USER MOD reduce.3.24.130724 H: found=0, std=0, add=1044, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 1040 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 45 THR OG1 : rot 150:sc= -0.573 USER MOD Set 1.2: A 103 SER OG : rot 180:sc= -0.489 USER MOD Set 2.1: A 34 GLN :FLIP amide:sc= -0.886 F(o=-1.7,f=-0.24) USER MOD Set 2.2: A 105 THR OG1 : rot 73:sc= 0.645 USER MOD Set 3.1: A 30 CYS SG : rot -18:sc= 0.584 USER MOD Set 3.2: A 31 ASN : amide:sc= 0.254 X(o=0.84,f=0.54) USER MOD Set 4.1: A 28 GLN : amide:sc= -0.35 K(o=-0.016,f=-1.1) USER MOD Set 4.2: A 32 TYR OH : rot 138:sc= -0.578 USER MOD Set 4.3: A 110 SER OG : rot 133:sc= 2.01 USER MOD Set 4.4: A 111 GLN : amide:sc= 0 X(o=-0.016,f=0.13) USER MOD Set 4.5: A 115 GLN : amide:sc= -1.1 K(o=-0.016,f=-9!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 ASN : amide:sc= -0.115 X(o=-0.12,f=-0.21) USER MOD Single : A 9 LYS NZ :NH3+ -166:sc=-0.00496 (180deg=-0.122) USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 HIS : no HD1:sc= -0.239 X(o=-0.24,f=-0.04) USER MOD Single : A 19 THR OG1 : rot -80:sc= 0.797 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 LYS NZ :NH3+ 166:sc= 0 (180deg=-0.301) USER MOD Single : A 27 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 29 SER OG : rot -150:sc= 0 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 ASN : amide:sc= -0.0142 X(o=-0.014,f=-0.16) USER MOD Single : A 43 THR OG1 : rot 69:sc= 0.801 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 ASN : amide:sc= -0.0528 X(o=-0.053,f=-0.053) USER MOD Single : A 51 SER OG : rot -150:sc= -0.177 USER MOD Single : A 56 MET CE :methyl -113:sc= -3.16! (180deg=-10.4!) USER MOD Single : A 68 HIS : no HD1:sc=-0.00787 X(o=-0.0079,f=-0.41) USER MOD Single : A 73 CYS SG : rot -100:sc= 0.599 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 80 TYR OH : rot 180:sc= -3.68! USER MOD Single : A 85 SER OG : rot 34:sc= 0.0658 USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 93 CYS SG : rot 86:sc= 0.16 USER MOD Single : A 96 SER OG : rot 180:sc= 0.0429 USER MOD Single : A 102 CYS SG : rot -42:sc= -0.576 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 GLN : amide:sc= -0.0153 K(o=-0.015,f=-1.4) USER MOD Single : A 117 GLN : amide:sc= 0 K(o=0,f=-0.73) USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 120 GLN : amide:sc= -0.0832 X(o=-0.083,f=0) USER MOD Single : A 121 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 122 SER OG : rot 180:sc= 0.00915 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -0.420 -2.960 15.921 1.00 0.00 N ATOM 2 CA MET A 1 -1.170 -2.838 14.677 1.00 52.33 C ATOM 3 C MET A 1 -0.652 -1.672 13.842 1.00 3.33 C ATOM 4 O MET A 1 -1.085 -0.531 14.013 1.00 65.14 O ATOM 5 CB MET A 1 -2.660 -2.647 14.972 1.00 10.31 C ATOM 6 CG MET A 1 -3.505 -3.869 14.649 1.00 11.34 C ATOM 7 SD MET A 1 -5.043 -3.916 15.589 1.00 60.45 S ATOM 8 CE MET A 1 -5.713 -5.491 15.061 1.00 61.14 C ATOM 0 H1 MET A 1 -0.790 -3.760 16.473 1.00 0.00 H new ATOM 0 H2 MET A 1 0.584 -3.123 15.706 1.00 0.00 H new ATOM 0 H3 MET A 1 -0.518 -2.084 16.473 1.00 0.00 H new ATOM 0 HA MET A 1 -1.034 -3.758 14.108 1.00 52.33 H new ATOM 0 HB2 MET A 1 -2.784 -2.398 16.026 1.00 10.31 H new ATOM 0 HB3 MET A 1 -3.030 -1.798 14.398 1.00 10.31 H new ATOM 0 HG2 MET A 1 -3.734 -3.876 13.583 1.00 11.34 H new ATOM 0 HG3 MET A 1 -2.928 -4.770 14.857 1.00 11.34 H new ATOM 0 HE1 MET A 1 -6.668 -5.665 15.557 1.00 61.14 H new ATOM 0 HE2 MET A 1 -5.862 -5.479 13.981 1.00 61.14 H new ATOM 0 HE3 MET A 1 -5.017 -6.288 15.323 1.00 61.14 H new ATOM 18 N THR A 2 0.278 -1.964 12.939 1.00 63.23 N ATOM 19 CA THR A 2 0.856 -0.939 12.077 1.00 31.24 C ATOM 20 C THR A 2 1.835 -1.548 11.080 1.00 41.22 C ATOM 21 O THR A 2 2.769 -2.252 11.463 1.00 11.20 O ATOM 22 CB THR A 2 1.585 0.140 12.901 1.00 72.33 C ATOM 23 OG1 THR A 2 2.294 1.027 12.028 1.00 60.54 O ATOM 24 CG2 THR A 2 2.556 -0.494 13.886 1.00 61.33 C ATOM 0 H THR A 2 0.648 -2.902 12.785 1.00 63.23 H new ATOM 0 HA THR A 2 0.030 -0.477 11.536 1.00 31.24 H new ATOM 0 HB THR A 2 0.839 0.702 13.463 1.00 72.33 H new ATOM 0 HG1 THR A 2 2.753 1.711 12.559 1.00 60.54 H new ATOM 0 HG21 THR A 2 3.058 0.288 14.456 1.00 61.33 H new ATOM 0 HG22 THR A 2 2.009 -1.146 14.568 1.00 61.33 H new ATOM 0 HG23 THR A 2 3.297 -1.079 13.341 1.00 61.33 H new ATOM 32 N GLU A 3 1.615 -1.272 9.798 1.00 42.31 N ATOM 33 CA GLU A 3 2.479 -1.793 8.745 1.00 32.32 C ATOM 34 C GLU A 3 2.149 -1.150 7.402 1.00 51.24 C ATOM 35 O GLU A 3 1.217 -1.566 6.715 1.00 1.32 O ATOM 36 CB GLU A 3 2.336 -3.313 8.644 1.00 54.01 C ATOM 37 CG GLU A 3 3.665 -4.047 8.581 1.00 11.22 C ATOM 38 CD GLU A 3 3.754 -5.181 9.583 1.00 62.43 C ATOM 39 OE1 GLU A 3 2.942 -6.125 9.482 1.00 72.42 O ATOM 40 OE2 GLU A 3 4.633 -5.126 10.466 1.00 21.42 O ATOM 0 H GLU A 3 0.846 -0.691 9.464 1.00 42.31 H new ATOM 0 HA GLU A 3 3.510 -1.548 9.001 1.00 32.32 H new ATOM 0 HB2 GLU A 3 1.772 -3.674 9.504 1.00 54.01 H new ATOM 0 HB3 GLU A 3 1.754 -3.556 7.755 1.00 54.01 H new ATOM 0 HG2 GLU A 3 3.809 -4.443 7.576 1.00 11.22 H new ATOM 0 HG3 GLU A 3 4.475 -3.341 8.765 1.00 11.22 H new ATOM 47 N ALA A 4 2.920 -0.131 7.035 1.00 50.12 N ATOM 48 CA ALA A 4 2.710 0.570 5.774 1.00 0.01 C ATOM 49 C ALA A 4 3.866 0.321 4.810 1.00 61.02 C ATOM 50 O ALA A 4 5.020 0.216 5.224 1.00 42.31 O ATOM 51 CB ALA A 4 2.538 2.061 6.021 1.00 53.04 C ATOM 0 H ALA A 4 3.695 0.227 7.593 1.00 50.12 H new ATOM 0 HA ALA A 4 1.799 0.182 5.317 1.00 0.01 H new ATOM 0 HB1 ALA A 4 2.382 2.572 5.071 1.00 53.04 H new ATOM 0 HB2 ALA A 4 1.676 2.226 6.667 1.00 53.04 H new ATOM 0 HB3 ALA A 4 3.433 2.456 6.502 1.00 53.04 H new ATOM 57 N ASP A 5 3.547 0.228 3.524 1.00 1.12 N ATOM 58 CA ASP A 5 4.559 -0.008 2.500 1.00 0.40 C ATOM 59 C ASP A 5 4.971 1.300 1.832 1.00 51.41 C ATOM 60 O ASP A 5 5.401 1.311 0.679 1.00 4.12 O ATOM 61 CB ASP A 5 4.034 -0.988 1.451 1.00 21.52 C ATOM 62 CG ASP A 5 3.773 -2.367 2.025 1.00 54.02 C ATOM 63 OD1 ASP A 5 3.767 -2.500 3.267 1.00 33.21 O ATOM 64 OD2 ASP A 5 3.573 -3.313 1.234 1.00 50.32 O ATOM 0 H ASP A 5 2.596 0.312 3.165 1.00 1.12 H new ATOM 0 HA ASP A 5 5.436 -0.440 2.983 1.00 0.40 H new ATOM 0 HB2 ASP A 5 3.112 -0.596 1.021 1.00 21.52 H new ATOM 0 HB3 ASP A 5 4.756 -1.067 0.638 1.00 21.52 H new ATOM 69 N VAL A 6 4.833 2.401 2.563 1.00 1.42 N ATOM 70 CA VAL A 6 5.190 3.715 2.042 1.00 25.33 C ATOM 71 C VAL A 6 5.940 4.536 3.085 1.00 32.02 C ATOM 72 O VAL A 6 5.445 4.755 4.189 1.00 34.45 O ATOM 73 CB VAL A 6 3.944 4.498 1.588 1.00 62.23 C ATOM 74 CG1 VAL A 6 3.364 3.889 0.320 1.00 41.04 C ATOM 75 CG2 VAL A 6 2.904 4.531 2.697 1.00 32.23 C ATOM 0 H VAL A 6 4.476 2.409 3.519 1.00 1.42 H new ATOM 0 HA VAL A 6 5.838 3.547 1.182 1.00 25.33 H new ATOM 0 HB VAL A 6 4.240 5.524 1.367 1.00 62.23 H new ATOM 0 HG11 VAL A 6 2.484 4.455 0.014 1.00 41.04 H new ATOM 0 HG12 VAL A 6 4.111 3.921 -0.474 1.00 41.04 H new ATOM 0 HG13 VAL A 6 3.081 2.854 0.510 1.00 41.04 H new ATOM 0 HG21 VAL A 6 2.030 5.088 2.360 1.00 32.23 H new ATOM 0 HG22 VAL A 6 2.610 3.512 2.950 1.00 32.23 H new ATOM 0 HG23 VAL A 6 3.326 5.016 3.577 1.00 32.23 H new ATOM 85 N ASN A 7 7.138 4.988 2.727 1.00 43.23 N ATOM 86 CA ASN A 7 7.956 5.785 3.633 1.00 1.21 C ATOM 87 C ASN A 7 8.586 6.966 2.900 1.00 1.41 C ATOM 88 O ASN A 7 9.609 6.838 2.227 1.00 60.43 O ATOM 89 CB ASN A 7 9.049 4.919 4.261 1.00 20.14 C ATOM 90 CG ASN A 7 9.654 3.942 3.271 1.00 51.32 C ATOM 91 OD1 ASN A 7 9.092 2.877 3.012 1.00 20.44 O ATOM 92 ND2 ASN A 7 10.804 4.301 2.713 1.00 61.33 N ATOM 0 H ASN A 7 7.563 4.816 1.816 1.00 43.23 H new ATOM 0 HA ASN A 7 7.310 6.172 4.421 1.00 1.21 H new ATOM 0 HB2 ASN A 7 9.834 5.562 4.659 1.00 20.14 H new ATOM 0 HB3 ASN A 7 8.632 4.367 5.103 1.00 20.14 H new ATOM 0 HD21 ASN A 7 11.258 3.685 2.039 1.00 61.33 H new ATOM 0 HD22 ASN A 7 11.233 5.193 2.958 1.00 61.33 H new ATOM 99 N PRO A 8 7.961 8.146 3.033 1.00 45.21 N ATOM 100 CA PRO A 8 8.444 9.373 2.392 1.00 51.24 C ATOM 101 C PRO A 8 9.741 9.880 3.012 1.00 23.40 C ATOM 102 O PRO A 8 10.359 9.197 3.829 1.00 22.14 O ATOM 103 CB PRO A 8 7.309 10.371 2.638 1.00 33.32 C ATOM 104 CG PRO A 8 6.624 9.872 3.864 1.00 22.33 C ATOM 105 CD PRO A 8 6.738 8.373 3.820 1.00 42.42 C ATOM 0 HA PRO A 8 8.675 9.218 1.338 1.00 51.24 H new ATOM 0 HB2 PRO A 8 7.694 11.380 2.783 1.00 33.32 H new ATOM 0 HB3 PRO A 8 6.625 10.409 1.790 1.00 33.32 H new ATOM 0 HG2 PRO A 8 7.092 10.273 4.763 1.00 22.33 H new ATOM 0 HG3 PRO A 8 5.580 10.184 3.882 1.00 22.33 H new ATOM 0 HD2 PRO A 8 6.819 7.947 4.820 1.00 42.42 H new ATOM 0 HD3 PRO A 8 5.867 7.918 3.349 1.00 42.42 H new ATOM 113 N LYS A 9 10.150 11.081 2.619 1.00 64.11 N ATOM 114 CA LYS A 9 11.375 11.680 3.136 1.00 42.54 C ATOM 115 C LYS A 9 11.154 12.246 4.535 1.00 3.34 C ATOM 116 O LYS A 9 12.097 12.388 5.313 1.00 51.43 O ATOM 117 CB LYS A 9 11.861 12.788 2.197 1.00 73.25 C ATOM 118 CG LYS A 9 12.524 12.266 0.934 1.00 23.13 C ATOM 119 CD LYS A 9 13.828 12.993 0.648 1.00 33.03 C ATOM 120 CE LYS A 9 13.578 14.375 0.063 1.00 25.52 C ATOM 121 NZ LYS A 9 13.097 14.302 -1.344 1.00 65.54 N ATOM 0 H LYS A 9 9.651 11.660 1.943 1.00 64.11 H new ATOM 0 HA LYS A 9 12.135 10.901 3.193 1.00 42.54 H new ATOM 0 HB2 LYS A 9 11.014 13.416 1.920 1.00 73.25 H new ATOM 0 HB3 LYS A 9 12.567 13.423 2.732 1.00 73.25 H new ATOM 0 HG2 LYS A 9 12.717 11.198 1.038 1.00 23.13 H new ATOM 0 HG3 LYS A 9 11.846 12.387 0.089 1.00 23.13 H new ATOM 0 HD2 LYS A 9 14.404 13.085 1.569 1.00 33.03 H new ATOM 0 HD3 LYS A 9 14.429 12.406 -0.047 1.00 33.03 H new ATOM 0 HE2 LYS A 9 12.842 14.899 0.672 1.00 25.52 H new ATOM 0 HE3 LYS A 9 14.498 14.958 0.103 1.00 25.52 H new ATOM 0 HZ1 LYS A 9 13.164 15.242 -1.783 1.00 65.54 H new ATOM 0 HZ2 LYS A 9 13.684 13.629 -1.877 1.00 65.54 H new ATOM 0 HZ3 LYS A 9 12.107 13.984 -1.356 1.00 65.54 H new ATOM 135 N ALA A 10 9.903 12.566 4.849 1.00 44.25 N ATOM 136 CA ALA A 10 9.558 13.113 6.155 1.00 4.14 C ATOM 137 C ALA A 10 9.102 12.013 7.108 1.00 41.32 C ATOM 138 O ALA A 10 8.203 12.219 7.924 1.00 23.21 O ATOM 139 CB ALA A 10 8.477 14.175 6.015 1.00 2.14 C ATOM 0 H ALA A 10 9.111 12.456 4.216 1.00 44.25 H new ATOM 0 HA ALA A 10 10.452 13.574 6.575 1.00 4.14 H new ATOM 0 HB1 ALA A 10 8.230 14.574 6.999 1.00 2.14 H new ATOM 0 HB2 ALA A 10 8.839 14.981 5.377 1.00 2.14 H new ATOM 0 HB3 ALA A 10 7.587 13.731 5.569 1.00 2.14 H new ATOM 145 N TYR A 11 9.725 10.845 6.997 1.00 3.15 N ATOM 146 CA TYR A 11 9.381 9.711 7.847 1.00 5.33 C ATOM 147 C TYR A 11 10.630 9.101 8.474 1.00 20.14 C ATOM 148 O TYR A 11 11.750 9.290 7.999 1.00 0.15 O ATOM 149 CB TYR A 11 8.632 8.651 7.039 1.00 5.15 C ATOM 150 CG TYR A 11 7.147 8.613 7.318 1.00 33.14 C ATOM 151 CD1 TYR A 11 6.365 9.753 7.180 1.00 63.52 C ATOM 152 CD2 TYR A 11 6.526 7.438 7.723 1.00 33.31 C ATOM 153 CE1 TYR A 11 5.007 9.723 7.435 1.00 43.13 C ATOM 154 CE2 TYR A 11 5.169 7.398 7.979 1.00 13.20 C ATOM 155 CZ TYR A 11 4.414 8.543 7.834 1.00 41.12 C ATOM 156 OH TYR A 11 3.062 8.509 8.090 1.00 21.34 O ATOM 0 H TYR A 11 10.471 10.659 6.327 1.00 3.15 H new ATOM 0 HA TYR A 11 8.735 10.072 8.647 1.00 5.33 H new ATOM 0 HB2 TYR A 11 8.789 8.838 5.977 1.00 5.15 H new ATOM 0 HB3 TYR A 11 9.059 7.672 7.256 1.00 5.15 H new ATOM 0 HD1 TYR A 11 6.826 10.678 6.868 1.00 63.52 H new ATOM 0 HD2 TYR A 11 7.115 6.540 7.840 1.00 33.31 H new ATOM 0 HE1 TYR A 11 4.413 10.618 7.323 1.00 43.13 H new ATOM 0 HE2 TYR A 11 4.702 6.475 8.291 1.00 13.20 H new ATOM 0 HH TYR A 11 2.803 7.603 8.359 1.00 21.34 H new ATOM 166 N PRO A 12 10.436 8.350 9.568 1.00 52.23 N ATOM 167 CA PRO A 12 9.108 8.119 10.143 1.00 51.35 C ATOM 168 C PRO A 12 8.525 9.375 10.782 1.00 20.14 C ATOM 169 O PRO A 12 9.257 10.303 11.129 1.00 13.24 O ATOM 170 CB PRO A 12 9.362 7.047 11.206 1.00 41.01 C ATOM 171 CG PRO A 12 10.795 7.218 11.579 1.00 74.54 C ATOM 172 CD PRO A 12 11.496 7.670 10.329 1.00 21.35 C ATOM 0 HA PRO A 12 8.383 7.824 9.385 1.00 51.35 H new ATOM 0 HB2 PRO A 12 8.709 7.182 12.068 1.00 41.01 H new ATOM 0 HB3 PRO A 12 9.171 6.048 10.815 1.00 41.01 H new ATOM 0 HG2 PRO A 12 10.906 7.953 12.376 1.00 74.54 H new ATOM 0 HG3 PRO A 12 11.217 6.283 11.947 1.00 74.54 H new ATOM 0 HD2 PRO A 12 12.324 8.343 10.554 1.00 21.35 H new ATOM 0 HD3 PRO A 12 11.911 6.828 9.775 1.00 21.35 H new ATOM 180 N LEU A 13 7.206 9.399 10.935 1.00 52.12 N ATOM 181 CA LEU A 13 6.526 10.542 11.534 1.00 42.14 C ATOM 182 C LEU A 13 5.561 10.091 12.626 1.00 63.43 C ATOM 183 O LEU A 13 4.817 9.125 12.451 1.00 43.44 O ATOM 184 CB LEU A 13 5.768 11.328 10.463 1.00 65.21 C ATOM 185 CG LEU A 13 4.865 12.454 10.968 1.00 31.50 C ATOM 186 CD1 LEU A 13 5.699 13.604 11.511 1.00 34.03 C ATOM 187 CD2 LEU A 13 3.945 12.938 9.856 1.00 15.23 C ATOM 0 H LEU A 13 6.586 8.640 10.653 1.00 52.12 H new ATOM 0 HA LEU A 13 7.281 11.187 11.984 1.00 42.14 H new ATOM 0 HB2 LEU A 13 6.495 11.755 9.772 1.00 65.21 H new ATOM 0 HB3 LEU A 13 5.158 10.629 9.892 1.00 65.21 H new ATOM 0 HG LEU A 13 4.249 12.065 11.779 1.00 31.50 H new ATOM 0 HD11 LEU A 13 5.039 14.396 11.866 1.00 34.03 H new ATOM 0 HD12 LEU A 13 6.316 13.248 12.336 1.00 34.03 H new ATOM 0 HD13 LEU A 13 6.341 13.993 10.720 1.00 34.03 H new ATOM 0 HD21 LEU A 13 3.309 13.739 10.233 1.00 15.23 H new ATOM 0 HD22 LEU A 13 4.544 13.310 9.025 1.00 15.23 H new ATOM 0 HD23 LEU A 13 3.322 12.112 9.513 1.00 15.23 H new ATOM 199 N ALA A 14 5.577 10.797 13.752 1.00 64.01 N ATOM 200 CA ALA A 14 4.701 10.472 14.871 1.00 60.54 C ATOM 201 C ALA A 14 3.235 10.649 14.489 1.00 70.11 C ATOM 202 O ALA A 14 2.807 11.744 14.124 1.00 10.14 O ATOM 203 CB ALA A 14 5.043 11.334 16.076 1.00 11.02 C ATOM 0 H ALA A 14 6.187 11.598 13.913 1.00 64.01 H new ATOM 0 HA ALA A 14 4.857 9.425 15.132 1.00 60.54 H new ATOM 0 HB1 ALA A 14 4.381 11.081 16.904 1.00 11.02 H new ATOM 0 HB2 ALA A 14 6.077 11.155 16.370 1.00 11.02 H new ATOM 0 HB3 ALA A 14 4.916 12.386 15.819 1.00 11.02 H new ATOM 209 N ASP A 15 2.471 9.566 14.576 1.00 32.01 N ATOM 210 CA ASP A 15 1.052 9.602 14.240 1.00 23.30 C ATOM 211 C ASP A 15 0.284 10.480 15.222 1.00 14.35 C ATOM 212 O ASP A 15 0.869 11.079 16.124 1.00 43.51 O ATOM 213 CB ASP A 15 0.471 8.187 14.239 1.00 51.23 C ATOM 214 CG ASP A 15 0.853 7.403 15.478 1.00 73.34 C ATOM 215 OD1 ASP A 15 1.969 6.844 15.506 1.00 33.11 O ATOM 216 OD2 ASP A 15 0.036 7.349 16.422 1.00 64.34 O ATOM 0 H ASP A 15 2.810 8.652 14.876 1.00 32.01 H new ATOM 0 HA ASP A 15 0.950 10.029 13.242 1.00 23.30 H new ATOM 0 HB2 ASP A 15 -0.615 8.244 14.169 1.00 51.23 H new ATOM 0 HB3 ASP A 15 0.820 7.655 13.354 1.00 51.23 H new ATOM 221 N ALA A 16 -1.030 10.553 15.040 1.00 70.34 N ATOM 222 CA ALA A 16 -1.879 11.357 15.910 1.00 14.12 C ATOM 223 C ALA A 16 -1.895 10.799 17.329 1.00 35.11 C ATOM 224 O ALA A 16 -2.015 11.548 18.300 1.00 71.41 O ATOM 225 CB ALA A 16 -3.293 11.425 15.352 1.00 55.14 C ATOM 0 H ALA A 16 -1.530 10.065 14.297 1.00 70.34 H new ATOM 0 HA ALA A 16 -1.466 12.365 15.948 1.00 14.12 H new ATOM 0 HB1 ALA A 16 -3.916 12.029 16.012 1.00 55.14 H new ATOM 0 HB2 ALA A 16 -3.271 11.877 14.360 1.00 55.14 H new ATOM 0 HB3 ALA A 16 -3.706 10.419 15.284 1.00 55.14 H new ATOM 231 N HIS A 17 -1.775 9.480 17.444 1.00 2.14 N ATOM 232 CA HIS A 17 -1.775 8.823 18.746 1.00 32.12 C ATOM 233 C HIS A 17 -0.402 8.923 19.406 1.00 73.00 C ATOM 234 O HIS A 17 -0.292 8.943 20.633 1.00 62.44 O ATOM 235 CB HIS A 17 -2.176 7.355 18.599 1.00 14.30 C ATOM 236 CG HIS A 17 -2.935 6.821 19.775 1.00 51.52 C ATOM 237 ND1 HIS A 17 -2.758 5.547 20.270 1.00 73.52 N ATOM 238 CD2 HIS A 17 -3.877 7.398 20.557 1.00 43.21 C ATOM 239 CE1 HIS A 17 -3.559 5.362 21.304 1.00 40.13 C ATOM 240 NE2 HIS A 17 -4.249 6.471 21.500 1.00 65.30 N ATOM 0 H HIS A 17 -1.677 8.846 16.651 1.00 2.14 H new ATOM 0 HA HIS A 17 -2.502 9.330 19.381 1.00 32.12 H new ATOM 0 HB2 HIS A 17 -2.785 7.241 17.702 1.00 14.30 H new ATOM 0 HB3 HIS A 17 -1.278 6.754 18.453 1.00 14.30 H new ATOM 0 HD2 HIS A 17 -4.264 8.401 20.458 1.00 43.21 H new ATOM 0 HE1 HIS A 17 -3.636 4.458 21.889 1.00 40.13 H new ATOM 0 HE2 HIS A 17 -4.944 6.616 22.232 1.00 65.30 H new ATOM 248 N LEU A 18 0.640 8.986 18.585 1.00 70.40 N ATOM 249 CA LEU A 18 2.005 9.083 19.089 1.00 3.24 C ATOM 250 C LEU A 18 2.339 10.519 19.482 1.00 34.33 C ATOM 251 O LEU A 18 2.972 10.761 20.511 1.00 51.23 O ATOM 252 CB LEU A 18 2.996 8.588 18.033 1.00 33.23 C ATOM 253 CG LEU A 18 3.706 7.269 18.345 1.00 4.54 C ATOM 254 CD1 LEU A 18 4.416 6.741 17.108 1.00 1.13 C ATOM 255 CD2 LEU A 18 4.691 7.452 19.491 1.00 44.25 C ATOM 0 H LEU A 18 0.566 8.972 17.568 1.00 70.40 H new ATOM 0 HA LEU A 18 2.084 8.455 19.976 1.00 3.24 H new ATOM 0 HB2 LEU A 18 2.464 8.477 17.088 1.00 33.23 H new ATOM 0 HB3 LEU A 18 3.753 9.358 17.884 1.00 33.23 H new ATOM 0 HG LEU A 18 2.957 6.538 18.650 1.00 4.54 H new ATOM 0 HD11 LEU A 18 4.916 5.802 17.348 1.00 1.13 H new ATOM 0 HD12 LEU A 18 3.688 6.572 16.315 1.00 1.13 H new ATOM 0 HD13 LEU A 18 5.154 7.470 16.773 1.00 1.13 H new ATOM 0 HD21 LEU A 18 5.187 6.504 19.699 1.00 44.25 H new ATOM 0 HD22 LEU A 18 5.436 8.198 19.215 1.00 44.25 H new ATOM 0 HD23 LEU A 18 4.156 7.785 20.381 1.00 44.25 H new ATOM 267 N THR A 19 1.909 11.468 18.659 1.00 72.05 N ATOM 268 CA THR A 19 2.160 12.880 18.921 1.00 63.41 C ATOM 269 C THR A 19 1.657 13.280 20.303 1.00 22.40 C ATOM 270 O THR A 19 2.221 14.165 20.947 1.00 42.31 O ATOM 271 CB THR A 19 1.487 13.776 17.863 1.00 22.13 C ATOM 272 OG1 THR A 19 0.172 13.291 17.575 1.00 74.23 O ATOM 273 CG2 THR A 19 2.311 13.815 16.585 1.00 65.41 C ATOM 0 H THR A 19 1.384 11.285 17.804 1.00 72.05 H new ATOM 0 HA THR A 19 3.240 13.023 18.874 1.00 63.41 H new ATOM 0 HB THR A 19 1.420 14.787 18.264 1.00 22.13 H new ATOM 0 HG1 THR A 19 0.230 12.539 16.949 1.00 74.23 H new ATOM 0 HG21 THR A 19 1.817 14.453 15.853 1.00 65.41 H new ATOM 0 HG22 THR A 19 3.302 14.213 16.803 1.00 65.41 H new ATOM 0 HG23 THR A 19 2.406 12.807 16.182 1.00 65.41 H new ATOM 281 N LYS A 20 0.595 12.622 20.755 1.00 10.14 N ATOM 282 CA LYS A 20 0.018 12.908 22.063 1.00 33.02 C ATOM 283 C LYS A 20 1.056 12.732 23.166 1.00 11.13 C ATOM 284 O LYS A 20 1.284 13.639 23.968 1.00 71.41 O ATOM 285 CB LYS A 20 -1.181 11.992 22.325 1.00 25.55 C ATOM 286 CG LYS A 20 -1.989 12.383 23.550 1.00 1.52 C ATOM 287 CD LYS A 20 -2.345 11.171 24.394 1.00 40.50 C ATOM 288 CE LYS A 20 -2.667 11.565 25.827 1.00 21.42 C ATOM 289 NZ LYS A 20 -3.860 10.841 26.347 1.00 10.23 N ATOM 0 H LYS A 20 0.116 11.887 20.235 1.00 10.14 H new ATOM 0 HA LYS A 20 -0.317 13.945 22.066 1.00 33.02 H new ATOM 0 HB2 LYS A 20 -1.833 12.002 21.452 1.00 25.55 H new ATOM 0 HB3 LYS A 20 -0.826 10.969 22.446 1.00 25.55 H new ATOM 0 HG2 LYS A 20 -1.420 13.092 24.151 1.00 1.52 H new ATOM 0 HG3 LYS A 20 -2.902 12.891 23.238 1.00 1.52 H new ATOM 0 HD2 LYS A 20 -3.202 10.659 23.955 1.00 40.50 H new ATOM 0 HD3 LYS A 20 -1.514 10.465 24.387 1.00 40.50 H new ATOM 0 HE2 LYS A 20 -1.808 11.353 26.464 1.00 21.42 H new ATOM 0 HE3 LYS A 20 -2.844 12.639 25.877 1.00 21.42 H new ATOM 0 HZ1 LYS A 20 -4.046 11.137 27.326 1.00 10.23 H new ATOM 0 HZ2 LYS A 20 -4.686 11.063 25.755 1.00 10.23 H new ATOM 0 HZ3 LYS A 20 -3.682 9.817 26.323 1.00 10.23 H new ATOM 303 N LYS A 21 1.683 11.562 23.202 1.00 4.25 N ATOM 304 CA LYS A 21 2.700 11.268 24.205 1.00 24.40 C ATOM 305 C LYS A 21 4.014 11.967 23.869 1.00 13.33 C ATOM 306 O LYS A 21 4.758 12.375 24.762 1.00 75.51 O ATOM 307 CB LYS A 21 2.925 9.757 24.305 1.00 2.20 C ATOM 308 CG LYS A 21 3.334 9.115 22.991 1.00 30.10 C ATOM 309 CD LYS A 21 3.530 7.615 23.141 1.00 1.33 C ATOM 310 CE LYS A 21 4.986 7.269 23.415 1.00 31.42 C ATOM 311 NZ LYS A 21 5.248 7.086 24.870 1.00 65.32 N ATOM 0 H LYS A 21 1.505 10.800 22.547 1.00 4.25 H new ATOM 0 HA LYS A 21 2.346 11.641 25.166 1.00 24.40 H new ATOM 0 HB2 LYS A 21 3.696 9.561 25.051 1.00 2.20 H new ATOM 0 HB3 LYS A 21 2.010 9.285 24.661 1.00 2.20 H new ATOM 0 HG2 LYS A 21 2.571 9.310 22.237 1.00 30.10 H new ATOM 0 HG3 LYS A 21 4.258 9.570 22.635 1.00 30.10 H new ATOM 0 HD2 LYS A 21 2.907 7.245 23.956 1.00 1.33 H new ATOM 0 HD3 LYS A 21 3.200 7.111 22.233 1.00 1.33 H new ATOM 0 HE2 LYS A 21 5.249 6.356 22.881 1.00 31.42 H new ATOM 0 HE3 LYS A 21 5.627 8.061 23.027 1.00 31.42 H new ATOM 0 HZ1 LYS A 21 6.172 6.626 25.001 1.00 65.32 H new ATOM 0 HZ2 LYS A 21 5.252 8.013 25.341 1.00 65.32 H new ATOM 0 HZ3 LYS A 21 4.503 6.491 25.285 1.00 65.32 H new ATOM 325 N LEU A 22 4.292 12.104 22.578 1.00 43.41 N ATOM 326 CA LEU A 22 5.516 12.756 22.123 1.00 55.43 C ATOM 327 C LEU A 22 5.563 14.209 22.587 1.00 14.21 C ATOM 328 O LEU A 22 6.545 14.649 23.187 1.00 31.02 O ATOM 329 CB LEU A 22 5.616 12.693 20.599 1.00 21.21 C ATOM 330 CG LEU A 22 6.943 13.150 19.993 1.00 0.42 C ATOM 331 CD1 LEU A 22 8.041 12.141 20.289 1.00 33.14 C ATOM 332 CD2 LEU A 22 6.801 13.362 18.494 1.00 44.21 C ATOM 0 H LEU A 22 3.687 11.773 21.827 1.00 43.41 H new ATOM 0 HA LEU A 22 6.363 12.226 22.558 1.00 55.43 H new ATOM 0 HB2 LEU A 22 5.431 11.666 20.285 1.00 21.21 H new ATOM 0 HB3 LEU A 22 4.818 13.304 20.177 1.00 21.21 H new ATOM 0 HG LEU A 22 7.219 14.101 20.449 1.00 0.42 H new ATOM 0 HD11 LEU A 22 8.978 12.483 19.850 1.00 33.14 H new ATOM 0 HD12 LEU A 22 8.161 12.040 21.368 1.00 33.14 H new ATOM 0 HD13 LEU A 22 7.772 11.175 19.862 1.00 33.14 H new ATOM 0 HD21 LEU A 22 7.756 13.687 18.080 1.00 44.21 H new ATOM 0 HD22 LEU A 22 6.500 12.427 18.021 1.00 44.21 H new ATOM 0 HD23 LEU A 22 6.045 14.124 18.304 1.00 44.21 H new ATOM 344 N LEU A 23 4.496 14.949 22.308 1.00 73.32 N ATOM 345 CA LEU A 23 4.414 16.352 22.699 1.00 44.15 C ATOM 346 C LEU A 23 4.447 16.497 24.216 1.00 0.33 C ATOM 347 O LEU A 23 5.025 17.447 24.746 1.00 22.12 O ATOM 348 CB LEU A 23 3.136 16.982 22.143 1.00 51.40 C ATOM 349 CG LEU A 23 3.261 17.665 20.781 1.00 62.33 C ATOM 350 CD1 LEU A 23 1.894 17.817 20.131 1.00 11.21 C ATOM 351 CD2 LEU A 23 3.940 19.019 20.922 1.00 14.51 C ATOM 0 H LEU A 23 3.675 14.601 21.812 1.00 73.32 H new ATOM 0 HA LEU A 23 5.278 16.871 22.284 1.00 44.15 H new ATOM 0 HB2 LEU A 23 2.375 16.205 22.069 1.00 51.40 H new ATOM 0 HB3 LEU A 23 2.774 17.716 22.863 1.00 51.40 H new ATOM 0 HG LEU A 23 3.878 17.037 20.138 1.00 62.33 H new ATOM 0 HD11 LEU A 23 2.004 18.305 19.163 1.00 11.21 H new ATOM 0 HD12 LEU A 23 1.445 16.833 19.993 1.00 11.21 H new ATOM 0 HD13 LEU A 23 1.252 18.422 20.771 1.00 11.21 H new ATOM 0 HD21 LEU A 23 4.020 19.490 19.942 1.00 14.51 H new ATOM 0 HD22 LEU A 23 3.351 19.655 21.583 1.00 14.51 H new ATOM 0 HD23 LEU A 23 4.937 18.884 21.342 1.00 14.51 H new ATOM 363 N ASP A 24 3.827 15.551 24.911 1.00 62.41 N ATOM 364 CA ASP A 24 3.789 15.571 26.369 1.00 44.43 C ATOM 365 C ASP A 24 5.199 15.526 26.950 1.00 23.33 C ATOM 366 O ASP A 24 5.460 16.082 28.017 1.00 23.41 O ATOM 367 CB ASP A 24 2.969 14.392 26.896 1.00 43.13 C ATOM 368 CG ASP A 24 1.987 14.806 27.974 1.00 4.33 C ATOM 369 OD1 ASP A 24 0.875 15.254 27.625 1.00 53.21 O ATOM 370 OD2 ASP A 24 2.332 14.682 29.167 1.00 15.02 O ATOM 0 H ASP A 24 3.343 14.759 24.488 1.00 62.41 H new ATOM 0 HA ASP A 24 3.316 16.501 26.683 1.00 44.43 H new ATOM 0 HB2 ASP A 24 2.425 13.933 26.070 1.00 43.13 H new ATOM 0 HB3 ASP A 24 3.643 13.634 27.294 1.00 43.13 H new ATOM 375 N LEU A 25 6.104 14.859 26.241 1.00 34.43 N ATOM 376 CA LEU A 25 7.488 14.739 26.687 1.00 0.43 C ATOM 377 C LEU A 25 8.123 16.115 26.865 1.00 75.20 C ATOM 378 O LEU A 25 8.921 16.328 27.778 1.00 34.53 O ATOM 379 CB LEU A 25 8.298 13.917 25.683 1.00 5.33 C ATOM 380 CG LEU A 25 9.377 13.010 26.275 1.00 63.43 C ATOM 381 CD1 LEU A 25 10.317 13.806 27.165 1.00 14.51 C ATOM 382 CD2 LEU A 25 8.742 11.866 27.053 1.00 15.33 C ATOM 0 H LEU A 25 5.904 14.393 25.356 1.00 34.43 H new ATOM 0 HA LEU A 25 7.491 14.230 27.651 1.00 0.43 H new ATOM 0 HB2 LEU A 25 7.608 13.300 25.108 1.00 5.33 H new ATOM 0 HB3 LEU A 25 8.773 14.603 24.981 1.00 5.33 H new ATOM 0 HG LEU A 25 9.959 12.588 25.456 1.00 63.43 H new ATOM 0 HD11 LEU A 25 11.077 13.142 27.577 1.00 14.51 H new ATOM 0 HD12 LEU A 25 10.798 14.589 26.578 1.00 14.51 H new ATOM 0 HD13 LEU A 25 9.751 14.258 27.979 1.00 14.51 H new ATOM 0 HD21 LEU A 25 9.524 11.230 27.468 1.00 15.33 H new ATOM 0 HD22 LEU A 25 8.135 12.270 27.863 1.00 15.33 H new ATOM 0 HD23 LEU A 25 8.112 11.278 26.386 1.00 15.33 H new ATOM 394 N VAL A 26 7.761 17.047 25.990 1.00 44.23 N ATOM 395 CA VAL A 26 8.292 18.403 26.053 1.00 53.00 C ATOM 396 C VAL A 26 7.898 19.087 27.358 1.00 25.52 C ATOM 397 O VAL A 26 8.747 19.632 28.064 1.00 72.32 O ATOM 398 CB VAL A 26 7.797 19.256 24.869 1.00 74.04 C ATOM 399 CG1 VAL A 26 8.506 20.600 24.845 1.00 13.42 C ATOM 400 CG2 VAL A 26 7.998 18.513 23.557 1.00 1.44 C ATOM 0 H VAL A 26 7.102 16.888 25.228 1.00 44.23 H new ATOM 0 HA VAL A 26 9.378 18.320 26.002 1.00 53.00 H new ATOM 0 HB VAL A 26 6.730 19.439 24.997 1.00 74.04 H new ATOM 0 HG11 VAL A 26 8.143 21.188 24.002 1.00 13.42 H new ATOM 0 HG12 VAL A 26 8.305 21.134 25.773 1.00 13.42 H new ATOM 0 HG13 VAL A 26 9.580 20.443 24.742 1.00 13.42 H new ATOM 0 HG21 VAL A 26 7.643 19.130 22.731 1.00 1.44 H new ATOM 0 HG22 VAL A 26 9.058 18.298 23.420 1.00 1.44 H new ATOM 0 HG23 VAL A 26 7.438 17.578 23.579 1.00 1.44 H new ATOM 410 N GLN A 27 6.607 19.055 27.670 1.00 34.13 N ATOM 411 CA GLN A 27 6.102 19.672 28.891 1.00 30.22 C ATOM 412 C GLN A 27 6.675 18.985 30.126 1.00 5.35 C ATOM 413 O GLN A 27 6.877 19.619 31.162 1.00 33.34 O ATOM 414 CB GLN A 27 4.574 19.613 28.923 1.00 71.23 C ATOM 415 CG GLN A 27 3.922 20.013 27.610 1.00 24.31 C ATOM 416 CD GLN A 27 2.509 20.532 27.793 1.00 34.33 C ATOM 417 OE1 GLN A 27 2.189 21.650 27.392 1.00 2.11 O ATOM 418 NE2 GLN A 27 1.654 19.719 28.403 1.00 22.53 N ATOM 0 H GLN A 27 5.892 18.609 27.095 1.00 34.13 H new ATOM 0 HA GLN A 27 6.419 20.715 28.898 1.00 30.22 H new ATOM 0 HB2 GLN A 27 4.263 18.600 29.180 1.00 71.23 H new ATOM 0 HB3 GLN A 27 4.210 20.268 29.714 1.00 71.23 H new ATOM 0 HG2 GLN A 27 4.527 20.781 27.128 1.00 24.31 H new ATOM 0 HG3 GLN A 27 3.905 19.153 26.941 1.00 24.31 H new ATOM 0 HE21 GLN A 27 1.962 18.800 28.720 1.00 22.53 H new ATOM 0 HE22 GLN A 27 0.689 20.014 28.555 1.00 22.53 H new ATOM 427 N GLN A 28 6.935 17.687 30.009 1.00 71.30 N ATOM 428 CA GLN A 28 7.484 16.915 31.117 1.00 1.03 C ATOM 429 C GLN A 28 8.963 17.226 31.317 1.00 2.23 C ATOM 430 O GLN A 28 9.471 17.182 32.438 1.00 23.33 O ATOM 431 CB GLN A 28 7.296 15.417 30.865 1.00 53.40 C ATOM 432 CG GLN A 28 5.886 14.925 31.152 1.00 11.52 C ATOM 433 CD GLN A 28 5.845 13.458 31.530 1.00 64.12 C ATOM 434 OE1 GLN A 28 5.665 12.590 30.675 1.00 12.21 O ATOM 435 NE2 GLN A 28 6.013 13.172 32.815 1.00 0.54 N ATOM 0 H GLN A 28 6.774 17.148 29.158 1.00 71.30 H new ATOM 0 HA GLN A 28 6.947 17.195 32.023 1.00 1.03 H new ATOM 0 HB2 GLN A 28 7.544 15.198 29.827 1.00 53.40 H new ATOM 0 HB3 GLN A 28 7.999 14.861 31.485 1.00 53.40 H new ATOM 0 HG2 GLN A 28 5.457 15.517 31.960 1.00 11.52 H new ATOM 0 HG3 GLN A 28 5.263 15.087 30.273 1.00 11.52 H new ATOM 0 HE21 GLN A 28 6.159 13.923 33.490 1.00 0.54 H new ATOM 0 HE22 GLN A 28 5.996 12.201 33.128 1.00 0.54 H new ATOM 444 N SER A 29 9.651 17.541 30.223 1.00 52.41 N ATOM 445 CA SER A 29 11.073 17.856 30.278 1.00 12.11 C ATOM 446 C SER A 29 11.307 19.194 30.975 1.00 71.34 C ATOM 447 O SER A 29 12.106 19.289 31.906 1.00 13.34 O ATOM 448 CB SER A 29 11.663 17.893 28.868 1.00 25.41 C ATOM 449 OG SER A 29 12.378 16.702 28.583 1.00 72.54 O ATOM 0 H SER A 29 9.246 17.585 29.288 1.00 52.41 H new ATOM 0 HA SER A 29 11.571 17.075 30.852 1.00 12.11 H new ATOM 0 HB2 SER A 29 10.863 18.024 28.139 1.00 25.41 H new ATOM 0 HB3 SER A 29 12.327 18.752 28.771 1.00 25.41 H new ATOM 0 HG SER A 29 13.103 16.898 27.954 1.00 72.54 H new ATOM 455 N CYS A 30 10.604 20.223 30.515 1.00 34.21 N ATOM 456 CA CYS A 30 10.735 21.556 31.092 1.00 5.42 C ATOM 457 C CYS A 30 10.268 21.569 32.544 1.00 70.32 C ATOM 458 O CYS A 30 10.722 22.384 33.346 1.00 43.50 O ATOM 459 CB CYS A 30 9.930 22.569 30.277 1.00 65.52 C ATOM 460 SG CYS A 30 8.139 22.338 30.374 1.00 1.30 S ATOM 0 H CYS A 30 9.938 20.160 29.745 1.00 34.21 H new ATOM 0 HA CYS A 30 11.789 21.834 31.065 1.00 5.42 H new ATOM 0 HB2 CYS A 30 10.175 23.574 30.622 1.00 65.52 H new ATOM 0 HB3 CYS A 30 10.238 22.506 29.233 1.00 65.52 H new ATOM 0 HG CYS A 30 7.879 21.139 30.803 1.00 1.30 H new ATOM 466 N ASN A 31 9.357 20.659 32.875 1.00 64.14 N ATOM 467 CA ASN A 31 8.827 20.567 34.230 1.00 72.13 C ATOM 468 C ASN A 31 9.896 20.073 35.201 1.00 71.32 C ATOM 469 O ASN A 31 9.846 20.363 36.396 1.00 42.42 O ATOM 470 CB ASN A 31 7.618 19.629 34.264 1.00 21.35 C ATOM 471 CG ASN A 31 6.312 20.374 34.460 1.00 23.13 C ATOM 472 OD1 ASN A 31 5.693 20.296 35.521 1.00 64.05 O ATOM 473 ND2 ASN A 31 5.889 21.103 33.434 1.00 41.13 N ATOM 0 H ASN A 31 8.971 19.976 32.224 1.00 64.14 H new ATOM 0 HA ASN A 31 8.514 21.564 34.539 1.00 72.13 H new ATOM 0 HB2 ASN A 31 7.574 19.064 33.333 1.00 21.35 H new ATOM 0 HB3 ASN A 31 7.745 18.906 35.070 1.00 21.35 H new ATOM 0 HD21 ASN A 31 5.018 21.628 33.506 1.00 41.13 H new ATOM 0 HD22 ASN A 31 6.435 21.138 32.573 1.00 41.13 H new ATOM 480 N TYR A 32 10.860 19.325 34.678 1.00 24.25 N ATOM 481 CA TYR A 32 11.942 18.789 35.498 1.00 62.15 C ATOM 482 C TYR A 32 13.172 19.689 35.432 1.00 74.40 C ATOM 483 O TYR A 32 14.300 19.233 35.624 1.00 35.01 O ATOM 484 CB TYR A 32 12.303 17.375 35.039 1.00 13.15 C ATOM 485 CG TYR A 32 11.441 16.299 35.658 1.00 12.14 C ATOM 486 CD1 TYR A 32 11.462 16.068 37.029 1.00 52.33 C ATOM 487 CD2 TYR A 32 10.608 15.512 34.874 1.00 73.54 C ATOM 488 CE1 TYR A 32 10.676 15.086 37.599 1.00 32.53 C ATOM 489 CE2 TYR A 32 9.818 14.528 35.436 1.00 34.31 C ATOM 490 CZ TYR A 32 9.856 14.318 36.799 1.00 14.00 C ATOM 491 OH TYR A 32 9.071 13.337 37.362 1.00 12.15 O ATOM 0 H TYR A 32 10.916 19.075 33.691 1.00 24.25 H new ATOM 0 HA TYR A 32 11.598 18.751 36.532 1.00 62.15 H new ATOM 0 HB2 TYR A 32 12.214 17.321 33.954 1.00 13.15 H new ATOM 0 HB3 TYR A 32 13.347 17.178 35.284 1.00 13.15 H new ATOM 0 HD1 TYR A 32 12.104 16.667 37.659 1.00 52.33 H new ATOM 0 HD2 TYR A 32 10.577 15.672 33.806 1.00 73.54 H new ATOM 0 HE1 TYR A 32 10.703 14.920 38.666 1.00 32.53 H new ATOM 0 HE2 TYR A 32 9.174 13.926 34.812 1.00 34.31 H new ATOM 0 HH TYR A 32 8.183 13.351 36.948 1.00 12.15 H new ATOM 501 N LYS A 33 12.947 20.969 35.160 1.00 22.34 N ATOM 502 CA LYS A 33 14.035 21.936 35.070 1.00 22.43 C ATOM 503 C LYS A 33 15.044 21.520 34.004 1.00 2.25 C ATOM 504 O LYS A 33 16.252 21.658 34.195 1.00 22.44 O ATOM 505 CB LYS A 33 14.735 22.073 36.424 1.00 30.12 C ATOM 506 CG LYS A 33 13.776 22.245 37.590 1.00 3.11 C ATOM 507 CD LYS A 33 14.497 22.724 38.839 1.00 24.41 C ATOM 508 CE LYS A 33 14.695 24.231 38.824 1.00 1.44 C ATOM 509 NZ LYS A 33 14.324 24.852 40.126 1.00 1.24 N ATOM 0 H LYS A 33 12.020 21.362 34.998 1.00 22.34 H new ATOM 0 HA LYS A 33 13.611 22.900 34.788 1.00 22.43 H new ATOM 0 HB2 LYS A 33 15.349 21.189 36.597 1.00 30.12 H new ATOM 0 HB3 LYS A 33 15.410 22.929 36.390 1.00 30.12 H new ATOM 0 HG2 LYS A 33 12.999 22.960 37.321 1.00 3.11 H new ATOM 0 HG3 LYS A 33 13.279 21.297 37.797 1.00 3.11 H new ATOM 0 HD2 LYS A 33 13.925 22.440 39.722 1.00 24.41 H new ATOM 0 HD3 LYS A 33 15.465 22.229 38.914 1.00 24.41 H new ATOM 0 HE2 LYS A 33 15.737 24.458 38.597 1.00 1.44 H new ATOM 0 HE3 LYS A 33 14.092 24.669 38.028 1.00 1.44 H new ATOM 0 HZ1 LYS A 33 14.473 25.880 40.075 1.00 1.24 H new ATOM 0 HZ2 LYS A 33 13.323 24.657 40.331 1.00 1.24 H new ATOM 0 HZ3 LYS A 33 14.916 24.453 40.882 1.00 1.24 H new ATOM 523 N GLN A 34 14.541 21.015 32.883 1.00 2.13 N ATOM 524 CA GLN A 34 15.400 20.582 31.787 1.00 22.10 C ATOM 525 C GLN A 34 14.764 20.902 30.439 1.00 61.43 C ATOM 526 O GLN A 34 13.576 20.655 30.226 1.00 14.10 O ATOM 527 CB GLN A 34 15.677 19.081 31.891 1.00 12.34 C ATOM 528 CG GLN A 34 17.117 18.752 32.251 1.00 0.32 C ATOM 529 CD GLN A 34 17.339 17.269 32.473 1.00 13.32 C ATOM 530 OE1 GLN A 34 16.810 16.450 31.572 1.00 63.45 O flip ATOM 531 NE2 GLN A 34 17.980 16.864 33.444 1.00 72.13 N flip ATOM 0 H GLN A 34 13.543 20.895 32.709 1.00 2.13 H new ATOM 0 HA GLN A 34 16.343 21.124 31.861 1.00 22.10 H new ATOM 0 HB2 GLN A 34 15.016 18.649 32.642 1.00 12.34 H new ATOM 0 HB3 GLN A 34 15.432 18.608 30.940 1.00 12.34 H new ATOM 0 HG2 GLN A 34 17.775 19.099 31.454 1.00 0.32 H new ATOM 0 HG3 GLN A 34 17.395 19.296 33.153 1.00 0.32 H new ATOM 0 HE21 GLN A 34 18.369 17.530 34.112 1.00 72.13 H new ATOM 0 HE22 GLN A 34 18.122 15.863 33.580 1.00 72.13 H new ATOM 540 N LEU A 35 15.561 21.451 29.529 1.00 30.14 N ATOM 541 CA LEU A 35 15.076 21.804 28.199 1.00 13.10 C ATOM 542 C LEU A 35 16.235 22.159 27.273 1.00 12.24 C ATOM 543 O LEU A 35 17.309 22.552 27.730 1.00 24.53 O ATOM 544 CB LEU A 35 14.100 22.979 28.287 1.00 22.12 C ATOM 545 CG LEU A 35 12.682 22.712 27.780 1.00 2.02 C ATOM 546 CD1 LEU A 35 11.853 23.985 27.821 1.00 54.43 C ATOM 547 CD2 LEU A 35 12.719 22.142 26.370 1.00 64.05 C ATOM 0 H LEU A 35 16.546 21.661 29.688 1.00 30.14 H new ATOM 0 HA LEU A 35 14.558 20.939 27.786 1.00 13.10 H new ATOM 0 HB2 LEU A 35 14.039 23.297 29.328 1.00 22.12 H new ATOM 0 HB3 LEU A 35 14.515 23.814 27.722 1.00 22.12 H new ATOM 0 HG LEU A 35 12.214 21.977 28.435 1.00 2.02 H new ATOM 0 HD11 LEU A 35 10.847 23.776 27.457 1.00 54.43 H new ATOM 0 HD12 LEU A 35 11.799 24.351 28.846 1.00 54.43 H new ATOM 0 HD13 LEU A 35 12.318 24.742 27.189 1.00 54.43 H new ATOM 0 HD21 LEU A 35 11.702 21.958 26.025 1.00 64.05 H new ATOM 0 HD22 LEU A 35 13.205 22.853 25.703 1.00 64.05 H new ATOM 0 HD23 LEU A 35 13.277 21.205 26.371 1.00 64.05 H new ATOM 559 N ARG A 36 16.009 22.022 25.971 1.00 31.10 N ATOM 560 CA ARG A 36 17.034 22.329 24.982 1.00 64.22 C ATOM 561 C ARG A 36 16.403 22.767 23.663 1.00 45.02 C ATOM 562 O ARG A 36 15.664 22.009 23.034 1.00 3.24 O ATOM 563 CB ARG A 36 17.931 21.112 24.750 1.00 31.51 C ATOM 564 CG ARG A 36 18.826 20.780 25.933 1.00 2.42 C ATOM 565 CD ARG A 36 19.805 21.907 26.223 1.00 11.15 C ATOM 566 NE ARG A 36 20.735 21.561 27.294 1.00 12.31 N ATOM 567 CZ ARG A 36 21.670 22.387 27.751 1.00 42.00 C ATOM 568 NH1 ARG A 36 21.798 23.601 27.232 1.00 13.02 N ATOM 569 NH2 ARG A 36 22.480 22.000 28.729 1.00 52.22 N ATOM 0 H ARG A 36 15.125 21.700 25.577 1.00 31.10 H new ATOM 0 HA ARG A 36 17.639 23.150 25.367 1.00 64.22 H new ATOM 0 HB2 ARG A 36 17.306 20.248 24.525 1.00 31.51 H new ATOM 0 HB3 ARG A 36 18.554 21.292 23.874 1.00 31.51 H new ATOM 0 HG2 ARG A 36 18.212 20.594 26.814 1.00 2.42 H new ATOM 0 HG3 ARG A 36 19.376 19.862 25.728 1.00 2.42 H new ATOM 0 HD2 ARG A 36 20.365 22.142 25.318 1.00 11.15 H new ATOM 0 HD3 ARG A 36 19.253 22.805 26.499 1.00 11.15 H new ATOM 0 HE ARG A 36 20.663 20.634 27.714 1.00 12.31 H new ATOM 0 HH11 ARG A 36 21.178 23.902 26.480 1.00 13.02 H new ATOM 0 HH12 ARG A 36 22.517 24.233 27.585 1.00 13.02 H new ATOM 0 HH21 ARG A 36 22.385 21.067 29.131 1.00 52.22 H new ATOM 0 HH22 ARG A 36 23.197 22.635 29.079 1.00 52.22 H new ATOM 583 N LYS A 37 16.698 23.995 23.251 1.00 12.24 N ATOM 584 CA LYS A 37 16.161 24.536 22.008 1.00 20.22 C ATOM 585 C LYS A 37 17.039 25.667 21.483 1.00 41.24 C ATOM 586 O LYS A 37 16.743 26.843 21.690 1.00 71.13 O ATOM 587 CB LYS A 37 14.733 25.041 22.223 1.00 43.43 C ATOM 588 CG LYS A 37 14.427 25.406 23.666 1.00 60.54 C ATOM 589 CD LYS A 37 15.309 26.542 24.153 1.00 35.54 C ATOM 590 CE LYS A 37 14.816 27.101 25.479 1.00 3.12 C ATOM 591 NZ LYS A 37 15.874 27.878 26.182 1.00 24.03 N ATOM 0 H LYS A 37 17.307 24.635 23.761 1.00 12.24 H new ATOM 0 HA LYS A 37 16.149 23.736 21.268 1.00 20.22 H new ATOM 0 HB2 LYS A 37 14.567 25.915 21.593 1.00 43.43 H new ATOM 0 HB3 LYS A 37 14.032 24.274 21.895 1.00 43.43 H new ATOM 0 HG2 LYS A 37 13.379 25.694 23.755 1.00 60.54 H new ATOM 0 HG3 LYS A 37 14.573 24.533 24.302 1.00 60.54 H new ATOM 0 HD2 LYS A 37 16.333 26.186 24.265 1.00 35.54 H new ATOM 0 HD3 LYS A 37 15.327 27.336 23.406 1.00 35.54 H new ATOM 0 HE2 LYS A 37 13.951 27.741 25.304 1.00 3.12 H new ATOM 0 HE3 LYS A 37 14.483 26.282 26.117 1.00 3.12 H new ATOM 0 HZ1 LYS A 37 15.498 28.242 27.081 1.00 24.03 H new ATOM 0 HZ2 LYS A 37 16.689 27.261 26.372 1.00 24.03 H new ATOM 0 HZ3 LYS A 37 16.174 28.675 25.585 1.00 24.03 H new ATOM 605 N GLY A 38 18.120 25.304 20.799 1.00 35.33 N ATOM 606 CA GLY A 38 19.023 26.300 20.254 1.00 61.45 C ATOM 607 C GLY A 38 19.982 25.717 19.235 1.00 34.05 C ATOM 608 O GLY A 38 20.676 24.739 19.515 1.00 40.02 O ATOM 0 H GLY A 38 18.386 24.337 20.613 1.00 35.33 H new ATOM 0 HA2 GLY A 38 18.442 27.096 19.788 1.00 61.45 H new ATOM 0 HA3 GLY A 38 19.592 26.753 21.066 1.00 61.45 H new ATOM 612 N ALA A 39 20.021 26.317 18.050 1.00 43.51 N ATOM 613 CA ALA A 39 20.903 25.852 16.987 1.00 73.12 C ATOM 614 C ALA A 39 22.344 25.746 17.475 1.00 75.22 C ATOM 615 O ALA A 39 23.092 24.870 17.044 1.00 41.11 O ATOM 616 CB ALA A 39 20.818 26.782 15.785 1.00 75.14 C ATOM 0 H ALA A 39 19.452 27.126 17.802 1.00 43.51 H new ATOM 0 HA ALA A 39 20.575 24.857 16.687 1.00 73.12 H new ATOM 0 HB1 ALA A 39 21.482 26.422 14.999 1.00 75.14 H new ATOM 0 HB2 ALA A 39 19.794 26.803 15.413 1.00 75.14 H new ATOM 0 HB3 ALA A 39 21.117 27.787 16.081 1.00 75.14 H new ATOM 622 N ASN A 40 22.726 26.645 18.377 1.00 60.41 N ATOM 623 CA ASN A 40 24.078 26.653 18.922 1.00 14.04 C ATOM 624 C ASN A 40 24.207 25.657 20.071 1.00 42.41 C ATOM 625 O ASN A 40 25.086 24.796 20.063 1.00 41.40 O ATOM 626 CB ASN A 40 24.447 28.057 19.406 1.00 22.23 C ATOM 627 CG ASN A 40 25.564 28.676 18.587 1.00 40.02 C ATOM 628 OD1 ASN A 40 26.581 28.036 18.322 1.00 65.24 O ATOM 629 ND2 ASN A 40 25.377 29.927 18.182 1.00 14.24 N ATOM 0 H ASN A 40 22.118 27.377 18.745 1.00 60.41 H new ATOM 0 HA ASN A 40 24.765 26.357 18.129 1.00 14.04 H new ATOM 0 HB2 ASN A 40 23.567 28.698 19.358 1.00 22.23 H new ATOM 0 HB3 ASN A 40 24.750 28.010 20.452 1.00 22.23 H new ATOM 0 HD21 ASN A 40 26.093 30.396 17.627 1.00 14.24 H new ATOM 0 HD22 ASN A 40 24.517 30.419 18.426 1.00 14.24 H new ATOM 636 N GLU A 41 23.324 25.783 21.057 1.00 31.42 N ATOM 637 CA GLU A 41 23.340 24.894 22.213 1.00 73.32 C ATOM 638 C GLU A 41 23.288 23.432 21.776 1.00 51.21 C ATOM 639 O GLU A 41 23.784 22.547 22.472 1.00 20.04 O ATOM 640 CB GLU A 41 22.162 25.203 23.139 1.00 21.12 C ATOM 641 CG GLU A 41 22.171 26.622 23.682 1.00 31.15 C ATOM 642 CD GLU A 41 23.253 26.840 24.723 1.00 43.32 C ATOM 643 OE1 GLU A 41 24.441 26.880 24.342 1.00 2.35 O ATOM 644 OE2 GLU A 41 22.911 26.972 25.917 1.00 4.23 O ATOM 0 H GLU A 41 22.590 26.491 21.078 1.00 31.42 H new ATOM 0 HA GLU A 41 24.271 25.061 22.754 1.00 73.32 H new ATOM 0 HB2 GLU A 41 21.231 25.036 22.597 1.00 21.12 H new ATOM 0 HB3 GLU A 41 22.174 24.503 23.975 1.00 21.12 H new ATOM 0 HG2 GLU A 41 22.317 27.321 22.859 1.00 31.15 H new ATOM 0 HG3 GLU A 41 21.199 26.845 24.121 1.00 31.15 H new ATOM 651 N ALA A 42 22.681 23.188 20.619 1.00 72.30 N ATOM 652 CA ALA A 42 22.565 21.836 20.088 1.00 65.21 C ATOM 653 C ALA A 42 23.938 21.201 19.897 1.00 61.52 C ATOM 654 O ALA A 42 24.205 20.109 20.401 1.00 5.23 O ATOM 655 CB ALA A 42 21.799 21.848 18.774 1.00 5.50 C ATOM 0 H ALA A 42 22.262 23.909 20.032 1.00 72.30 H new ATOM 0 HA ALA A 42 22.014 21.235 20.811 1.00 65.21 H new ATOM 0 HB1 ALA A 42 21.720 20.831 18.389 1.00 5.50 H new ATOM 0 HB2 ALA A 42 20.800 22.252 18.939 1.00 5.50 H new ATOM 0 HB3 ALA A 42 22.327 22.470 18.051 1.00 5.50 H new ATOM 661 N THR A 43 24.807 21.890 19.163 1.00 55.31 N ATOM 662 CA THR A 43 26.152 21.393 18.904 1.00 65.35 C ATOM 663 C THR A 43 26.853 21.000 20.199 1.00 43.31 C ATOM 664 O THR A 43 27.683 20.091 20.216 1.00 15.53 O ATOM 665 CB THR A 43 27.006 22.443 18.168 1.00 61.30 C ATOM 666 OG1 THR A 43 26.205 23.582 17.835 1.00 32.10 O ATOM 667 CG2 THR A 43 27.613 21.856 16.902 1.00 11.01 C ATOM 0 H THR A 43 24.602 22.794 18.738 1.00 55.31 H new ATOM 0 HA THR A 43 26.047 20.512 18.271 1.00 65.35 H new ATOM 0 HB THR A 43 27.814 22.750 18.831 1.00 61.30 H new ATOM 0 HG1 THR A 43 25.965 24.064 18.654 1.00 32.10 H new ATOM 0 HG21 THR A 43 28.212 22.616 16.399 1.00 11.01 H new ATOM 0 HG22 THR A 43 28.247 21.008 17.162 1.00 11.01 H new ATOM 0 HG23 THR A 43 26.816 21.523 16.237 1.00 11.01 H new ATOM 675 N LYS A 44 26.513 21.690 21.282 1.00 52.10 N ATOM 676 CA LYS A 44 27.108 21.412 22.583 1.00 13.31 C ATOM 677 C LYS A 44 26.443 20.208 23.240 1.00 72.23 C ATOM 678 O LYS A 44 27.111 19.246 23.620 1.00 22.42 O ATOM 679 CB LYS A 44 26.985 22.636 23.495 1.00 11.53 C ATOM 680 CG LYS A 44 27.141 22.313 24.970 1.00 14.41 C ATOM 681 CD LYS A 44 28.473 21.643 25.258 1.00 25.44 C ATOM 682 CE LYS A 44 29.642 22.544 24.890 1.00 65.55 C ATOM 683 NZ LYS A 44 30.623 22.665 26.004 1.00 73.53 N ATOM 0 H LYS A 44 25.828 22.446 21.284 1.00 52.10 H new ATOM 0 HA LYS A 44 28.163 21.184 22.430 1.00 13.31 H new ATOM 0 HB2 LYS A 44 27.740 23.368 23.210 1.00 11.53 H new ATOM 0 HB3 LYS A 44 26.013 23.102 23.335 1.00 11.53 H new ATOM 0 HG2 LYS A 44 27.060 23.230 25.554 1.00 14.41 H new ATOM 0 HG3 LYS A 44 26.328 21.660 25.288 1.00 14.41 H new ATOM 0 HD2 LYS A 44 28.530 21.385 26.315 1.00 25.44 H new ATOM 0 HD3 LYS A 44 28.541 20.710 24.698 1.00 25.44 H new ATOM 0 HE2 LYS A 44 30.143 22.146 24.007 1.00 65.55 H new ATOM 0 HE3 LYS A 44 29.269 23.533 24.626 1.00 65.55 H new ATOM 0 HZ1 LYS A 44 31.404 23.287 25.713 1.00 73.53 H new ATOM 0 HZ2 LYS A 44 30.152 23.068 26.839 1.00 73.53 H new ATOM 0 HZ3 LYS A 44 30.999 21.724 26.239 1.00 73.53 H new ATOM 697 N THR A 45 25.121 20.265 23.371 1.00 43.53 N ATOM 698 CA THR A 45 24.365 19.178 23.982 1.00 44.43 C ATOM 699 C THR A 45 24.707 17.840 23.336 1.00 44.45 C ATOM 700 O THR A 45 25.164 16.915 24.006 1.00 61.24 O ATOM 701 CB THR A 45 22.848 19.418 23.870 1.00 62.44 C ATOM 702 OG1 THR A 45 22.496 19.705 22.512 1.00 44.54 O ATOM 703 CG2 THR A 45 22.414 20.568 24.765 1.00 54.31 C ATOM 0 H THR A 45 24.551 21.053 23.062 1.00 43.53 H new ATOM 0 HA THR A 45 24.644 19.151 25.035 1.00 44.43 H new ATOM 0 HB THR A 45 22.335 18.513 24.194 1.00 62.44 H new ATOM 0 HG1 THR A 45 21.583 19.393 22.338 1.00 44.54 H new ATOM 0 HG21 THR A 45 21.339 20.718 24.669 1.00 54.31 H new ATOM 0 HG22 THR A 45 22.656 20.334 25.802 1.00 54.31 H new ATOM 0 HG23 THR A 45 22.936 21.478 24.467 1.00 54.31 H new ATOM 711 N LEU A 46 24.482 17.746 22.029 1.00 2.10 N ATOM 712 CA LEU A 46 24.767 16.520 21.291 1.00 72.22 C ATOM 713 C LEU A 46 26.226 16.109 21.460 1.00 5.12 C ATOM 714 O LEU A 46 26.554 14.924 21.436 1.00 54.20 O ATOM 715 CB LEU A 46 24.445 16.708 19.807 1.00 30.05 C ATOM 716 CG LEU A 46 22.968 16.895 19.459 1.00 11.31 C ATOM 717 CD1 LEU A 46 22.771 18.154 18.630 1.00 64.31 C ATOM 718 CD2 LEU A 46 22.438 15.677 18.718 1.00 51.25 C ATOM 0 H LEU A 46 24.104 18.503 21.460 1.00 2.10 H new ATOM 0 HA LEU A 46 24.137 15.727 21.695 1.00 72.22 H new ATOM 0 HB2 LEU A 46 24.996 17.575 19.443 1.00 30.05 H new ATOM 0 HB3 LEU A 46 24.819 15.841 19.262 1.00 30.05 H new ATOM 0 HG LEU A 46 22.406 17.004 20.386 1.00 11.31 H new ATOM 0 HD11 LEU A 46 21.714 18.271 18.392 1.00 64.31 H new ATOM 0 HD12 LEU A 46 23.113 19.020 19.197 1.00 64.31 H new ATOM 0 HD13 LEU A 46 23.345 18.075 17.706 1.00 64.31 H new ATOM 0 HD21 LEU A 46 21.385 15.827 18.478 1.00 51.25 H new ATOM 0 HD22 LEU A 46 23.004 15.537 17.797 1.00 51.25 H new ATOM 0 HD23 LEU A 46 22.544 14.793 19.347 1.00 51.25 H new ATOM 730 N ASN A 47 27.097 17.099 21.631 1.00 22.45 N ATOM 731 CA ASN A 47 28.523 16.839 21.806 1.00 51.45 C ATOM 732 C ASN A 47 28.810 16.301 23.204 1.00 43.33 C ATOM 733 O ASN A 47 29.769 15.557 23.408 1.00 62.30 O ATOM 734 CB ASN A 47 29.327 18.118 21.564 1.00 4.11 C ATOM 735 CG ASN A 47 30.745 18.018 22.092 1.00 55.42 C ATOM 736 OD1 ASN A 47 31.077 18.603 23.123 1.00 33.25 O ATOM 737 ND2 ASN A 47 31.588 17.274 21.387 1.00 63.23 N ATOM 0 H ASN A 47 26.842 18.086 21.652 1.00 22.45 H new ATOM 0 HA ASN A 47 28.823 16.085 21.078 1.00 51.45 H new ATOM 0 HB2 ASN A 47 29.354 18.330 20.495 1.00 4.11 H new ATOM 0 HB3 ASN A 47 28.822 18.957 22.043 1.00 4.11 H new ATOM 0 HD21 ASN A 47 32.555 17.169 21.694 1.00 63.23 H new ATOM 0 HD22 ASN A 47 31.269 16.807 20.538 1.00 63.23 H new ATOM 744 N ARG A 48 27.973 16.682 24.163 1.00 53.23 N ATOM 745 CA ARG A 48 28.138 16.239 25.542 1.00 65.34 C ATOM 746 C ARG A 48 27.663 14.798 25.709 1.00 11.24 C ATOM 747 O ARG A 48 28.099 14.091 26.618 1.00 3.51 O ATOM 748 CB ARG A 48 27.364 17.155 26.491 1.00 63.24 C ATOM 749 CG ARG A 48 28.213 18.260 27.097 1.00 30.43 C ATOM 750 CD ARG A 48 28.815 17.834 28.427 1.00 32.52 C ATOM 751 NE ARG A 48 28.082 18.386 29.562 1.00 10.45 N ATOM 752 CZ ARG A 48 28.077 19.678 29.876 1.00 64.02 C ATOM 753 NH1 ARG A 48 28.761 20.544 29.141 1.00 70.14 N ATOM 754 NH2 ARG A 48 27.386 20.104 30.925 1.00 45.43 N ATOM 0 H ARG A 48 27.173 17.297 24.010 1.00 53.23 H new ATOM 0 HA ARG A 48 29.199 16.286 25.788 1.00 65.34 H new ATOM 0 HB2 ARG A 48 26.531 17.604 25.950 1.00 63.24 H new ATOM 0 HB3 ARG A 48 26.937 16.555 27.294 1.00 63.24 H new ATOM 0 HG2 ARG A 48 29.011 18.529 26.405 1.00 30.43 H new ATOM 0 HG3 ARG A 48 27.603 19.152 27.241 1.00 30.43 H new ATOM 0 HD2 ARG A 48 28.817 16.746 28.492 1.00 32.52 H new ATOM 0 HD3 ARG A 48 29.855 18.158 28.475 1.00 32.52 H new ATOM 0 HE ARG A 48 27.544 17.746 30.146 1.00 10.45 H new ATOM 0 HH11 ARG A 48 29.292 20.219 28.333 1.00 70.14 H new ATOM 0 HH12 ARG A 48 28.756 21.535 29.384 1.00 70.14 H new ATOM 0 HH21 ARG A 48 26.858 19.440 31.492 1.00 45.43 H new ATOM 0 HH22 ARG A 48 27.383 21.095 31.165 1.00 45.43 H new ATOM 768 N GLY A 49 26.766 14.369 24.826 1.00 31.23 N ATOM 769 CA GLY A 49 26.248 13.015 24.895 1.00 50.24 C ATOM 770 C GLY A 49 25.196 12.851 25.974 1.00 34.43 C ATOM 771 O GLY A 49 25.212 11.871 26.720 1.00 30.11 O ATOM 0 H GLY A 49 26.389 14.934 24.065 1.00 31.23 H new ATOM 0 HA2 GLY A 49 25.820 12.744 23.930 1.00 50.24 H new ATOM 0 HA3 GLY A 49 27.070 12.324 25.085 1.00 50.24 H new ATOM 775 N ILE A 50 24.283 13.811 26.059 1.00 51.43 N ATOM 776 CA ILE A 50 23.221 13.769 27.057 1.00 61.30 C ATOM 777 C ILE A 50 21.846 13.786 26.397 1.00 23.15 C ATOM 778 O ILE A 50 20.825 13.610 27.061 1.00 1.53 O ATOM 779 CB ILE A 50 23.322 14.951 28.038 1.00 40.12 C ATOM 780 CG1 ILE A 50 23.813 16.205 27.311 1.00 65.02 C ATOM 781 CG2 ILE A 50 24.250 14.604 29.192 1.00 74.11 C ATOM 782 CD1 ILE A 50 22.918 16.630 26.168 1.00 43.32 C ATOM 0 H ILE A 50 24.257 14.628 25.449 1.00 51.43 H new ATOM 0 HA ILE A 50 23.345 12.838 27.610 1.00 61.30 H new ATOM 0 HB ILE A 50 22.331 15.153 28.443 1.00 40.12 H new ATOM 0 HG12 ILE A 50 23.889 17.024 28.026 1.00 65.02 H new ATOM 0 HG13 ILE A 50 24.817 16.023 26.927 1.00 65.02 H new ATOM 0 HG21 ILE A 50 24.311 15.450 29.877 1.00 74.11 H new ATOM 0 HG22 ILE A 50 23.861 13.735 29.723 1.00 74.11 H new ATOM 0 HG23 ILE A 50 25.244 14.378 28.805 1.00 74.11 H new ATOM 0 HD11 ILE A 50 23.327 17.525 25.699 1.00 43.32 H new ATOM 0 HD12 ILE A 50 22.862 15.828 25.432 1.00 43.32 H new ATOM 0 HD13 ILE A 50 21.919 16.844 26.548 1.00 43.32 H new ATOM 794 N SER A 51 21.828 13.997 25.085 1.00 24.23 N ATOM 795 CA SER A 51 20.579 14.040 24.334 1.00 70.11 C ATOM 796 C SER A 51 20.208 12.652 23.819 1.00 73.03 C ATOM 797 O SER A 51 20.850 12.122 22.913 1.00 1.11 O ATOM 798 CB SER A 51 20.696 15.016 23.162 1.00 41.43 C ATOM 799 OG SER A 51 22.050 15.204 22.788 1.00 54.10 O ATOM 0 H SER A 51 22.665 14.141 24.520 1.00 24.23 H new ATOM 0 HA SER A 51 19.792 14.383 25.005 1.00 70.11 H new ATOM 0 HB2 SER A 51 20.130 14.637 22.311 1.00 41.43 H new ATOM 0 HB3 SER A 51 20.255 15.974 23.437 1.00 41.43 H new ATOM 0 HG SER A 51 22.166 16.105 22.421 1.00 54.10 H new ATOM 805 N GLU A 52 19.165 12.071 24.404 1.00 61.55 N ATOM 806 CA GLU A 52 18.708 10.744 24.005 1.00 23.34 C ATOM 807 C GLU A 52 18.199 10.754 22.567 1.00 24.13 C ATOM 808 O GLU A 52 18.549 9.885 21.767 1.00 64.23 O ATOM 809 CB GLU A 52 17.603 10.257 24.945 1.00 62.15 C ATOM 810 CG GLU A 52 18.072 9.215 25.947 1.00 61.25 C ATOM 811 CD GLU A 52 19.401 9.572 26.581 1.00 0.23 C ATOM 812 OE1 GLU A 52 19.655 10.776 26.790 1.00 21.15 O ATOM 813 OE2 GLU A 52 20.189 8.646 26.868 1.00 34.31 O ATOM 0 H GLU A 52 18.621 12.497 25.154 1.00 61.55 H new ATOM 0 HA GLU A 52 19.556 10.062 24.068 1.00 23.34 H new ATOM 0 HB2 GLU A 52 17.195 11.111 25.486 1.00 62.15 H new ATOM 0 HB3 GLU A 52 16.791 9.838 24.351 1.00 62.15 H new ATOM 0 HG2 GLU A 52 17.320 9.103 26.728 1.00 61.25 H new ATOM 0 HG3 GLU A 52 18.159 8.250 25.448 1.00 61.25 H new ATOM 820 N PHE A 53 17.372 11.742 22.245 1.00 43.45 N ATOM 821 CA PHE A 53 16.813 11.865 20.903 1.00 30.52 C ATOM 822 C PHE A 53 16.711 13.329 20.488 1.00 52.40 C ATOM 823 O PHE A 53 16.949 14.231 21.293 1.00 43.33 O ATOM 824 CB PHE A 53 15.432 11.208 20.841 1.00 23.03 C ATOM 825 CG PHE A 53 14.382 11.945 21.622 1.00 32.04 C ATOM 826 CD1 PHE A 53 13.636 12.950 21.029 1.00 12.33 C ATOM 827 CD2 PHE A 53 14.142 11.632 22.950 1.00 54.43 C ATOM 828 CE1 PHE A 53 12.668 13.630 21.746 1.00 25.34 C ATOM 829 CE2 PHE A 53 13.176 12.308 23.671 1.00 74.11 C ATOM 830 CZ PHE A 53 12.439 13.309 23.068 1.00 32.12 C ATOM 0 H PHE A 53 17.073 12.470 22.894 1.00 43.45 H new ATOM 0 HA PHE A 53 17.482 11.355 20.210 1.00 30.52 H new ATOM 0 HB2 PHE A 53 15.118 11.139 19.800 1.00 23.03 H new ATOM 0 HB3 PHE A 53 15.506 10.188 21.219 1.00 23.03 H new ATOM 0 HD1 PHE A 53 13.812 13.206 19.995 1.00 12.33 H new ATOM 0 HD2 PHE A 53 14.716 10.851 23.427 1.00 54.43 H new ATOM 0 HE1 PHE A 53 12.092 14.411 21.272 1.00 25.34 H new ATOM 0 HE2 PHE A 53 12.997 12.054 24.705 1.00 74.11 H new ATOM 0 HZ PHE A 53 11.685 13.839 23.631 1.00 32.12 H new ATOM 840 N ILE A 54 16.357 13.558 19.228 1.00 11.13 N ATOM 841 CA ILE A 54 16.223 14.913 18.706 1.00 72.21 C ATOM 842 C ILE A 54 15.042 15.019 17.749 1.00 74.44 C ATOM 843 O ILE A 54 14.753 14.088 16.997 1.00 61.02 O ATOM 844 CB ILE A 54 17.502 15.364 17.977 1.00 3.13 C ATOM 845 CG1 ILE A 54 18.704 15.301 18.922 1.00 54.41 C ATOM 846 CG2 ILE A 54 17.328 16.771 17.425 1.00 4.34 C ATOM 847 CD1 ILE A 54 19.370 13.944 18.963 1.00 4.44 C ATOM 0 H ILE A 54 16.158 12.823 18.549 1.00 11.13 H new ATOM 0 HA ILE A 54 16.053 15.566 19.562 1.00 72.21 H new ATOM 0 HB ILE A 54 17.685 14.687 17.143 1.00 3.13 H new ATOM 0 HG12 ILE A 54 19.437 16.047 18.615 1.00 54.41 H new ATOM 0 HG13 ILE A 54 18.380 15.568 19.928 1.00 54.41 H new ATOM 0 HG21 ILE A 54 18.240 17.076 16.912 1.00 4.34 H new ATOM 0 HG22 ILE A 54 16.495 16.786 16.722 1.00 4.34 H new ATOM 0 HG23 ILE A 54 17.124 17.461 18.244 1.00 4.34 H new ATOM 0 HD11 ILE A 54 20.213 13.973 19.653 1.00 4.44 H new ATOM 0 HD12 ILE A 54 18.652 13.196 19.299 1.00 4.44 H new ATOM 0 HD13 ILE A 54 19.726 13.683 17.966 1.00 4.44 H new ATOM 859 N VAL A 55 14.361 16.160 17.780 1.00 12.45 N ATOM 860 CA VAL A 55 13.212 16.390 16.914 1.00 64.41 C ATOM 861 C VAL A 55 13.368 17.686 16.124 1.00 31.44 C ATOM 862 O VAL A 55 13.608 18.748 16.698 1.00 25.43 O ATOM 863 CB VAL A 55 11.902 16.450 17.722 1.00 42.23 C ATOM 864 CG1 VAL A 55 10.701 16.513 16.790 1.00 31.52 C ATOM 865 CG2 VAL A 55 11.799 15.255 18.658 1.00 63.01 C ATOM 0 H VAL A 55 14.586 16.940 18.397 1.00 12.45 H new ATOM 0 HA VAL A 55 13.166 15.549 16.222 1.00 64.41 H new ATOM 0 HB VAL A 55 11.910 17.357 18.327 1.00 42.23 H new ATOM 0 HG11 VAL A 55 9.785 16.555 17.379 1.00 31.52 H new ATOM 0 HG12 VAL A 55 10.772 17.403 16.165 1.00 31.52 H new ATOM 0 HG13 VAL A 55 10.685 15.626 16.157 1.00 31.52 H new ATOM 0 HG21 VAL A 55 10.868 15.313 19.221 1.00 63.01 H new ATOM 0 HG22 VAL A 55 11.814 14.334 18.075 1.00 63.01 H new ATOM 0 HG23 VAL A 55 12.642 15.260 19.349 1.00 63.01 H new ATOM 875 N MET A 56 13.231 17.588 14.807 1.00 4.41 N ATOM 876 CA MET A 56 13.356 18.754 13.938 1.00 11.33 C ATOM 877 C MET A 56 12.095 18.948 13.104 1.00 63.10 C ATOM 878 O MET A 56 11.362 17.996 12.840 1.00 73.44 O ATOM 879 CB MET A 56 14.572 18.605 13.020 1.00 54.33 C ATOM 880 CG MET A 56 14.602 17.288 12.262 1.00 41.03 C ATOM 881 SD MET A 56 14.947 17.506 10.506 1.00 72.30 S ATOM 882 CE MET A 56 13.297 17.787 9.869 1.00 33.34 C ATOM 0 H MET A 56 13.034 16.715 14.317 1.00 4.41 H new ATOM 0 HA MET A 56 13.492 19.633 14.568 1.00 11.33 H new ATOM 0 HB2 MET A 56 14.580 19.427 12.304 1.00 54.33 H new ATOM 0 HB3 MET A 56 15.480 18.693 13.616 1.00 54.33 H new ATOM 0 HG2 MET A 56 15.360 16.639 12.699 1.00 41.03 H new ATOM 0 HG3 MET A 56 13.643 16.783 12.380 1.00 41.03 H new ATOM 0 HE1 MET A 56 13.005 16.951 9.233 1.00 33.34 H new ATOM 0 HE2 MET A 56 12.596 17.873 10.699 1.00 33.34 H new ATOM 0 HE3 MET A 56 13.284 18.708 9.287 1.00 33.34 H new ATOM 892 N ALA A 57 11.848 20.186 12.690 1.00 4.24 N ATOM 893 CA ALA A 57 10.676 20.504 11.884 1.00 34.23 C ATOM 894 C ALA A 57 10.839 19.998 10.455 1.00 22.44 C ATOM 895 O ALA A 57 11.752 20.411 9.740 1.00 12.11 O ATOM 896 CB ALA A 57 10.423 22.004 11.888 1.00 0.52 C ATOM 0 H ALA A 57 12.445 20.986 12.900 1.00 4.24 H new ATOM 0 HA ALA A 57 9.816 20.000 12.325 1.00 34.23 H new ATOM 0 HB1 ALA A 57 9.545 22.226 11.282 1.00 0.52 H new ATOM 0 HB2 ALA A 57 10.253 22.342 12.910 1.00 0.52 H new ATOM 0 HB3 ALA A 57 11.289 22.520 11.474 1.00 0.52 H new ATOM 902 N ALA A 58 9.949 19.100 10.045 1.00 52.44 N ATOM 903 CA ALA A 58 9.994 18.538 8.700 1.00 55.52 C ATOM 904 C ALA A 58 9.740 19.612 7.648 1.00 35.24 C ATOM 905 O ALA A 58 10.179 19.489 6.504 1.00 1.21 O ATOM 906 CB ALA A 58 8.979 17.413 8.565 1.00 34.32 C ATOM 0 H ALA A 58 9.188 18.746 10.625 1.00 52.44 H new ATOM 0 HA ALA A 58 10.993 18.134 8.534 1.00 55.52 H new ATOM 0 HB1 ALA A 58 9.023 17.002 7.556 1.00 34.32 H new ATOM 0 HB2 ALA A 58 9.207 16.628 9.286 1.00 34.32 H new ATOM 0 HB3 ALA A 58 7.978 17.801 8.755 1.00 34.32 H new ATOM 912 N ASP A 59 9.029 20.663 8.042 1.00 65.43 N ATOM 913 CA ASP A 59 8.716 21.759 7.132 1.00 64.00 C ATOM 914 C ASP A 59 9.628 22.954 7.388 1.00 4.32 C ATOM 915 O ASP A 59 9.214 24.105 7.252 1.00 65.25 O ATOM 916 CB ASP A 59 7.253 22.177 7.285 1.00 72.41 C ATOM 917 CG ASP A 59 6.799 23.112 6.182 1.00 61.51 C ATOM 918 OD1 ASP A 59 7.422 23.098 5.099 1.00 64.22 O ATOM 919 OD2 ASP A 59 5.820 23.855 6.400 1.00 22.33 O ATOM 0 H ASP A 59 8.659 20.779 8.985 1.00 65.43 H new ATOM 0 HA ASP A 59 8.881 21.410 6.113 1.00 64.00 H new ATOM 0 HB2 ASP A 59 6.622 21.288 7.286 1.00 72.41 H new ATOM 0 HB3 ASP A 59 7.117 22.665 8.250 1.00 72.41 H new ATOM 924 N ALA A 60 10.873 22.673 7.760 1.00 3.34 N ATOM 925 CA ALA A 60 11.844 23.726 8.034 1.00 24.54 C ATOM 926 C ALA A 60 13.164 23.453 7.320 1.00 32.23 C ATOM 927 O ALA A 60 13.804 22.428 7.551 1.00 71.24 O ATOM 928 CB ALA A 60 12.070 23.858 9.533 1.00 71.44 C ATOM 0 H ALA A 60 11.233 21.726 7.878 1.00 3.34 H new ATOM 0 HA ALA A 60 11.442 24.665 7.654 1.00 24.54 H new ATOM 0 HB1 ALA A 60 12.797 24.648 9.723 1.00 71.44 H new ATOM 0 HB2 ALA A 60 11.128 24.106 10.022 1.00 71.44 H new ATOM 0 HB3 ALA A 60 12.447 22.915 9.929 1.00 71.44 H new ATOM 934 N GLU A 61 13.565 24.378 6.454 1.00 4.34 N ATOM 935 CA GLU A 61 14.809 24.236 5.706 1.00 12.25 C ATOM 936 C GLU A 61 15.666 25.492 5.831 1.00 21.22 C ATOM 937 O GLU A 61 15.185 26.569 6.186 1.00 2.14 O ATOM 938 CB GLU A 61 14.514 23.951 4.232 1.00 52.31 C ATOM 939 CG GLU A 61 14.685 22.490 3.848 1.00 55.31 C ATOM 940 CD GLU A 61 13.684 22.042 2.800 1.00 14.54 C ATOM 941 OE1 GLU A 61 12.467 22.113 3.072 1.00 4.23 O ATOM 942 OE2 GLU A 61 14.120 21.621 1.708 1.00 53.01 O ATOM 0 H GLU A 61 13.047 25.233 6.253 1.00 4.34 H new ATOM 0 HA GLU A 61 15.362 23.397 6.127 1.00 12.25 H new ATOM 0 HB2 GLU A 61 13.493 24.260 4.008 1.00 52.31 H new ATOM 0 HB3 GLU A 61 15.174 24.560 3.614 1.00 52.31 H new ATOM 0 HG2 GLU A 61 15.695 22.333 3.471 1.00 55.31 H new ATOM 0 HG3 GLU A 61 14.577 21.869 4.737 1.00 55.31 H new ATOM 949 N PRO A 62 16.966 25.353 5.533 1.00 73.41 N ATOM 950 CA PRO A 62 17.549 24.076 5.111 1.00 50.24 C ATOM 951 C PRO A 62 17.599 23.058 6.245 1.00 1.22 C ATOM 952 O PRO A 62 17.707 23.423 7.416 1.00 52.11 O ATOM 953 CB PRO A 62 18.965 24.460 4.673 1.00 15.54 C ATOM 954 CG PRO A 62 19.274 25.701 5.438 1.00 72.23 C ATOM 955 CD PRO A 62 17.968 26.431 5.587 1.00 14.12 C ATOM 0 HA PRO A 62 16.961 23.599 4.327 1.00 50.24 H new ATOM 0 HB2 PRO A 62 19.678 23.667 4.899 1.00 15.54 H new ATOM 0 HB3 PRO A 62 19.013 24.635 3.598 1.00 15.54 H new ATOM 0 HG2 PRO A 62 19.701 25.463 6.412 1.00 72.23 H new ATOM 0 HG3 PRO A 62 20.005 26.313 4.910 1.00 72.23 H new ATOM 0 HD2 PRO A 62 17.919 26.978 6.528 1.00 14.12 H new ATOM 0 HD3 PRO A 62 17.820 27.157 4.788 1.00 14.12 H new ATOM 963 N LEU A 63 17.520 21.780 5.890 1.00 24.13 N ATOM 964 CA LEU A 63 17.558 20.708 6.878 1.00 34.12 C ATOM 965 C LEU A 63 18.986 20.217 7.097 1.00 64.14 C ATOM 966 O LEU A 63 19.312 19.680 8.154 1.00 3.23 O ATOM 967 CB LEU A 63 16.669 19.545 6.433 1.00 3.13 C ATOM 968 CG LEU A 63 16.184 18.609 7.540 1.00 24.35 C ATOM 969 CD1 LEU A 63 14.930 17.869 7.101 1.00 72.51 C ATOM 970 CD2 LEU A 63 17.280 17.624 7.923 1.00 24.21 C ATOM 0 H LEU A 63 17.429 21.461 4.925 1.00 24.13 H new ATOM 0 HA LEU A 63 17.182 21.105 7.821 1.00 34.12 H new ATOM 0 HB2 LEU A 63 15.797 19.955 5.923 1.00 3.13 H new ATOM 0 HB3 LEU A 63 17.218 18.954 5.700 1.00 3.13 H new ATOM 0 HG LEU A 63 15.939 19.209 8.416 1.00 24.35 H new ATOM 0 HD11 LEU A 63 14.599 17.207 7.901 1.00 72.51 H new ATOM 0 HD12 LEU A 63 14.143 18.589 6.876 1.00 72.51 H new ATOM 0 HD13 LEU A 63 15.148 17.280 6.210 1.00 72.51 H new ATOM 0 HD21 LEU A 63 16.918 16.965 8.712 1.00 24.21 H new ATOM 0 HD22 LEU A 63 17.555 17.029 7.052 1.00 24.21 H new ATOM 0 HD23 LEU A 63 18.153 18.171 8.279 1.00 24.21 H new ATOM 982 N GLU A 64 19.832 20.407 6.089 1.00 61.02 N ATOM 983 CA GLU A 64 21.225 19.984 6.172 1.00 53.53 C ATOM 984 C GLU A 64 21.897 20.567 7.412 1.00 51.35 C ATOM 985 O GLU A 64 22.670 19.888 8.089 1.00 61.13 O ATOM 986 CB GLU A 64 21.987 20.414 4.916 1.00 35.22 C ATOM 987 CG GLU A 64 22.964 19.367 4.409 1.00 74.00 C ATOM 988 CD GLU A 64 24.289 19.965 3.980 1.00 25.31 C ATOM 989 OE1 GLU A 64 24.850 20.778 4.743 1.00 73.01 O ATOM 990 OE2 GLU A 64 24.766 19.619 2.878 1.00 42.13 O ATOM 0 H GLU A 64 19.577 20.851 5.207 1.00 61.02 H new ATOM 0 HA GLU A 64 21.245 18.897 6.246 1.00 53.53 H new ATOM 0 HB2 GLU A 64 21.271 20.643 4.127 1.00 35.22 H new ATOM 0 HB3 GLU A 64 22.531 21.334 5.129 1.00 35.22 H new ATOM 0 HG2 GLU A 64 23.139 18.629 5.192 1.00 74.00 H new ATOM 0 HG3 GLU A 64 22.519 18.838 3.567 1.00 74.00 H new ATOM 997 N ILE A 65 21.597 21.828 7.703 1.00 44.43 N ATOM 998 CA ILE A 65 22.171 22.501 8.861 1.00 12.33 C ATOM 999 C ILE A 65 21.657 21.893 10.161 1.00 0.45 C ATOM 1000 O ILE A 65 22.333 21.940 11.190 1.00 4.43 O ATOM 1001 CB ILE A 65 21.853 24.008 8.852 1.00 63.04 C ATOM 1002 CG1 ILE A 65 20.359 24.238 9.092 1.00 25.00 C ATOM 1003 CG2 ILE A 65 22.284 24.633 7.533 1.00 52.10 C ATOM 1004 CD1 ILE A 65 19.964 25.698 9.087 1.00 54.03 C ATOM 0 H ILE A 65 20.960 22.404 7.153 1.00 44.43 H new ATOM 0 HA ILE A 65 23.251 22.365 8.801 1.00 12.33 H new ATOM 0 HB ILE A 65 22.410 24.486 9.658 1.00 63.04 H new ATOM 0 HG12 ILE A 65 19.791 23.714 8.324 1.00 25.00 H new ATOM 0 HG13 ILE A 65 20.081 23.798 10.050 1.00 25.00 H new ATOM 0 HG21 ILE A 65 22.053 25.698 7.542 1.00 52.10 H new ATOM 0 HG22 ILE A 65 23.357 24.496 7.399 1.00 52.10 H new ATOM 0 HG23 ILE A 65 21.752 24.153 6.712 1.00 52.10 H new ATOM 0 HD11 ILE A 65 18.892 25.785 9.263 1.00 54.03 H new ATOM 0 HD12 ILE A 65 20.505 26.224 9.874 1.00 54.03 H new ATOM 0 HD13 ILE A 65 20.210 26.138 8.121 1.00 54.03 H new ATOM 1016 N ILE A 66 20.459 21.321 10.108 1.00 62.40 N ATOM 1017 CA ILE A 66 19.856 20.700 11.281 1.00 3.34 C ATOM 1018 C ILE A 66 20.257 19.234 11.394 1.00 62.44 C ATOM 1019 O ILE A 66 20.152 18.630 12.462 1.00 14.10 O ATOM 1020 CB ILE A 66 18.320 20.800 11.244 1.00 22.23 C ATOM 1021 CG1 ILE A 66 17.888 22.227 10.900 1.00 1.22 C ATOM 1022 CG2 ILE A 66 17.729 20.369 12.578 1.00 23.53 C ATOM 1023 CD1 ILE A 66 16.389 22.394 10.787 1.00 4.11 C ATOM 0 H ILE A 66 19.887 21.275 9.265 1.00 62.40 H new ATOM 0 HA ILE A 66 20.226 21.243 12.151 1.00 3.34 H new ATOM 0 HB ILE A 66 17.946 20.131 10.470 1.00 22.23 H new ATOM 0 HG12 ILE A 66 18.264 22.906 11.665 1.00 1.22 H new ATOM 0 HG13 ILE A 66 18.350 22.521 9.958 1.00 1.22 H new ATOM 0 HG21 ILE A 66 16.642 20.445 12.536 1.00 23.53 H new ATOM 0 HG22 ILE A 66 18.013 19.337 12.785 1.00 23.53 H new ATOM 0 HG23 ILE A 66 18.108 21.015 13.370 1.00 23.53 H new ATOM 0 HD11 ILE A 66 16.156 23.430 10.541 1.00 4.11 H new ATOM 0 HD12 ILE A 66 16.008 21.740 10.002 1.00 4.11 H new ATOM 0 HD13 ILE A 66 15.921 22.132 11.736 1.00 4.11 H new ATOM 1035 N LEU A 67 20.718 18.665 10.285 1.00 11.24 N ATOM 1036 CA LEU A 67 21.137 17.268 10.259 1.00 40.22 C ATOM 1037 C LEU A 67 22.642 17.146 10.474 1.00 43.30 C ATOM 1038 O LEU A 67 23.134 16.111 10.925 1.00 1.34 O ATOM 1039 CB LEU A 67 20.747 16.623 8.927 1.00 33.33 C ATOM 1040 CG LEU A 67 21.076 15.136 8.780 1.00 42.51 C ATOM 1041 CD1 LEU A 67 20.005 14.433 7.960 1.00 13.33 C ATOM 1042 CD2 LEU A 67 22.445 14.954 8.142 1.00 41.45 C ATOM 0 H LEU A 67 20.811 19.150 9.392 1.00 11.24 H new ATOM 0 HA LEU A 67 20.629 16.747 11.071 1.00 40.22 H new ATOM 0 HB2 LEU A 67 19.674 16.753 8.783 1.00 33.33 H new ATOM 0 HB3 LEU A 67 21.245 17.166 8.124 1.00 33.33 H new ATOM 0 HG LEU A 67 21.098 14.687 9.773 1.00 42.51 H new ATOM 0 HD11 LEU A 67 20.255 13.376 7.865 1.00 13.33 H new ATOM 0 HD12 LEU A 67 19.041 14.535 8.457 1.00 13.33 H new ATOM 0 HD13 LEU A 67 19.951 14.883 6.969 1.00 13.33 H new ATOM 0 HD21 LEU A 67 22.663 13.890 8.045 1.00 41.45 H new ATOM 0 HD22 LEU A 67 22.451 15.417 7.155 1.00 41.45 H new ATOM 0 HD23 LEU A 67 23.204 15.424 8.768 1.00 41.45 H new ATOM 1054 N HIS A 68 23.369 18.212 10.151 1.00 72.31 N ATOM 1055 CA HIS A 68 24.818 18.226 10.312 1.00 31.53 C ATOM 1056 C HIS A 68 25.204 18.630 11.731 1.00 12.35 C ATOM 1057 O HIS A 68 26.199 18.150 12.277 1.00 50.32 O ATOM 1058 CB HIS A 68 25.456 19.184 9.305 1.00 73.33 C ATOM 1059 CG HIS A 68 25.658 18.580 7.949 1.00 21.20 C ATOM 1060 ND1 HIS A 68 24.941 17.493 7.495 1.00 23.34 N ATOM 1061 CD2 HIS A 68 26.501 18.920 6.946 1.00 62.32 C ATOM 1062 CE1 HIS A 68 25.337 17.188 6.272 1.00 44.33 C ATOM 1063 NE2 HIS A 68 26.283 18.040 5.915 1.00 75.42 N ATOM 0 H HIS A 68 22.978 19.076 9.777 1.00 72.31 H new ATOM 0 HA HIS A 68 25.188 17.218 10.127 1.00 31.53 H new ATOM 0 HB2 HIS A 68 24.827 20.069 9.209 1.00 73.33 H new ATOM 0 HB3 HIS A 68 26.419 19.517 9.692 1.00 73.33 H new ATOM 0 HD2 HIS A 68 27.213 19.732 6.955 1.00 62.32 H new ATOM 0 HE1 HIS A 68 24.953 16.380 5.667 1.00 44.33 H new ATOM 0 HE2 HIS A 68 26.771 18.043 5.019 1.00 75.42 H new ATOM 1071 N LEU A 69 24.412 19.517 12.324 1.00 71.13 N ATOM 1072 CA LEU A 69 24.669 19.987 13.680 1.00 31.23 C ATOM 1073 C LEU A 69 24.850 18.814 14.639 1.00 23.42 C ATOM 1074 O LEU A 69 25.893 18.654 15.274 1.00 50.33 O ATOM 1075 CB LEU A 69 23.523 20.879 14.159 1.00 34.00 C ATOM 1076 CG LEU A 69 23.852 22.363 14.329 1.00 63.23 C ATOM 1077 CD1 LEU A 69 22.602 23.211 14.153 1.00 74.31 C ATOM 1078 CD2 LEU A 69 24.484 22.617 15.690 1.00 73.40 C ATOM 0 H LEU A 69 23.586 19.925 11.886 1.00 71.13 H new ATOM 0 HA LEU A 69 25.592 20.567 13.667 1.00 31.23 H new ATOM 0 HB2 LEU A 69 22.699 20.789 13.451 1.00 34.00 H new ATOM 0 HB3 LEU A 69 23.166 20.495 15.114 1.00 34.00 H new ATOM 0 HG LEU A 69 24.569 22.647 13.559 1.00 63.23 H new ATOM 0 HD11 LEU A 69 22.856 24.264 14.278 1.00 74.31 H new ATOM 0 HD12 LEU A 69 22.192 23.052 13.156 1.00 74.31 H new ATOM 0 HD13 LEU A 69 21.861 22.926 14.900 1.00 74.31 H new ATOM 0 HD21 LEU A 69 24.711 23.678 15.793 1.00 73.40 H new ATOM 0 HD22 LEU A 69 23.790 22.316 16.475 1.00 73.40 H new ATOM 0 HD23 LEU A 69 25.404 22.039 15.778 1.00 73.40 H new ATOM 1090 N PRO A 70 23.813 17.971 14.745 1.00 52.55 N ATOM 1091 CA PRO A 70 23.833 16.796 15.621 1.00 1.24 C ATOM 1092 C PRO A 70 24.785 15.716 15.120 1.00 25.02 C ATOM 1093 O PRO A 70 24.700 15.284 13.970 1.00 45.02 O ATOM 1094 CB PRO A 70 22.387 16.297 15.579 1.00 22.52 C ATOM 1095 CG PRO A 70 21.855 16.786 14.276 1.00 21.24 C ATOM 1096 CD PRO A 70 22.538 18.100 14.018 1.00 1.12 C ATOM 0 HA PRO A 70 24.184 17.041 16.623 1.00 1.24 H new ATOM 0 HB2 PRO A 70 22.341 15.210 15.642 1.00 22.52 H new ATOM 0 HB3 PRO A 70 21.808 16.689 16.415 1.00 22.52 H new ATOM 0 HG2 PRO A 70 22.064 16.074 13.477 1.00 21.24 H new ATOM 0 HG3 PRO A 70 20.773 16.910 14.318 1.00 21.24 H new ATOM 0 HD2 PRO A 70 22.698 18.267 12.953 1.00 1.12 H new ATOM 0 HD3 PRO A 70 21.948 18.939 14.387 1.00 1.12 H new ATOM 1104 N LEU A 71 25.692 15.283 15.989 1.00 3.23 N ATOM 1105 CA LEU A 71 26.661 14.252 15.633 1.00 34.23 C ATOM 1106 C LEU A 71 26.071 12.859 15.831 1.00 0.31 C ATOM 1107 O LEU A 71 26.530 11.887 15.229 1.00 41.24 O ATOM 1108 CB LEU A 71 27.930 14.405 16.475 1.00 53.03 C ATOM 1109 CG LEU A 71 28.772 15.650 16.200 1.00 44.25 C ATOM 1110 CD1 LEU A 71 28.372 16.783 17.132 1.00 30.13 C ATOM 1111 CD2 LEU A 71 30.253 15.335 16.344 1.00 4.44 C ATOM 0 H LEU A 71 25.777 15.630 16.945 1.00 3.23 H new ATOM 0 HA LEU A 71 26.914 14.373 14.580 1.00 34.23 H new ATOM 0 HB2 LEU A 71 27.645 14.409 17.527 1.00 53.03 H new ATOM 0 HB3 LEU A 71 28.555 13.526 16.317 1.00 53.03 H new ATOM 0 HG LEU A 71 28.588 15.970 15.174 1.00 44.25 H new ATOM 0 HD11 LEU A 71 28.983 17.661 16.921 1.00 30.13 H new ATOM 0 HD12 LEU A 71 27.321 17.027 16.978 1.00 30.13 H new ATOM 0 HD13 LEU A 71 28.525 16.475 18.166 1.00 30.13 H new ATOM 0 HD21 LEU A 71 30.837 16.233 16.145 1.00 4.44 H new ATOM 0 HD22 LEU A 71 30.454 14.989 17.358 1.00 4.44 H new ATOM 0 HD23 LEU A 71 30.530 14.557 15.633 1.00 4.44 H new ATOM 1123 N LEU A 72 25.050 12.769 16.676 1.00 13.21 N ATOM 1124 CA LEU A 72 24.395 11.496 16.953 1.00 70.14 C ATOM 1125 C LEU A 72 23.254 11.247 15.971 1.00 53.10 C ATOM 1126 O LEU A 72 22.464 10.317 16.145 1.00 3.33 O ATOM 1127 CB LEU A 72 23.863 11.473 18.387 1.00 62.44 C ATOM 1128 CG LEU A 72 24.918 11.417 19.492 1.00 51.33 C ATOM 1129 CD1 LEU A 72 24.267 11.568 20.859 1.00 43.53 C ATOM 1130 CD2 LEU A 72 25.703 10.116 19.415 1.00 25.20 C ATOM 0 H LEU A 72 24.658 13.563 17.182 1.00 13.21 H new ATOM 0 HA LEU A 72 25.133 10.703 16.834 1.00 70.14 H new ATOM 0 HB2 LEU A 72 23.251 12.362 18.541 1.00 62.44 H new ATOM 0 HB3 LEU A 72 23.205 10.611 18.496 1.00 62.44 H new ATOM 0 HG LEU A 72 25.611 12.246 19.348 1.00 51.33 H new ATOM 0 HD11 LEU A 72 25.033 11.526 21.633 1.00 43.53 H new ATOM 0 HD12 LEU A 72 23.750 12.526 20.912 1.00 43.53 H new ATOM 0 HD13 LEU A 72 23.551 10.760 21.012 1.00 43.53 H new ATOM 0 HD21 LEU A 72 26.449 10.094 20.209 1.00 25.20 H new ATOM 0 HD22 LEU A 72 25.022 9.273 19.533 1.00 25.20 H new ATOM 0 HD23 LEU A 72 26.201 10.048 18.448 1.00 25.20 H new ATOM 1142 N CYS A 73 23.175 12.081 14.940 1.00 43.22 N ATOM 1143 CA CYS A 73 22.131 11.951 13.930 1.00 21.41 C ATOM 1144 C CYS A 73 22.187 10.579 13.263 1.00 14.44 C ATOM 1145 O CYS A 73 22.965 9.716 13.666 1.00 73.43 O ATOM 1146 CB CYS A 73 22.273 13.049 12.876 1.00 64.23 C ATOM 1147 SG CYS A 73 23.862 13.043 12.013 1.00 3.24 S ATOM 0 H CYS A 73 23.821 12.854 14.782 1.00 43.22 H new ATOM 0 HA CYS A 73 21.166 12.055 14.425 1.00 21.41 H new ATOM 0 HB2 CYS A 73 21.473 12.940 12.143 1.00 64.23 H new ATOM 0 HB3 CYS A 73 22.136 14.018 13.356 1.00 64.23 H new ATOM 0 HG CYS A 73 24.640 13.947 12.530 1.00 3.24 H new ATOM 1153 N GLU A 74 21.355 10.388 12.245 1.00 63.32 N ATOM 1154 CA GLU A 74 21.309 9.120 11.526 1.00 45.24 C ATOM 1155 C GLU A 74 22.706 8.694 11.083 1.00 24.22 C ATOM 1156 O GLU A 74 23.003 7.503 10.987 1.00 54.14 O ATOM 1157 CB GLU A 74 20.389 9.233 10.308 1.00 23.42 C ATOM 1158 CG GLU A 74 19.005 9.764 10.638 1.00 42.23 C ATOM 1159 CD GLU A 74 18.708 11.084 9.955 1.00 43.53 C ATOM 1160 OE1 GLU A 74 19.047 12.140 10.532 1.00 72.53 O ATOM 1161 OE2 GLU A 74 18.138 11.065 8.845 1.00 53.33 O ATOM 0 H GLU A 74 20.704 11.094 11.900 1.00 63.32 H new ATOM 0 HA GLU A 74 20.914 8.362 12.203 1.00 45.24 H new ATOM 0 HB2 GLU A 74 20.854 9.888 9.571 1.00 23.42 H new ATOM 0 HB3 GLU A 74 20.291 8.251 9.845 1.00 23.42 H new ATOM 0 HG2 GLU A 74 18.257 9.029 10.340 1.00 42.23 H new ATOM 0 HG3 GLU A 74 18.916 9.890 11.717 1.00 42.23 H new ATOM 1168 N ASP A 75 23.560 9.676 10.815 1.00 4.10 N ATOM 1169 CA ASP A 75 24.927 9.404 10.384 1.00 51.50 C ATOM 1170 C ASP A 75 25.650 8.521 11.396 1.00 3.44 C ATOM 1171 O ASP A 75 26.500 7.708 11.032 1.00 45.35 O ATOM 1172 CB ASP A 75 25.693 10.714 10.190 1.00 34.44 C ATOM 1173 CG ASP A 75 26.828 10.578 9.194 1.00 33.33 C ATOM 1174 OD1 ASP A 75 26.603 9.992 8.113 1.00 13.23 O ATOM 1175 OD2 ASP A 75 27.941 11.058 9.494 1.00 20.51 O ATOM 0 H ASP A 75 23.330 10.667 10.888 1.00 4.10 H new ATOM 0 HA ASP A 75 24.884 8.874 9.433 1.00 51.50 H new ATOM 0 HB2 ASP A 75 25.005 11.487 9.849 1.00 34.44 H new ATOM 0 HB3 ASP A 75 26.092 11.044 11.149 1.00 34.44 H new ATOM 1180 N LYS A 76 25.309 8.687 12.669 1.00 44.32 N ATOM 1181 CA LYS A 76 25.925 7.906 13.735 1.00 13.21 C ATOM 1182 C LYS A 76 25.061 6.702 14.097 1.00 21.11 C ATOM 1183 O LYS A 76 25.225 6.106 15.160 1.00 63.20 O ATOM 1184 CB LYS A 76 26.146 8.779 14.973 1.00 43.14 C ATOM 1185 CG LYS A 76 27.606 8.920 15.364 1.00 22.11 C ATOM 1186 CD LYS A 76 27.879 8.311 16.730 1.00 61.54 C ATOM 1187 CE LYS A 76 29.371 8.143 16.977 1.00 51.23 C ATOM 1188 NZ LYS A 76 29.705 6.768 17.437 1.00 33.43 N ATOM 0 H LYS A 76 24.608 9.356 12.988 1.00 44.32 H new ATOM 0 HA LYS A 76 26.889 7.545 13.376 1.00 13.21 H new ATOM 0 HB2 LYS A 76 25.731 9.770 14.788 1.00 43.14 H new ATOM 0 HB3 LYS A 76 25.594 8.354 15.811 1.00 43.14 H new ATOM 0 HG2 LYS A 76 28.232 8.434 14.616 1.00 22.11 H new ATOM 0 HG3 LYS A 76 27.881 9.975 15.373 1.00 22.11 H new ATOM 0 HD2 LYS A 76 27.450 8.946 17.505 1.00 61.54 H new ATOM 0 HD3 LYS A 76 27.386 7.342 16.803 1.00 61.54 H new ATOM 0 HE2 LYS A 76 29.918 8.362 16.060 1.00 51.23 H new ATOM 0 HE3 LYS A 76 29.699 8.866 17.724 1.00 51.23 H new ATOM 0 HZ1 LYS A 76 30.730 6.694 17.594 1.00 33.43 H new ATOM 0 HZ2 LYS A 76 29.203 6.568 18.326 1.00 33.43 H new ATOM 0 HZ3 LYS A 76 29.415 6.080 16.713 1.00 33.43 H new ATOM 1202 N ASN A 77 24.141 6.351 13.204 1.00 55.31 N ATOM 1203 CA ASN A 77 23.252 5.217 13.429 1.00 14.00 C ATOM 1204 C ASN A 77 22.377 5.448 14.658 1.00 72.33 C ATOM 1205 O ASN A 77 22.633 4.895 15.728 1.00 14.53 O ATOM 1206 CB ASN A 77 24.064 3.931 13.602 1.00 41.53 C ATOM 1207 CG ASN A 77 24.142 3.121 12.323 1.00 0.00 C ATOM 1208 OD1 ASN A 77 23.351 2.203 12.107 1.00 22.23 O ATOM 1209 ND2 ASN A 77 25.100 3.459 11.466 1.00 13.32 N ATOM 0 H ASN A 77 23.992 6.835 12.319 1.00 55.31 H new ATOM 0 HA ASN A 77 22.605 5.116 12.557 1.00 14.00 H new ATOM 0 HB2 ASN A 77 25.072 4.182 13.932 1.00 41.53 H new ATOM 0 HB3 ASN A 77 23.614 3.323 14.387 1.00 41.53 H new ATOM 0 HD21 ASN A 77 25.201 2.950 10.588 1.00 13.32 H new ATOM 0 HD22 ASN A 77 25.734 4.227 11.686 1.00 13.32 H new ATOM 1216 N VAL A 78 21.342 6.267 14.496 1.00 30.50 N ATOM 1217 CA VAL A 78 20.427 6.569 15.590 1.00 1.44 C ATOM 1218 C VAL A 78 19.022 6.851 15.071 1.00 3.42 C ATOM 1219 O VAL A 78 18.826 7.603 14.115 1.00 34.53 O ATOM 1220 CB VAL A 78 20.913 7.780 16.408 1.00 13.21 C ATOM 1221 CG1 VAL A 78 19.949 8.077 17.548 1.00 21.44 C ATOM 1222 CG2 VAL A 78 22.319 7.537 16.937 1.00 75.24 C ATOM 0 H VAL A 78 21.117 6.733 13.617 1.00 30.50 H new ATOM 0 HA VAL A 78 20.402 5.690 16.234 1.00 1.44 H new ATOM 0 HB VAL A 78 20.942 8.650 15.753 1.00 13.21 H new ATOM 0 HG11 VAL A 78 20.309 8.936 18.115 1.00 21.44 H new ATOM 0 HG12 VAL A 78 18.962 8.298 17.142 1.00 21.44 H new ATOM 0 HG13 VAL A 78 19.885 7.210 18.205 1.00 21.44 H new ATOM 0 HG21 VAL A 78 22.646 8.403 17.512 1.00 75.24 H new ATOM 0 HG22 VAL A 78 22.319 6.655 17.577 1.00 75.24 H new ATOM 0 HG23 VAL A 78 23.000 7.379 16.101 1.00 75.24 H new ATOM 1232 N PRO A 79 18.019 6.235 15.713 1.00 1.14 N ATOM 1233 CA PRO A 79 16.614 6.405 15.334 1.00 50.14 C ATOM 1234 C PRO A 79 16.092 7.801 15.654 1.00 51.22 C ATOM 1235 O PRO A 79 15.985 8.184 16.820 1.00 70.30 O ATOM 1236 CB PRO A 79 15.888 5.356 16.181 1.00 4.40 C ATOM 1237 CG PRO A 79 16.773 5.144 17.360 1.00 31.43 C ATOM 1238 CD PRO A 79 18.180 5.325 16.861 1.00 5.51 C ATOM 0 HA PRO A 79 16.464 6.285 14.261 1.00 50.14 H new ATOM 0 HB2 PRO A 79 14.901 5.706 16.484 1.00 4.40 H new ATOM 0 HB3 PRO A 79 15.741 4.430 15.625 1.00 4.40 H new ATOM 0 HG2 PRO A 79 16.545 5.857 18.152 1.00 31.43 H new ATOM 0 HG3 PRO A 79 16.633 4.147 17.779 1.00 31.43 H new ATOM 0 HD2 PRO A 79 18.826 5.754 17.627 1.00 5.51 H new ATOM 0 HD3 PRO A 79 18.626 4.376 16.563 1.00 5.51 H new ATOM 1246 N TYR A 80 15.767 8.559 14.612 1.00 54.44 N ATOM 1247 CA TYR A 80 15.258 9.915 14.783 1.00 60.03 C ATOM 1248 C TYR A 80 13.747 9.960 14.572 1.00 63.25 C ATOM 1249 O TYR A 80 13.118 8.942 14.284 1.00 62.12 O ATOM 1250 CB TYR A 80 15.948 10.869 13.807 1.00 62.51 C ATOM 1251 CG TYR A 80 17.059 11.679 14.436 1.00 75.11 C ATOM 1252 CD1 TYR A 80 17.978 11.086 15.293 1.00 13.35 C ATOM 1253 CD2 TYR A 80 17.190 13.037 14.174 1.00 75.30 C ATOM 1254 CE1 TYR A 80 18.994 11.822 15.872 1.00 44.52 C ATOM 1255 CE2 TYR A 80 18.203 13.781 14.746 1.00 42.20 C ATOM 1256 CZ TYR A 80 19.103 13.169 15.594 1.00 53.31 C ATOM 1257 OH TYR A 80 20.113 13.907 16.168 1.00 64.01 O ATOM 0 H TYR A 80 15.847 8.258 13.641 1.00 54.44 H new ATOM 0 HA TYR A 80 15.475 10.231 15.804 1.00 60.03 H new ATOM 0 HB2 TYR A 80 16.355 10.293 12.976 1.00 62.51 H new ATOM 0 HB3 TYR A 80 15.205 11.549 13.390 1.00 62.51 H new ATOM 0 HD1 TYR A 80 17.897 10.031 15.510 1.00 13.35 H new ATOM 0 HD2 TYR A 80 16.487 13.519 13.511 1.00 75.30 H new ATOM 0 HE1 TYR A 80 19.698 11.346 16.538 1.00 44.52 H new ATOM 0 HE2 TYR A 80 18.290 14.836 14.531 1.00 42.20 H new ATOM 0 HH TYR A 80 20.049 14.838 15.868 1.00 64.01 H new ATOM 1267 N VAL A 81 13.171 11.149 14.717 1.00 24.20 N ATOM 1268 CA VAL A 81 11.734 11.329 14.541 1.00 5.25 C ATOM 1269 C VAL A 81 11.417 12.728 14.024 1.00 52.13 C ATOM 1270 O VAL A 81 12.044 13.708 14.426 1.00 63.33 O ATOM 1271 CB VAL A 81 10.974 11.096 15.859 1.00 20.11 C ATOM 1272 CG1 VAL A 81 11.256 9.701 16.399 1.00 44.21 C ATOM 1273 CG2 VAL A 81 11.345 12.157 16.884 1.00 45.13 C ATOM 0 H VAL A 81 13.677 12.002 14.956 1.00 24.20 H new ATOM 0 HA VAL A 81 11.409 10.591 13.808 1.00 5.25 H new ATOM 0 HB VAL A 81 9.905 11.174 15.660 1.00 20.11 H new ATOM 0 HG11 VAL A 81 10.710 9.554 17.331 1.00 44.21 H new ATOM 0 HG12 VAL A 81 10.935 8.957 15.670 1.00 44.21 H new ATOM 0 HG13 VAL A 81 12.325 9.591 16.583 1.00 44.21 H new ATOM 0 HG21 VAL A 81 10.798 11.976 17.809 1.00 45.13 H new ATOM 0 HG22 VAL A 81 12.416 12.114 17.081 1.00 45.13 H new ATOM 0 HG23 VAL A 81 11.087 13.143 16.497 1.00 45.13 H new ATOM 1283 N PHE A 82 10.435 12.814 13.132 1.00 21.01 N ATOM 1284 CA PHE A 82 10.032 14.093 12.558 1.00 12.32 C ATOM 1285 C PHE A 82 8.625 14.471 13.010 1.00 64.03 C ATOM 1286 O PHE A 82 7.857 13.622 13.462 1.00 41.34 O ATOM 1287 CB PHE A 82 10.092 14.033 11.031 1.00 22.15 C ATOM 1288 CG PHE A 82 11.428 13.597 10.500 1.00 2.43 C ATOM 1289 CD1 PHE A 82 12.502 14.474 10.485 1.00 64.53 C ATOM 1290 CD2 PHE A 82 11.610 12.312 10.016 1.00 2.04 C ATOM 1291 CE1 PHE A 82 13.733 14.076 9.997 1.00 53.00 C ATOM 1292 CE2 PHE A 82 12.839 11.908 9.529 1.00 44.32 C ATOM 1293 CZ PHE A 82 13.901 12.792 9.517 1.00 75.30 C ATOM 0 H PHE A 82 9.904 12.013 12.791 1.00 21.01 H new ATOM 0 HA PHE A 82 10.725 14.857 12.911 1.00 12.32 H new ATOM 0 HB2 PHE A 82 9.326 13.346 10.672 1.00 22.15 H new ATOM 0 HB3 PHE A 82 9.853 15.017 10.627 1.00 22.15 H new ATOM 0 HD1 PHE A 82 12.376 15.479 10.859 1.00 64.53 H new ATOM 0 HD2 PHE A 82 10.782 11.618 10.019 1.00 2.04 H new ATOM 0 HE1 PHE A 82 14.562 14.768 9.991 1.00 53.00 H new ATOM 0 HE2 PHE A 82 12.969 10.902 9.158 1.00 44.32 H new ATOM 0 HZ PHE A 82 14.861 12.479 9.133 1.00 75.30 H new ATOM 1303 N VAL A 83 8.294 15.752 12.883 1.00 50.24 N ATOM 1304 CA VAL A 83 6.979 16.244 13.276 1.00 44.55 C ATOM 1305 C VAL A 83 6.454 17.270 12.277 1.00 31.52 C ATOM 1306 O VAL A 83 7.216 17.826 11.485 1.00 74.13 O ATOM 1307 CB VAL A 83 7.014 16.882 14.678 1.00 43.22 C ATOM 1308 CG1 VAL A 83 7.380 15.843 15.727 1.00 12.40 C ATOM 1309 CG2 VAL A 83 7.990 18.048 14.707 1.00 51.43 C ATOM 0 H VAL A 83 8.918 16.468 12.511 1.00 50.24 H new ATOM 0 HA VAL A 83 6.312 15.382 13.293 1.00 44.55 H new ATOM 0 HB VAL A 83 6.020 17.264 14.911 1.00 43.22 H new ATOM 0 HG11 VAL A 83 7.400 16.311 16.711 1.00 12.40 H new ATOM 0 HG12 VAL A 83 6.640 15.043 15.721 1.00 12.40 H new ATOM 0 HG13 VAL A 83 8.363 15.429 15.502 1.00 12.40 H new ATOM 0 HG21 VAL A 83 8.002 18.487 15.704 1.00 51.43 H new ATOM 0 HG22 VAL A 83 8.989 17.693 14.454 1.00 51.43 H new ATOM 0 HG23 VAL A 83 7.679 18.801 13.983 1.00 51.43 H new ATOM 1319 N ARG A 84 5.148 17.516 12.320 1.00 22.54 N ATOM 1320 CA ARG A 84 4.522 18.474 11.417 1.00 42.35 C ATOM 1321 C ARG A 84 3.992 19.681 12.187 1.00 34.44 C ATOM 1322 O ARG A 84 2.823 20.046 12.061 1.00 24.53 O ATOM 1323 CB ARG A 84 3.382 17.809 10.644 1.00 74.33 C ATOM 1324 CG ARG A 84 3.102 18.452 9.297 1.00 60.33 C ATOM 1325 CD ARG A 84 1.642 18.852 9.162 1.00 52.55 C ATOM 1326 NE ARG A 84 1.208 18.885 7.768 1.00 35.03 N ATOM 1327 CZ ARG A 84 1.529 19.856 6.921 1.00 41.23 C ATOM 1328 NH1 ARG A 84 2.282 20.870 7.325 1.00 40.44 N ATOM 1329 NH2 ARG A 84 1.096 19.815 5.667 1.00 53.13 N ATOM 0 H ARG A 84 4.504 17.065 12.970 1.00 22.54 H new ATOM 0 HA ARG A 84 5.278 18.818 10.712 1.00 42.35 H new ATOM 0 HB2 ARG A 84 3.623 16.757 10.491 1.00 74.33 H new ATOM 0 HB3 ARG A 84 2.476 17.844 11.249 1.00 74.33 H new ATOM 0 HG2 ARG A 84 3.734 19.332 9.174 1.00 60.33 H new ATOM 0 HG3 ARG A 84 3.365 17.757 8.499 1.00 60.33 H new ATOM 0 HD2 ARG A 84 1.021 18.149 9.718 1.00 52.55 H new ATOM 0 HD3 ARG A 84 1.493 19.834 9.611 1.00 52.55 H new ATOM 0 HE ARG A 84 0.626 18.120 7.426 1.00 35.03 H new ATOM 0 HH11 ARG A 84 2.616 20.905 8.288 1.00 40.44 H new ATOM 0 HH12 ARG A 84 2.527 21.615 6.673 1.00 40.44 H new ATOM 0 HH21 ARG A 84 0.516 19.037 5.353 1.00 53.13 H new ATOM 0 HH22 ARG A 84 1.343 20.562 5.017 1.00 53.13 H new ATOM 1343 N SER A 85 4.860 20.293 12.986 1.00 23.32 N ATOM 1344 CA SER A 85 4.479 21.455 13.780 1.00 24.11 C ATOM 1345 C SER A 85 5.712 22.155 14.344 1.00 72.20 C ATOM 1346 O SER A 85 6.557 21.529 14.985 1.00 1.33 O ATOM 1347 CB SER A 85 3.549 21.038 14.920 1.00 73.10 C ATOM 1348 OG SER A 85 4.097 19.957 15.656 1.00 11.53 O ATOM 0 H SER A 85 5.831 20.004 13.101 1.00 23.32 H new ATOM 0 HA SER A 85 3.952 22.153 13.129 1.00 24.11 H new ATOM 0 HB2 SER A 85 3.380 21.886 15.584 1.00 73.10 H new ATOM 0 HB3 SER A 85 2.578 20.752 14.515 1.00 73.10 H new ATOM 0 HG SER A 85 5.073 20.041 15.683 1.00 11.53 H new ATOM 1354 N LYS A 86 5.808 23.458 14.101 1.00 12.51 N ATOM 1355 CA LYS A 86 6.935 24.246 14.586 1.00 42.23 C ATOM 1356 C LYS A 86 6.517 25.136 15.751 1.00 15.42 C ATOM 1357 O LYS A 86 7.305 25.393 16.661 1.00 2.51 O ATOM 1358 CB LYS A 86 7.507 25.104 13.454 1.00 32.04 C ATOM 1359 CG LYS A 86 6.454 25.900 12.703 1.00 55.42 C ATOM 1360 CD LYS A 86 7.080 26.793 11.645 1.00 61.22 C ATOM 1361 CE LYS A 86 6.510 28.202 11.697 1.00 44.31 C ATOM 1362 NZ LYS A 86 7.551 29.232 11.426 1.00 22.43 N ATOM 0 H LYS A 86 5.118 23.991 13.571 1.00 12.51 H new ATOM 0 HA LYS A 86 7.703 23.557 14.937 1.00 42.23 H new ATOM 0 HB2 LYS A 86 8.244 25.792 13.868 1.00 32.04 H new ATOM 0 HB3 LYS A 86 8.033 24.459 12.750 1.00 32.04 H new ATOM 0 HG2 LYS A 86 5.747 25.217 12.232 1.00 55.42 H new ATOM 0 HG3 LYS A 86 5.887 26.510 13.406 1.00 55.42 H new ATOM 0 HD2 LYS A 86 8.160 26.830 11.791 1.00 61.22 H new ATOM 0 HD3 LYS A 86 6.907 26.365 10.657 1.00 61.22 H new ATOM 0 HE2 LYS A 86 5.707 28.296 10.966 1.00 44.31 H new ATOM 0 HE3 LYS A 86 6.070 28.380 12.678 1.00 44.31 H new ATOM 0 HZ1 LYS A 86 7.123 30.179 11.471 1.00 22.43 H new ATOM 0 HZ2 LYS A 86 8.305 29.159 12.139 1.00 22.43 H new ATOM 0 HZ3 LYS A 86 7.953 29.078 10.479 1.00 22.43 H new ATOM 1376 N GLN A 87 5.272 25.601 15.718 1.00 71.41 N ATOM 1377 CA GLN A 87 4.750 26.461 16.773 1.00 54.05 C ATOM 1378 C GLN A 87 4.499 25.665 18.049 1.00 14.51 C ATOM 1379 O GLN A 87 4.761 26.145 19.153 1.00 71.35 O ATOM 1380 CB GLN A 87 3.455 27.136 16.316 1.00 61.01 C ATOM 1381 CG GLN A 87 3.610 28.622 16.034 1.00 20.45 C ATOM 1382 CD GLN A 87 2.645 29.118 14.976 1.00 72.33 C ATOM 1383 OE1 GLN A 87 3.038 29.395 13.842 1.00 42.32 O ATOM 1384 NE2 GLN A 87 1.374 29.234 15.341 1.00 51.12 N ATOM 0 H GLN A 87 4.607 25.397 14.972 1.00 71.41 H new ATOM 0 HA GLN A 87 5.496 27.227 16.985 1.00 54.05 H new ATOM 0 HB2 GLN A 87 3.095 26.639 15.415 1.00 61.01 H new ATOM 0 HB3 GLN A 87 2.693 26.998 17.083 1.00 61.01 H new ATOM 0 HG2 GLN A 87 3.452 29.181 16.956 1.00 20.45 H new ATOM 0 HG3 GLN A 87 4.632 28.822 15.711 1.00 20.45 H new ATOM 0 HE21 GLN A 87 1.092 28.993 16.291 1.00 51.12 H new ATOM 0 HE22 GLN A 87 0.679 29.564 14.671 1.00 51.12 H new ATOM 1393 N ALA A 88 3.989 24.448 17.892 1.00 14.20 N ATOM 1394 CA ALA A 88 3.705 23.585 19.032 1.00 54.11 C ATOM 1395 C ALA A 88 4.976 23.274 19.816 1.00 61.22 C ATOM 1396 O ALA A 88 4.951 23.167 21.043 1.00 42.35 O ATOM 1397 CB ALA A 88 3.040 22.298 18.568 1.00 65.00 C ATOM 0 H ALA A 88 3.764 24.037 16.986 1.00 14.20 H new ATOM 0 HA ALA A 88 3.021 24.115 19.695 1.00 54.11 H new ATOM 0 HB1 ALA A 88 2.834 21.664 19.430 1.00 65.00 H new ATOM 0 HB2 ALA A 88 2.105 22.534 18.060 1.00 65.00 H new ATOM 0 HB3 ALA A 88 3.704 21.773 17.881 1.00 65.00 H new ATOM 1403 N LEU A 89 6.085 23.127 19.100 1.00 11.23 N ATOM 1404 CA LEU A 89 7.367 22.827 19.729 1.00 65.51 C ATOM 1405 C LEU A 89 7.748 23.910 20.732 1.00 70.51 C ATOM 1406 O LEU A 89 7.947 23.633 21.914 1.00 41.25 O ATOM 1407 CB LEU A 89 8.459 22.693 18.666 1.00 52.12 C ATOM 1408 CG LEU A 89 9.859 22.356 19.181 1.00 73.03 C ATOM 1409 CD1 LEU A 89 9.855 21.013 19.896 1.00 5.51 C ATOM 1410 CD2 LEU A 89 10.861 22.349 18.036 1.00 63.41 C ATOM 0 H LEU A 89 6.123 23.211 18.084 1.00 11.23 H new ATOM 0 HA LEU A 89 7.270 21.882 20.263 1.00 65.51 H new ATOM 0 HB2 LEU A 89 8.158 21.920 17.960 1.00 52.12 H new ATOM 0 HB3 LEU A 89 8.514 23.629 18.110 1.00 52.12 H new ATOM 0 HG LEU A 89 10.158 23.124 19.894 1.00 73.03 H new ATOM 0 HD11 LEU A 89 10.859 20.789 20.256 1.00 5.51 H new ATOM 0 HD12 LEU A 89 9.167 21.053 20.741 1.00 5.51 H new ATOM 0 HD13 LEU A 89 9.535 20.234 19.204 1.00 5.51 H new ATOM 0 HD21 LEU A 89 11.852 22.107 18.421 1.00 63.41 H new ATOM 0 HD22 LEU A 89 10.566 21.602 17.299 1.00 63.41 H new ATOM 0 HD23 LEU A 89 10.884 23.333 17.567 1.00 63.41 H new ATOM 1422 N GLY A 90 7.848 25.146 20.252 1.00 55.42 N ATOM 1423 CA GLY A 90 8.202 26.252 21.121 1.00 10.41 C ATOM 1424 C GLY A 90 7.187 26.472 22.226 1.00 33.51 C ATOM 1425 O GLY A 90 7.534 26.929 23.315 1.00 61.43 O ATOM 0 H GLY A 90 7.690 25.400 19.277 1.00 55.42 H new ATOM 0 HA2 GLY A 90 9.180 26.063 21.563 1.00 10.41 H new ATOM 0 HA3 GLY A 90 8.291 27.162 20.527 1.00 10.41 H new ATOM 1429 N ARG A 91 5.930 26.146 21.945 1.00 22.30 N ATOM 1430 CA ARG A 91 4.861 26.311 22.922 1.00 12.23 C ATOM 1431 C ARG A 91 5.119 25.459 24.161 1.00 30.13 C ATOM 1432 O ARG A 91 5.161 25.968 25.280 1.00 1.24 O ATOM 1433 CB ARG A 91 3.512 25.936 22.304 1.00 3.52 C ATOM 1434 CG ARG A 91 2.652 27.138 21.945 1.00 21.40 C ATOM 1435 CD ARG A 91 1.651 26.798 20.852 1.00 40.13 C ATOM 1436 NE ARG A 91 0.744 27.908 20.577 1.00 54.43 N ATOM 1437 CZ ARG A 91 1.096 28.996 19.901 1.00 4.34 C ATOM 1438 NH1 ARG A 91 2.331 29.119 19.433 1.00 75.32 N ATOM 1439 NH2 ARG A 91 0.213 29.964 19.692 1.00 44.31 N ATOM 0 H ARG A 91 5.627 25.766 21.048 1.00 22.30 H new ATOM 0 HA ARG A 91 4.837 27.359 23.221 1.00 12.23 H new ATOM 0 HB2 ARG A 91 3.685 25.343 21.406 1.00 3.52 H new ATOM 0 HB3 ARG A 91 2.965 25.304 23.003 1.00 3.52 H new ATOM 0 HG2 ARG A 91 2.121 27.485 22.831 1.00 21.40 H new ATOM 0 HG3 ARG A 91 3.290 27.958 21.614 1.00 21.40 H new ATOM 0 HD2 ARG A 91 2.186 26.533 19.940 1.00 40.13 H new ATOM 0 HD3 ARG A 91 1.073 25.923 21.149 1.00 40.13 H new ATOM 0 HE ARG A 91 -0.213 27.845 20.923 1.00 54.43 H new ATOM 0 HH11 ARG A 91 3.013 28.377 19.592 1.00 75.32 H new ATOM 0 HH12 ARG A 91 2.599 29.955 18.914 1.00 75.32 H new ATOM 0 HH21 ARG A 91 -0.738 29.873 20.051 1.00 44.31 H new ATOM 0 HH22 ARG A 91 0.485 30.799 19.173 1.00 44.31 H new ATOM 1453 N ALA A 92 5.291 24.157 23.952 1.00 52.30 N ATOM 1454 CA ALA A 92 5.546 23.235 25.051 1.00 65.53 C ATOM 1455 C ALA A 92 6.869 23.553 25.739 1.00 43.41 C ATOM 1456 O ALA A 92 7.061 23.237 26.913 1.00 75.00 O ATOM 1457 CB ALA A 92 5.544 21.799 24.545 1.00 13.54 C ATOM 0 H ALA A 92 5.258 23.718 23.032 1.00 52.30 H new ATOM 0 HA ALA A 92 4.748 23.352 25.784 1.00 65.53 H new ATOM 0 HB1 ALA A 92 5.736 21.120 25.376 1.00 13.54 H new ATOM 0 HB2 ALA A 92 4.573 21.569 24.105 1.00 13.54 H new ATOM 0 HB3 ALA A 92 6.322 21.678 23.791 1.00 13.54 H new ATOM 1463 N CYS A 93 7.779 24.180 25.001 1.00 2.40 N ATOM 1464 CA CYS A 93 9.085 24.541 25.541 1.00 62.51 C ATOM 1465 C CYS A 93 8.993 25.806 26.388 1.00 60.01 C ATOM 1466 O CYS A 93 9.725 25.966 27.363 1.00 11.41 O ATOM 1467 CB CYS A 93 10.091 24.743 24.406 1.00 52.11 C ATOM 1468 SG CYS A 93 10.645 23.207 23.628 1.00 43.42 S ATOM 0 H CYS A 93 7.636 24.449 24.027 1.00 2.40 H new ATOM 0 HA CYS A 93 9.426 23.725 26.178 1.00 62.51 H new ATOM 0 HB2 CYS A 93 9.641 25.381 23.645 1.00 52.11 H new ATOM 0 HB3 CYS A 93 10.960 25.274 24.795 1.00 52.11 H new ATOM 0 HG CYS A 93 9.805 22.865 22.696 1.00 43.42 H new ATOM 1474 N GLY A 94 8.090 26.703 26.006 1.00 61.44 N ATOM 1475 CA GLY A 94 7.920 27.944 26.740 1.00 61.44 C ATOM 1476 C GLY A 94 8.902 29.014 26.304 1.00 35.43 C ATOM 1477 O GLY A 94 9.694 29.504 27.109 1.00 74.15 O ATOM 0 H GLY A 94 7.473 26.593 25.201 1.00 61.44 H new ATOM 0 HA2 GLY A 94 6.903 28.309 26.599 1.00 61.44 H new ATOM 0 HA3 GLY A 94 8.045 27.752 27.806 1.00 61.44 H new ATOM 1481 N VAL A 95 8.853 29.375 25.026 1.00 0.40 N ATOM 1482 CA VAL A 95 9.746 30.393 24.485 1.00 22.40 C ATOM 1483 C VAL A 95 8.962 31.488 23.770 1.00 1.14 C ATOM 1484 O VAL A 95 7.923 31.227 23.165 1.00 31.01 O ATOM 1485 CB VAL A 95 10.764 29.782 23.504 1.00 20.31 C ATOM 1486 CG1 VAL A 95 11.768 30.833 23.052 1.00 75.31 C ATOM 1487 CG2 VAL A 95 11.473 28.596 24.141 1.00 51.54 C ATOM 0 H VAL A 95 8.205 28.978 24.346 1.00 0.40 H new ATOM 0 HA VAL A 95 10.281 30.826 25.330 1.00 22.40 H new ATOM 0 HB VAL A 95 10.226 29.426 22.626 1.00 20.31 H new ATOM 0 HG11 VAL A 95 12.479 30.383 22.359 1.00 75.31 H new ATOM 0 HG12 VAL A 95 11.242 31.648 22.554 1.00 75.31 H new ATOM 0 HG13 VAL A 95 12.302 31.222 23.919 1.00 75.31 H new ATOM 0 HG21 VAL A 95 12.188 28.177 23.433 1.00 51.54 H new ATOM 0 HG22 VAL A 95 11.999 28.925 25.037 1.00 51.54 H new ATOM 0 HG23 VAL A 95 10.740 27.835 24.409 1.00 51.54 H new ATOM 1497 N SER A 96 9.468 32.715 23.845 1.00 21.54 N ATOM 1498 CA SER A 96 8.814 33.852 23.208 1.00 14.10 C ATOM 1499 C SER A 96 8.707 33.642 21.701 1.00 51.43 C ATOM 1500 O SER A 96 7.700 33.992 21.085 1.00 44.34 O ATOM 1501 CB SER A 96 9.583 35.141 23.501 1.00 14.02 C ATOM 1502 OG SER A 96 10.982 34.913 23.494 1.00 54.43 O ATOM 0 H SER A 96 10.329 32.947 24.341 1.00 21.54 H new ATOM 0 HA SER A 96 7.808 33.937 23.619 1.00 14.10 H new ATOM 0 HB2 SER A 96 9.331 35.896 22.756 1.00 14.02 H new ATOM 0 HB3 SER A 96 9.281 35.536 24.471 1.00 14.02 H new ATOM 0 HG SER A 96 11.451 35.753 23.682 1.00 54.43 H new ATOM 1508 N ARG A 97 9.751 33.069 21.114 1.00 20.42 N ATOM 1509 CA ARG A 97 9.777 32.812 19.679 1.00 42.31 C ATOM 1510 C ARG A 97 9.846 31.315 19.395 1.00 22.42 C ATOM 1511 O ARG A 97 10.222 30.513 20.250 1.00 45.23 O ATOM 1512 CB ARG A 97 10.969 33.521 19.033 1.00 34.23 C ATOM 1513 CG ARG A 97 10.585 34.754 18.232 1.00 55.32 C ATOM 1514 CD ARG A 97 11.594 35.040 17.131 1.00 34.22 C ATOM 1515 NE ARG A 97 11.505 36.417 16.651 1.00 31.43 N ATOM 1516 CZ ARG A 97 11.975 37.461 17.324 1.00 32.31 C ATOM 1517 NH1 ARG A 97 12.564 37.286 18.499 1.00 72.54 N ATOM 1518 NH2 ARG A 97 11.857 38.683 16.822 1.00 65.10 N ATOM 0 H ARG A 97 10.592 32.773 21.610 1.00 20.42 H new ATOM 0 HA ARG A 97 8.855 33.203 19.249 1.00 42.31 H new ATOM 0 HB2 ARG A 97 11.675 33.810 19.812 1.00 34.23 H new ATOM 0 HB3 ARG A 97 11.486 32.820 18.378 1.00 34.23 H new ATOM 0 HG2 ARG A 97 9.597 34.611 17.794 1.00 55.32 H new ATOM 0 HG3 ARG A 97 10.517 35.615 18.897 1.00 55.32 H new ATOM 0 HD2 ARG A 97 12.601 34.850 17.504 1.00 34.22 H new ATOM 0 HD3 ARG A 97 11.427 34.355 16.300 1.00 34.22 H new ATOM 0 HE ARG A 97 11.058 36.586 15.750 1.00 31.43 H new ATOM 0 HH11 ARG A 97 12.657 36.348 18.888 1.00 72.54 H new ATOM 0 HH12 ARG A 97 12.924 38.090 19.014 1.00 72.54 H new ATOM 0 HH21 ARG A 97 11.405 38.822 15.918 1.00 65.10 H new ATOM 0 HH22 ARG A 97 12.218 39.484 17.340 1.00 65.10 H new ATOM 1532 N PRO A 98 9.475 30.928 18.164 1.00 35.25 N ATOM 1533 CA PRO A 98 9.487 29.525 17.739 1.00 11.15 C ATOM 1534 C PRO A 98 10.902 28.976 17.592 1.00 2.12 C ATOM 1535 O PRO A 98 11.878 29.725 17.638 1.00 54.54 O ATOM 1536 CB PRO A 98 8.783 29.561 16.380 1.00 33.41 C ATOM 1537 CG PRO A 98 8.998 30.947 15.878 1.00 11.13 C ATOM 1538 CD PRO A 98 9.017 31.830 17.095 1.00 55.31 C ATOM 0 HA PRO A 98 9.004 28.874 18.468 1.00 11.15 H new ATOM 0 HB2 PRO A 98 9.203 28.823 15.697 1.00 33.41 H new ATOM 0 HB3 PRO A 98 7.721 29.336 16.478 1.00 33.41 H new ATOM 0 HG2 PRO A 98 9.936 31.021 15.327 1.00 11.13 H new ATOM 0 HG3 PRO A 98 8.202 31.242 15.194 1.00 11.13 H new ATOM 0 HD2 PRO A 98 9.692 32.676 16.967 1.00 55.31 H new ATOM 0 HD3 PRO A 98 8.030 32.239 17.310 1.00 55.31 H new ATOM 1546 N VAL A 99 11.007 27.663 17.413 1.00 63.42 N ATOM 1547 CA VAL A 99 12.303 27.014 17.257 1.00 5.11 C ATOM 1548 C VAL A 99 12.232 25.883 16.237 1.00 53.14 C ATOM 1549 O VAL A 99 11.197 25.231 16.089 1.00 51.32 O ATOM 1550 CB VAL A 99 12.814 26.451 18.597 1.00 60.24 C ATOM 1551 CG1 VAL A 99 11.934 25.301 19.062 1.00 33.22 C ATOM 1552 CG2 VAL A 99 14.263 26.008 18.469 1.00 33.43 C ATOM 0 H VAL A 99 10.210 27.028 17.372 1.00 63.42 H new ATOM 0 HA VAL A 99 12.998 27.776 16.903 1.00 5.11 H new ATOM 0 HB VAL A 99 12.765 27.240 19.347 1.00 60.24 H new ATOM 0 HG11 VAL A 99 12.310 24.916 20.010 1.00 33.22 H new ATOM 0 HG12 VAL A 99 10.912 25.655 19.194 1.00 33.22 H new ATOM 0 HG13 VAL A 99 11.949 24.507 18.316 1.00 33.22 H new ATOM 0 HG21 VAL A 99 14.608 25.613 19.424 1.00 33.43 H new ATOM 0 HG22 VAL A 99 14.341 25.233 17.706 1.00 33.43 H new ATOM 0 HG23 VAL A 99 14.880 26.860 18.184 1.00 33.43 H new ATOM 1562 N ILE A 100 13.337 25.654 15.537 1.00 1.20 N ATOM 1563 CA ILE A 100 13.400 24.601 14.531 1.00 32.21 C ATOM 1564 C ILE A 100 14.177 23.394 15.048 1.00 14.22 C ATOM 1565 O ILE A 100 13.694 22.264 14.999 1.00 41.24 O ATOM 1566 CB ILE A 100 14.056 25.102 13.232 1.00 61.34 C ATOM 1567 CG1 ILE A 100 13.430 26.427 12.796 1.00 50.31 C ATOM 1568 CG2 ILE A 100 13.918 24.058 12.132 1.00 53.20 C ATOM 1569 CD1 ILE A 100 14.063 27.017 11.556 1.00 3.44 C ATOM 0 H ILE A 100 14.202 26.184 15.648 1.00 1.20 H new ATOM 0 HA ILE A 100 12.373 24.305 14.318 1.00 32.21 H new ATOM 0 HB ILE A 100 15.117 25.267 13.419 1.00 61.34 H new ATOM 0 HG12 ILE A 100 12.366 26.274 12.613 1.00 50.31 H new ATOM 0 HG13 ILE A 100 13.513 27.144 13.612 1.00 50.31 H new ATOM 0 HG21 ILE A 100 14.387 24.427 11.220 1.00 53.20 H new ATOM 0 HG22 ILE A 100 14.407 23.135 12.443 1.00 53.20 H new ATOM 0 HG23 ILE A 100 12.862 23.864 11.945 1.00 53.20 H new ATOM 0 HD11 ILE A 100 13.568 27.955 11.306 1.00 3.44 H new ATOM 0 HD12 ILE A 100 15.121 27.203 11.741 1.00 3.44 H new ATOM 0 HD13 ILE A 100 13.957 26.319 10.726 1.00 3.44 H new ATOM 1581 N ALA A 101 15.385 23.644 15.546 1.00 71.32 N ATOM 1582 CA ALA A 101 16.227 22.579 16.075 1.00 2.41 C ATOM 1583 C ALA A 101 16.198 22.563 17.599 1.00 14.14 C ATOM 1584 O ALA A 101 16.608 23.526 18.249 1.00 64.40 O ATOM 1585 CB ALA A 101 17.655 22.739 15.575 1.00 65.34 C ATOM 0 H ALA A 101 15.801 24.574 15.594 1.00 71.32 H new ATOM 0 HA ALA A 101 15.833 21.627 15.720 1.00 2.41 H new ATOM 0 HB1 ALA A 101 18.274 21.937 15.978 1.00 65.34 H new ATOM 0 HB2 ALA A 101 17.666 22.694 14.486 1.00 65.34 H new ATOM 0 HB3 ALA A 101 18.050 23.701 15.903 1.00 65.34 H new ATOM 1591 N CYS A 102 15.709 21.465 18.165 1.00 15.03 N ATOM 1592 CA CYS A 102 15.625 21.324 19.615 1.00 70.55 C ATOM 1593 C CYS A 102 16.277 20.024 20.074 1.00 45.11 C ATOM 1594 O CYS A 102 16.654 19.185 19.256 1.00 20.30 O ATOM 1595 CB CYS A 102 14.165 21.364 20.067 1.00 71.25 C ATOM 1596 SG CYS A 102 13.212 19.893 19.619 1.00 5.35 S ATOM 0 H CYS A 102 15.365 20.660 17.642 1.00 15.03 H new ATOM 0 HA CYS A 102 16.162 22.157 20.068 1.00 70.55 H new ATOM 0 HB2 CYS A 102 14.134 21.488 21.150 1.00 71.25 H new ATOM 0 HB3 CYS A 102 13.685 22.241 19.632 1.00 71.25 H new ATOM 0 HG CYS A 102 13.502 19.542 18.401 1.00 5.35 H new ATOM 1602 N SER A 103 16.408 19.865 21.387 1.00 41.14 N ATOM 1603 CA SER A 103 17.019 18.670 21.955 1.00 21.13 C ATOM 1604 C SER A 103 16.254 18.201 23.189 1.00 43.10 C ATOM 1605 O SER A 103 15.536 18.976 23.819 1.00 53.42 O ATOM 1606 CB SER A 103 18.480 18.943 22.321 1.00 61.34 C ATOM 1607 OG SER A 103 18.898 20.209 21.839 1.00 21.12 O ATOM 0 H SER A 103 16.099 20.549 22.077 1.00 41.14 H new ATOM 0 HA SER A 103 16.980 17.881 21.204 1.00 21.13 H new ATOM 0 HB2 SER A 103 18.600 18.905 23.404 1.00 61.34 H new ATOM 0 HB3 SER A 103 19.115 18.163 21.902 1.00 61.34 H new ATOM 0 HG SER A 103 19.834 20.361 22.087 1.00 21.12 H new ATOM 1613 N VAL A 104 16.413 16.925 23.527 1.00 12.02 N ATOM 1614 CA VAL A 104 15.738 16.352 24.685 1.00 30.12 C ATOM 1615 C VAL A 104 16.698 15.512 25.521 1.00 24.20 C ATOM 1616 O VAL A 104 17.184 14.472 25.072 1.00 10.54 O ATOM 1617 CB VAL A 104 14.543 15.478 24.263 1.00 62.32 C ATOM 1618 CG1 VAL A 104 13.872 14.866 25.482 1.00 74.13 C ATOM 1619 CG2 VAL A 104 13.549 16.293 23.448 1.00 35.23 C ATOM 0 H VAL A 104 17.003 16.269 23.015 1.00 12.02 H new ATOM 0 HA VAL A 104 15.374 17.187 25.284 1.00 30.12 H new ATOM 0 HB VAL A 104 14.912 14.666 23.636 1.00 62.32 H new ATOM 0 HG11 VAL A 104 13.030 14.252 25.164 1.00 74.13 H new ATOM 0 HG12 VAL A 104 14.590 14.247 26.020 1.00 74.13 H new ATOM 0 HG13 VAL A 104 13.515 15.660 26.138 1.00 74.13 H new ATOM 0 HG21 VAL A 104 12.711 15.660 23.158 1.00 35.23 H new ATOM 0 HG22 VAL A 104 13.184 17.127 24.048 1.00 35.23 H new ATOM 0 HG23 VAL A 104 14.040 16.677 22.554 1.00 35.23 H new ATOM 1629 N THR A 105 16.969 15.969 26.740 1.00 62.51 N ATOM 1630 CA THR A 105 17.871 15.260 27.638 1.00 11.24 C ATOM 1631 C THR A 105 17.098 14.520 28.723 1.00 63.04 C ATOM 1632 O THR A 105 16.053 14.985 29.181 1.00 25.03 O ATOM 1633 CB THR A 105 18.873 16.224 28.303 1.00 54.43 C ATOM 1634 OG1 THR A 105 18.188 17.084 29.221 1.00 43.44 O ATOM 1635 CG2 THR A 105 19.595 17.060 27.258 1.00 53.21 C ATOM 0 H THR A 105 16.576 16.827 27.127 1.00 62.51 H new ATOM 0 HA THR A 105 18.419 14.539 27.031 1.00 11.24 H new ATOM 0 HB THR A 105 19.611 15.631 28.843 1.00 54.43 H new ATOM 0 HG1 THR A 105 17.930 16.574 30.017 1.00 43.44 H new ATOM 0 HG21 THR A 105 20.297 17.733 27.751 1.00 53.21 H new ATOM 0 HG22 THR A 105 20.138 16.403 26.579 1.00 53.21 H new ATOM 0 HG23 THR A 105 18.868 17.644 26.694 1.00 53.21 H new ATOM 1643 N ILE A 106 17.618 13.366 29.131 1.00 52.35 N ATOM 1644 CA ILE A 106 16.975 12.563 30.164 1.00 52.24 C ATOM 1645 C ILE A 106 17.349 13.058 31.556 1.00 11.15 C ATOM 1646 O ILE A 106 18.468 13.520 31.784 1.00 42.42 O ATOM 1647 CB ILE A 106 17.356 11.077 30.040 1.00 21.32 C ATOM 1648 CG1 ILE A 106 16.502 10.228 30.983 1.00 0.11 C ATOM 1649 CG2 ILE A 106 18.836 10.883 30.337 1.00 53.13 C ATOM 1650 CD1 ILE A 106 16.753 8.742 30.852 1.00 33.24 C ATOM 0 H ILE A 106 18.481 12.967 28.762 1.00 52.35 H new ATOM 0 HA ILE A 106 15.899 12.667 30.021 1.00 52.24 H new ATOM 0 HB ILE A 106 17.165 10.753 29.017 1.00 21.32 H new ATOM 0 HG12 ILE A 106 16.698 10.532 32.011 1.00 0.11 H new ATOM 0 HG13 ILE A 106 15.449 10.429 30.787 1.00 0.11 H new ATOM 0 HG21 ILE A 106 19.090 9.827 30.245 1.00 53.13 H new ATOM 0 HG22 ILE A 106 19.428 11.462 29.628 1.00 53.13 H new ATOM 0 HG23 ILE A 106 19.051 11.221 31.351 1.00 53.13 H new ATOM 0 HD11 ILE A 106 16.113 8.202 31.550 1.00 33.24 H new ATOM 0 HD12 ILE A 106 16.529 8.424 29.834 1.00 33.24 H new ATOM 0 HD13 ILE A 106 17.798 8.528 31.077 1.00 33.24 H new ATOM 1662 N LYS A 107 16.408 12.956 32.488 1.00 14.03 N ATOM 1663 CA LYS A 107 16.638 13.389 33.861 1.00 41.53 C ATOM 1664 C LYS A 107 16.955 12.200 34.761 1.00 2.43 C ATOM 1665 O LYS A 107 16.052 11.502 35.223 1.00 5.12 O ATOM 1666 CB LYS A 107 15.412 14.135 34.394 1.00 14.13 C ATOM 1667 CG LYS A 107 15.594 14.674 35.803 1.00 44.13 C ATOM 1668 CD LYS A 107 16.211 16.063 35.792 1.00 2.24 C ATOM 1669 CE LYS A 107 15.995 16.779 37.117 1.00 30.14 C ATOM 1670 NZ LYS A 107 17.213 17.517 37.553 1.00 54.44 N ATOM 0 H LYS A 107 15.477 12.576 32.317 1.00 14.03 H new ATOM 0 HA LYS A 107 17.495 14.062 33.865 1.00 41.53 H new ATOM 0 HB2 LYS A 107 15.181 14.963 33.724 1.00 14.13 H new ATOM 0 HB3 LYS A 107 14.553 13.464 34.379 1.00 14.13 H new ATOM 0 HG2 LYS A 107 14.629 14.707 36.309 1.00 44.13 H new ATOM 0 HG3 LYS A 107 16.230 13.997 36.374 1.00 44.13 H new ATOM 0 HD2 LYS A 107 17.279 15.986 35.588 1.00 2.24 H new ATOM 0 HD3 LYS A 107 15.774 16.650 34.984 1.00 2.24 H new ATOM 0 HE2 LYS A 107 15.162 17.476 37.022 1.00 30.14 H new ATOM 0 HE3 LYS A 107 15.717 16.053 37.881 1.00 30.14 H new ATOM 0 HZ1 LYS A 107 17.026 17.991 38.459 1.00 54.44 H new ATOM 0 HZ2 LYS A 107 18.001 16.848 37.669 1.00 54.44 H new ATOM 0 HZ3 LYS A 107 17.464 18.227 36.836 1.00 54.44 H new ATOM 1684 N GLU A 108 18.242 11.976 35.008 1.00 42.11 N ATOM 1685 CA GLU A 108 18.676 10.871 35.854 1.00 11.44 C ATOM 1686 C GLU A 108 17.949 10.895 37.196 1.00 31.21 C ATOM 1687 O GLU A 108 18.138 11.805 38.000 1.00 52.41 O ATOM 1688 CB GLU A 108 20.188 10.936 36.081 1.00 24.21 C ATOM 1689 CG GLU A 108 20.809 9.596 36.435 1.00 33.25 C ATOM 1690 CD GLU A 108 20.688 9.270 37.912 1.00 12.23 C ATOM 1691 OE1 GLU A 108 20.475 10.208 38.710 1.00 73.31 O ATOM 1692 OE2 GLU A 108 20.807 8.079 38.269 1.00 43.43 O ATOM 0 H GLU A 108 19.002 12.545 34.634 1.00 42.11 H new ATOM 0 HA GLU A 108 18.432 9.939 35.344 1.00 11.44 H new ATOM 0 HB2 GLU A 108 20.666 11.322 35.180 1.00 24.21 H new ATOM 0 HB3 GLU A 108 20.396 11.646 36.881 1.00 24.21 H new ATOM 0 HG2 GLU A 108 20.327 8.811 35.853 1.00 33.25 H new ATOM 0 HG3 GLU A 108 21.862 9.601 36.153 1.00 33.25 H new ATOM 1699 N GLY A 109 17.116 9.885 37.429 1.00 43.05 N ATOM 1700 CA GLY A 109 16.372 9.808 38.672 1.00 42.31 C ATOM 1701 C GLY A 109 15.012 10.470 38.576 1.00 44.34 C ATOM 1702 O GLY A 109 14.699 11.378 39.346 1.00 55.32 O ATOM 0 H GLY A 109 16.943 9.119 36.778 1.00 43.05 H new ATOM 0 HA2 GLY A 109 16.245 8.762 38.951 1.00 42.31 H new ATOM 0 HA3 GLY A 109 16.948 10.282 39.467 1.00 42.31 H new ATOM 1706 N SER A 110 14.201 10.016 37.625 1.00 53.02 N ATOM 1707 CA SER A 110 12.868 10.574 37.427 1.00 71.53 C ATOM 1708 C SER A 110 12.007 9.637 36.585 1.00 53.14 C ATOM 1709 O SER A 110 12.519 8.877 35.765 1.00 60.44 O ATOM 1710 CB SER A 110 12.960 11.944 36.753 1.00 3.30 C ATOM 1711 OG SER A 110 11.787 12.227 36.010 1.00 50.11 O ATOM 0 H SER A 110 14.444 9.264 36.980 1.00 53.02 H new ATOM 0 HA SER A 110 12.400 10.689 38.405 1.00 71.53 H new ATOM 0 HB2 SER A 110 13.110 12.715 37.509 1.00 3.30 H new ATOM 0 HB3 SER A 110 13.827 11.971 36.093 1.00 3.30 H new ATOM 0 HG SER A 110 11.484 13.137 36.212 1.00 50.11 H new ATOM 1717 N GLN A 111 10.695 9.701 36.795 1.00 33.53 N ATOM 1718 CA GLN A 111 9.762 8.857 36.056 1.00 21.05 C ATOM 1719 C GLN A 111 9.918 9.062 34.553 1.00 74.10 C ATOM 1720 O GLN A 111 9.618 8.168 33.760 1.00 3.02 O ATOM 1721 CB GLN A 111 8.324 9.161 36.479 1.00 25.10 C ATOM 1722 CG GLN A 111 7.866 10.563 36.112 1.00 51.00 C ATOM 1723 CD GLN A 111 6.563 10.946 36.787 1.00 2.32 C ATOM 1724 OE1 GLN A 111 6.556 11.676 37.779 1.00 70.02 O ATOM 1725 NE2 GLN A 111 5.452 10.454 36.253 1.00 64.22 N ATOM 0 H GLN A 111 10.255 10.327 37.469 1.00 33.53 H new ATOM 0 HA GLN A 111 9.989 7.816 36.287 1.00 21.05 H new ATOM 0 HB2 GLN A 111 7.656 8.436 36.014 1.00 25.10 H new ATOM 0 HB3 GLN A 111 8.236 9.029 37.557 1.00 25.10 H new ATOM 0 HG2 GLN A 111 8.639 11.279 36.391 1.00 51.00 H new ATOM 0 HG3 GLN A 111 7.744 10.630 35.031 1.00 51.00 H new ATOM 0 HE21 GLN A 111 5.504 9.853 35.431 1.00 64.22 H new ATOM 0 HE22 GLN A 111 4.546 10.677 36.665 1.00 64.22 H new ATOM 1734 N LEU A 112 10.387 10.243 34.168 1.00 65.33 N ATOM 1735 CA LEU A 112 10.582 10.565 32.758 1.00 23.05 C ATOM 1736 C LEU A 112 11.580 9.608 32.113 1.00 41.15 C ATOM 1737 O LEU A 112 11.535 9.368 30.906 1.00 30.43 O ATOM 1738 CB LEU A 112 11.071 12.007 32.607 1.00 42.12 C ATOM 1739 CG LEU A 112 10.248 12.901 31.678 1.00 4.15 C ATOM 1740 CD1 LEU A 112 10.858 14.292 31.599 1.00 63.54 C ATOM 1741 CD2 LEU A 112 10.148 12.281 30.292 1.00 61.11 C ATOM 0 H LEU A 112 10.639 10.993 34.811 1.00 65.33 H new ATOM 0 HA LEU A 112 9.623 10.457 32.251 1.00 23.05 H new ATOM 0 HB2 LEU A 112 11.094 12.467 33.595 1.00 42.12 H new ATOM 0 HB3 LEU A 112 12.098 11.985 32.242 1.00 42.12 H new ATOM 0 HG LEU A 112 9.242 12.990 32.087 1.00 4.15 H new ATOM 0 HD11 LEU A 112 10.260 14.914 30.934 1.00 63.54 H new ATOM 0 HD12 LEU A 112 10.877 14.738 32.593 1.00 63.54 H new ATOM 0 HD13 LEU A 112 11.875 14.222 31.213 1.00 63.54 H new ATOM 0 HD21 LEU A 112 9.559 12.931 29.644 1.00 61.11 H new ATOM 0 HD22 LEU A 112 11.148 12.161 29.874 1.00 61.11 H new ATOM 0 HD23 LEU A 112 9.666 11.306 30.363 1.00 61.11 H new ATOM 1753 N LYS A 113 12.478 9.062 32.925 1.00 32.03 N ATOM 1754 CA LYS A 113 13.485 8.127 32.437 1.00 44.32 C ATOM 1755 C LYS A 113 12.838 6.997 31.643 1.00 10.42 C ATOM 1756 O LYS A 113 13.126 6.814 30.461 1.00 72.24 O ATOM 1757 CB LYS A 113 14.285 7.551 33.606 1.00 22.33 C ATOM 1758 CG LYS A 113 15.403 6.616 33.176 1.00 75.24 C ATOM 1759 CD LYS A 113 15.409 5.340 34.001 1.00 20.34 C ATOM 1760 CE LYS A 113 15.701 5.625 35.466 1.00 34.43 C ATOM 1761 NZ LYS A 113 15.734 4.377 36.279 1.00 53.14 N ATOM 0 H LYS A 113 12.529 9.251 33.926 1.00 32.03 H new ATOM 0 HA LYS A 113 14.160 8.671 31.777 1.00 44.32 H new ATOM 0 HB2 LYS A 113 14.711 8.372 34.183 1.00 22.33 H new ATOM 0 HB3 LYS A 113 13.607 7.013 34.269 1.00 22.33 H new ATOM 0 HG2 LYS A 113 15.286 6.368 32.121 1.00 75.24 H new ATOM 0 HG3 LYS A 113 16.363 7.122 33.280 1.00 75.24 H new ATOM 0 HD2 LYS A 113 14.443 4.843 33.911 1.00 20.34 H new ATOM 0 HD3 LYS A 113 16.158 4.654 33.606 1.00 20.34 H new ATOM 0 HE2 LYS A 113 16.658 6.140 35.552 1.00 34.43 H new ATOM 0 HE3 LYS A 113 14.941 6.297 35.864 1.00 34.43 H new ATOM 0 HZ1 LYS A 113 15.936 4.614 37.271 1.00 53.14 H new ATOM 0 HZ2 LYS A 113 14.813 3.898 36.218 1.00 53.14 H new ATOM 0 HZ3 LYS A 113 16.477 3.746 35.916 1.00 53.14 H new ATOM 1775 N GLN A 114 11.963 6.244 32.301 1.00 31.41 N ATOM 1776 CA GLN A 114 11.276 5.131 31.656 1.00 54.22 C ATOM 1777 C GLN A 114 10.411 5.623 30.500 1.00 25.32 C ATOM 1778 O GLN A 114 10.247 4.928 29.497 1.00 1.43 O ATOM 1779 CB GLN A 114 10.411 4.381 32.671 1.00 61.11 C ATOM 1780 CG GLN A 114 9.463 5.282 33.447 1.00 23.42 C ATOM 1781 CD GLN A 114 8.439 4.500 34.245 1.00 54.31 C ATOM 1782 OE1 GLN A 114 8.308 3.285 34.089 1.00 12.32 O ATOM 1783 NE2 GLN A 114 7.705 5.194 35.107 1.00 1.04 N ATOM 0 H GLN A 114 11.713 6.384 33.280 1.00 31.41 H new ATOM 0 HA GLN A 114 12.030 4.452 31.259 1.00 54.22 H new ATOM 0 HB2 GLN A 114 9.830 3.620 32.149 1.00 61.11 H new ATOM 0 HB3 GLN A 114 11.060 3.860 33.374 1.00 61.11 H new ATOM 0 HG2 GLN A 114 10.039 5.914 34.123 1.00 23.42 H new ATOM 0 HG3 GLN A 114 8.948 5.945 32.752 1.00 23.42 H new ATOM 0 HE21 GLN A 114 7.847 6.199 35.204 1.00 1.04 H new ATOM 0 HE22 GLN A 114 6.999 4.722 35.672 1.00 1.04 H new ATOM 1792 N GLN A 115 9.862 6.825 30.646 1.00 30.51 N ATOM 1793 CA GLN A 115 9.014 7.408 29.613 1.00 12.13 C ATOM 1794 C GLN A 115 9.794 7.610 28.318 1.00 34.33 C ATOM 1795 O GLN A 115 9.376 7.156 27.253 1.00 11.11 O ATOM 1796 CB GLN A 115 8.440 8.743 30.090 1.00 51.14 C ATOM 1797 CG GLN A 115 7.205 8.597 30.965 1.00 21.14 C ATOM 1798 CD GLN A 115 6.985 9.795 31.869 1.00 70.44 C ATOM 1799 OE1 GLN A 115 7.469 10.892 31.592 1.00 44.24 O ATOM 1800 NE2 GLN A 115 6.250 9.589 32.956 1.00 5.25 N ATOM 0 H GLN A 115 9.989 7.414 31.469 1.00 30.51 H new ATOM 0 HA GLN A 115 8.194 6.717 29.417 1.00 12.13 H new ATOM 0 HB2 GLN A 115 9.208 9.281 30.646 1.00 51.14 H new ATOM 0 HB3 GLN A 115 8.190 9.352 29.222 1.00 51.14 H new ATOM 0 HG2 GLN A 115 6.329 8.460 30.331 1.00 21.14 H new ATOM 0 HG3 GLN A 115 7.301 7.699 31.575 1.00 21.14 H new ATOM 0 HE21 GLN A 115 5.869 8.662 33.146 1.00 5.25 H new ATOM 0 HE22 GLN A 115 6.067 10.358 33.601 1.00 5.25 H new ATOM 1809 N ILE A 116 10.930 8.293 28.418 1.00 60.14 N ATOM 1810 CA ILE A 116 11.768 8.555 27.255 1.00 70.33 C ATOM 1811 C ILE A 116 12.259 7.254 26.628 1.00 13.13 C ATOM 1812 O ILE A 116 12.376 7.147 25.408 1.00 50.23 O ATOM 1813 CB ILE A 116 12.984 9.426 27.621 1.00 42.23 C ATOM 1814 CG1 ILE A 116 12.523 10.753 28.226 1.00 31.02 C ATOM 1815 CG2 ILE A 116 13.849 9.670 26.393 1.00 33.31 C ATOM 1816 CD1 ILE A 116 13.620 11.499 28.952 1.00 20.12 C ATOM 0 H ILE A 116 11.291 8.675 29.292 1.00 60.14 H new ATOM 0 HA ILE A 116 11.150 9.093 26.536 1.00 70.33 H new ATOM 0 HB ILE A 116 13.582 8.897 28.363 1.00 42.23 H new ATOM 0 HG12 ILE A 116 12.127 11.387 27.432 1.00 31.02 H new ATOM 0 HG13 ILE A 116 11.704 10.562 28.920 1.00 31.02 H new ATOM 0 HG21 ILE A 116 14.705 10.287 26.667 1.00 33.31 H new ATOM 0 HG22 ILE A 116 14.201 8.716 26.000 1.00 33.31 H new ATOM 0 HG23 ILE A 116 13.262 10.182 25.630 1.00 33.31 H new ATOM 0 HD11 ILE A 116 13.222 12.430 29.355 1.00 20.12 H new ATOM 0 HD12 ILE A 116 14.000 10.884 29.767 1.00 20.12 H new ATOM 0 HD13 ILE A 116 14.430 11.722 28.257 1.00 20.12 H new ATOM 1828 N GLN A 117 12.543 6.267 27.472 1.00 2.02 N ATOM 1829 CA GLN A 117 13.021 4.973 27.000 1.00 34.01 C ATOM 1830 C GLN A 117 11.897 4.188 26.333 1.00 63.45 C ATOM 1831 O GLN A 117 12.128 3.444 25.380 1.00 75.54 O ATOM 1832 CB GLN A 117 13.602 4.165 28.163 1.00 50.15 C ATOM 1833 CG GLN A 117 14.850 3.380 27.794 1.00 1.35 C ATOM 1834 CD GLN A 117 15.466 2.671 28.984 1.00 20.15 C ATOM 1835 OE1 GLN A 117 14.895 2.653 30.075 1.00 51.41 O ATOM 1836 NE2 GLN A 117 16.639 2.083 28.781 1.00 61.54 N ATOM 0 H GLN A 117 12.450 6.339 28.485 1.00 2.02 H new ATOM 0 HA GLN A 117 13.804 5.150 26.262 1.00 34.01 H new ATOM 0 HB2 GLN A 117 13.838 4.843 28.983 1.00 50.15 H new ATOM 0 HB3 GLN A 117 12.843 3.474 28.529 1.00 50.15 H new ATOM 0 HG2 GLN A 117 14.600 2.646 27.028 1.00 1.35 H new ATOM 0 HG3 GLN A 117 15.585 4.057 27.359 1.00 1.35 H new ATOM 0 HE21 GLN A 117 17.077 2.123 27.861 1.00 61.54 H new ATOM 0 HE22 GLN A 117 17.102 1.592 29.545 1.00 61.54 H new ATOM 1845 N SER A 118 10.680 4.360 26.839 1.00 51.41 N ATOM 1846 CA SER A 118 9.519 3.665 26.294 1.00 20.52 C ATOM 1847 C SER A 118 9.185 4.180 24.898 1.00 73.44 C ATOM 1848 O SER A 118 8.960 3.397 23.973 1.00 54.02 O ATOM 1849 CB SER A 118 8.313 3.840 27.218 1.00 12.21 C ATOM 1850 OG SER A 118 7.102 3.832 26.482 1.00 54.12 O ATOM 0 H SER A 118 10.472 4.975 27.626 1.00 51.41 H new ATOM 0 HA SER A 118 9.761 2.605 26.223 1.00 20.52 H new ATOM 0 HB2 SER A 118 8.298 3.039 27.958 1.00 12.21 H new ATOM 0 HB3 SER A 118 8.403 4.778 27.766 1.00 12.21 H new ATOM 0 HG SER A 118 6.346 3.944 27.095 1.00 54.12 H new ATOM 1856 N ILE A 119 9.153 5.500 24.753 1.00 71.13 N ATOM 1857 CA ILE A 119 8.845 6.120 23.470 1.00 10.00 C ATOM 1858 C ILE A 119 9.953 5.859 22.455 1.00 64.12 C ATOM 1859 O ILE A 119 9.702 5.794 21.252 1.00 2.34 O ATOM 1860 CB ILE A 119 8.643 7.639 23.613 1.00 52.35 C ATOM 1861 CG1 ILE A 119 8.232 8.250 22.272 1.00 3.23 C ATOM 1862 CG2 ILE A 119 9.912 8.297 24.134 1.00 71.42 C ATOM 1863 CD1 ILE A 119 7.691 9.658 22.389 1.00 72.42 C ATOM 0 H ILE A 119 9.337 6.161 25.508 1.00 71.13 H new ATOM 0 HA ILE A 119 7.917 5.671 23.116 1.00 10.00 H new ATOM 0 HB ILE A 119 7.844 7.817 24.332 1.00 52.35 H new ATOM 0 HG12 ILE A 119 9.094 8.255 21.605 1.00 3.23 H new ATOM 0 HG13 ILE A 119 7.475 7.616 21.810 1.00 3.23 H new ATOM 0 HG21 ILE A 119 9.752 9.371 24.229 1.00 71.42 H new ATOM 0 HG22 ILE A 119 10.164 7.880 25.109 1.00 71.42 H new ATOM 0 HG23 ILE A 119 10.730 8.112 23.438 1.00 71.42 H new ATOM 0 HD11 ILE A 119 7.420 10.027 21.400 1.00 72.42 H new ATOM 0 HD12 ILE A 119 6.809 9.657 23.030 1.00 72.42 H new ATOM 0 HD13 ILE A 119 8.453 10.306 22.822 1.00 72.42 H new ATOM 1875 N GLN A 120 11.178 5.710 22.948 1.00 12.53 N ATOM 1876 CA GLN A 120 12.324 5.455 22.084 1.00 4.31 C ATOM 1877 C GLN A 120 12.086 4.227 21.212 1.00 12.22 C ATOM 1878 O GLN A 120 12.336 4.252 20.008 1.00 62.03 O ATOM 1879 CB GLN A 120 13.589 5.264 22.922 1.00 63.50 C ATOM 1880 CG GLN A 120 14.859 5.715 22.218 1.00 34.34 C ATOM 1881 CD GLN A 120 16.024 5.891 23.173 1.00 61.14 C ATOM 1882 OE1 GLN A 120 16.396 4.965 23.894 1.00 32.52 O ATOM 1883 NE2 GLN A 120 16.607 7.084 23.181 1.00 32.34 N ATOM 0 H GLN A 120 11.402 5.762 23.942 1.00 12.53 H new ATOM 0 HA GLN A 120 12.456 6.319 21.433 1.00 4.31 H new ATOM 0 HB2 GLN A 120 13.484 5.818 23.855 1.00 63.50 H new ATOM 0 HB3 GLN A 120 13.684 4.211 23.186 1.00 63.50 H new ATOM 0 HG2 GLN A 120 15.126 4.984 21.455 1.00 34.34 H new ATOM 0 HG3 GLN A 120 14.670 6.657 21.704 1.00 34.34 H new ATOM 0 HE21 GLN A 120 16.265 7.823 22.566 1.00 32.34 H new ATOM 0 HE22 GLN A 120 17.397 7.262 23.802 1.00 32.34 H new ATOM 1892 N GLN A 121 11.603 3.154 21.829 1.00 14.04 N ATOM 1893 CA GLN A 121 11.333 1.915 21.110 1.00 61.13 C ATOM 1894 C GLN A 121 10.234 2.118 20.072 1.00 61.05 C ATOM 1895 O GLN A 121 10.300 1.577 18.968 1.00 15.23 O ATOM 1896 CB GLN A 121 10.931 0.809 22.086 1.00 31.14 C ATOM 1897 CG GLN A 121 11.451 -0.565 21.697 1.00 73.44 C ATOM 1898 CD GLN A 121 10.431 -1.663 21.931 1.00 4.52 C ATOM 1899 OE1 GLN A 121 10.488 -2.375 22.933 1.00 20.22 O ATOM 1900 NE2 GLN A 121 9.491 -1.805 21.004 1.00 11.41 N ATOM 0 H GLN A 121 11.390 3.118 22.826 1.00 14.04 H new ATOM 0 HA GLN A 121 12.246 1.618 20.594 1.00 61.13 H new ATOM 0 HB2 GLN A 121 11.302 1.061 23.080 1.00 31.14 H new ATOM 0 HB3 GLN A 121 9.844 0.771 22.152 1.00 31.14 H new ATOM 0 HG2 GLN A 121 11.736 -0.557 20.645 1.00 73.44 H new ATOM 0 HG3 GLN A 121 12.352 -0.784 22.270 1.00 73.44 H new ATOM 0 HE21 GLN A 121 9.482 -1.192 20.189 1.00 11.41 H new ATOM 0 HE22 GLN A 121 8.778 -2.527 21.107 1.00 11.41 H new ATOM 1909 N SER A 122 9.221 2.900 20.435 1.00 24.32 N ATOM 1910 CA SER A 122 8.105 3.170 19.537 1.00 62.05 C ATOM 1911 C SER A 122 8.600 3.730 18.207 1.00 5.11 C ATOM 1912 O SER A 122 7.964 3.547 17.168 1.00 3.24 O ATOM 1913 CB SER A 122 7.128 4.153 20.185 1.00 13.31 C ATOM 1914 OG SER A 122 6.906 3.829 21.547 1.00 3.22 O ATOM 0 H SER A 122 9.151 3.357 21.344 1.00 24.32 H new ATOM 0 HA SER A 122 7.590 2.229 19.345 1.00 62.05 H new ATOM 0 HB2 SER A 122 7.523 5.166 20.109 1.00 13.31 H new ATOM 0 HB3 SER A 122 6.181 4.138 19.645 1.00 13.31 H new ATOM 0 HG SER A 122 6.280 4.473 21.939 1.00 3.22 H new ATOM 1920 N ILE A 123 9.739 4.414 18.248 1.00 63.31 N ATOM 1921 CA ILE A 123 10.322 5.000 17.047 1.00 41.25 C ATOM 1922 C ILE A 123 10.839 3.920 16.103 1.00 33.22 C ATOM 1923 O ILE A 123 10.700 4.027 14.885 1.00 32.31 O ATOM 1924 CB ILE A 123 11.474 5.961 17.392 1.00 30.51 C ATOM 1925 CG1 ILE A 123 11.001 7.026 18.383 1.00 34.54 C ATOM 1926 CG2 ILE A 123 12.018 6.610 16.128 1.00 62.02 C ATOM 1927 CD1 ILE A 123 12.119 7.895 18.915 1.00 34.44 C ATOM 0 H ILE A 123 10.276 4.576 19.100 1.00 63.31 H new ATOM 0 HA ILE A 123 9.529 5.561 16.552 1.00 41.25 H new ATOM 0 HB ILE A 123 12.276 5.390 17.859 1.00 30.51 H new ATOM 0 HG12 ILE A 123 10.259 7.660 17.897 1.00 34.54 H new ATOM 0 HG13 ILE A 123 10.503 6.536 19.220 1.00 34.54 H new ATOM 0 HG21 ILE A 123 12.832 7.287 16.388 1.00 62.02 H new ATOM 0 HG22 ILE A 123 12.389 5.838 15.454 1.00 62.02 H new ATOM 0 HG23 ILE A 123 11.223 7.170 15.636 1.00 62.02 H new ATOM 0 HD11 ILE A 123 11.711 8.627 19.612 1.00 34.44 H new ATOM 0 HD12 ILE A 123 12.850 7.272 19.430 1.00 34.44 H new ATOM 0 HD13 ILE A 123 12.603 8.413 18.087 1.00 34.44 H new ATOM 1939 N GLU A 124 11.435 2.878 16.675 1.00 33.04 N ATOM 1940 CA GLU A 124 11.973 1.778 15.885 1.00 62.43 C ATOM 1941 C GLU A 124 10.866 1.080 15.099 1.00 63.45 C ATOM 1942 O GLU A 124 10.997 0.844 13.898 1.00 70.11 O ATOM 1943 CB GLU A 124 12.685 0.769 16.789 1.00 53.24 C ATOM 1944 CG GLU A 124 13.909 1.336 17.488 1.00 62.43 C ATOM 1945 CD GLU A 124 15.195 1.040 16.741 1.00 35.25 C ATOM 1946 OE1 GLU A 124 15.311 -0.066 16.174 1.00 10.34 O ATOM 1947 OE2 GLU A 124 16.085 1.917 16.724 1.00 71.42 O ATOM 0 H GLU A 124 11.557 2.773 17.682 1.00 33.04 H new ATOM 0 HA GLU A 124 12.692 2.192 15.178 1.00 62.43 H new ATOM 0 HB2 GLU A 124 11.983 0.408 17.540 1.00 53.24 H new ATOM 0 HB3 GLU A 124 12.984 -0.093 16.192 1.00 53.24 H new ATOM 0 HG2 GLU A 124 13.795 2.415 17.595 1.00 62.43 H new ATOM 0 HG3 GLU A 124 13.973 0.921 18.494 1.00 62.43 H new ATOM 1954 N ARG A 125 9.777 0.753 15.786 1.00 40.44 N ATOM 1955 CA ARG A 125 8.648 0.082 15.154 1.00 35.02 C ATOM 1956 C ARG A 125 8.109 0.905 13.988 1.00 54.13 C ATOM 1957 O ARG A 125 7.561 0.359 13.030 1.00 62.44 O ATOM 1958 CB ARG A 125 7.536 -0.163 16.177 1.00 21.52 C ATOM 1959 CG ARG A 125 7.657 -1.495 16.901 1.00 4.43 C ATOM 1960 CD ARG A 125 6.292 -2.081 17.221 1.00 61.24 C ATOM 1961 NE ARG A 125 6.171 -3.464 16.769 1.00 70.23 N ATOM 1962 CZ ARG A 125 5.111 -4.227 17.012 1.00 21.53 C ATOM 1963 NH1 ARG A 125 4.085 -3.744 17.700 1.00 20.44 N ATOM 1964 NH2 ARG A 125 5.076 -5.478 16.567 1.00 13.50 N ATOM 0 H ARG A 125 9.653 0.942 16.781 1.00 40.44 H new ATOM 0 HA ARG A 125 8.996 -0.876 14.769 1.00 35.02 H new ATOM 0 HB2 ARG A 125 7.546 0.642 16.911 1.00 21.52 H new ATOM 0 HB3 ARG A 125 6.572 -0.121 15.670 1.00 21.52 H new ATOM 0 HG2 ARG A 125 8.219 -2.196 16.284 1.00 4.43 H new ATOM 0 HG3 ARG A 125 8.221 -1.359 17.824 1.00 4.43 H new ATOM 0 HD2 ARG A 125 6.121 -2.035 18.296 1.00 61.24 H new ATOM 0 HD3 ARG A 125 5.518 -1.476 16.749 1.00 61.24 H new ATOM 0 HE ARG A 125 6.943 -3.867 16.237 1.00 70.23 H new ATOM 0 HH11 ARG A 125 4.108 -2.784 18.044 1.00 20.44 H new ATOM 0 HH12 ARG A 125 3.273 -4.332 17.885 1.00 20.44 H new ATOM 0 HH21 ARG A 125 5.863 -5.853 16.038 1.00 13.50 H new ATOM 0 HH22 ARG A 125 4.262 -6.063 16.754 1.00 13.50 H new ATOM 1978 N LEU A 126 8.268 2.221 14.077 1.00 74.41 N ATOM 1979 CA LEU A 126 7.796 3.121 13.029 1.00 33.23 C ATOM 1980 C LEU A 126 8.858 3.302 11.949 1.00 32.23 C ATOM 1981 O LEU A 126 8.540 3.562 10.789 1.00 63.34 O ATOM 1982 CB LEU A 126 7.422 4.478 13.626 1.00 32.13 C ATOM 1983 CG LEU A 126 5.928 4.736 13.824 1.00 72.21 C ATOM 1984 CD1 LEU A 126 5.221 4.840 12.481 1.00 5.44 C ATOM 1985 CD2 LEU A 126 5.305 3.636 14.672 1.00 64.42 C ATOM 0 H LEU A 126 8.720 2.689 14.863 1.00 74.41 H new ATOM 0 HA LEU A 126 6.912 2.676 12.572 1.00 33.23 H new ATOM 0 HB2 LEU A 126 7.918 4.577 14.591 1.00 32.13 H new ATOM 0 HB3 LEU A 126 7.823 5.259 12.980 1.00 32.13 H new ATOM 0 HG LEU A 126 5.809 5.684 14.348 1.00 72.21 H new ATOM 0 HD11 LEU A 126 4.159 5.024 12.642 1.00 5.44 H new ATOM 0 HD12 LEU A 126 5.649 5.662 11.907 1.00 5.44 H new ATOM 0 HD13 LEU A 126 5.348 3.908 11.930 1.00 5.44 H new ATOM 0 HD21 LEU A 126 4.241 3.836 14.803 1.00 64.42 H new ATOM 0 HD22 LEU A 126 5.435 2.675 14.174 1.00 64.42 H new ATOM 0 HD23 LEU A 126 5.792 3.609 15.647 1.00 64.42 H new ATOM 1997 N LEU A 127 10.120 3.161 12.339 1.00 3.14 N ATOM 1998 CA LEU A 127 11.231 3.307 11.404 1.00 44.51 C ATOM 1999 C LEU A 127 11.121 2.297 10.267 1.00 24.34 C ATOM 2000 O LEU A 127 11.045 2.669 9.096 1.00 62.43 O ATOM 2001 CB LEU A 127 12.563 3.131 12.132 1.00 31.25 C ATOM 2002 CG LEU A 127 13.492 4.346 12.136 1.00 14.13 C ATOM 2003 CD1 LEU A 127 14.698 4.092 13.028 1.00 3.53 C ATOM 2004 CD2 LEU A 127 13.935 4.685 10.721 1.00 40.03 C ATOM 0 H LEU A 127 10.400 2.946 13.296 1.00 3.14 H new ATOM 0 HA LEU A 127 11.187 4.310 10.980 1.00 44.51 H new ATOM 0 HB2 LEU A 127 12.355 2.854 13.166 1.00 31.25 H new ATOM 0 HB3 LEU A 127 13.094 2.294 11.678 1.00 31.25 H new ATOM 0 HG LEU A 127 12.942 5.198 12.536 1.00 14.13 H new ATOM 0 HD11 LEU A 127 15.348 4.967 13.019 1.00 3.53 H new ATOM 0 HD12 LEU A 127 14.363 3.900 14.047 1.00 3.53 H new ATOM 0 HD13 LEU A 127 15.249 3.227 12.658 1.00 3.53 H new ATOM 0 HD21 LEU A 127 14.595 5.552 10.744 1.00 40.03 H new ATOM 0 HD22 LEU A 127 14.467 3.835 10.293 1.00 40.03 H new ATOM 0 HD23 LEU A 127 13.061 4.911 10.110 1.00 40.03 H new ATOM 2016 N VAL A 128 11.113 1.015 10.620 1.00 34.02 N ATOM 2017 CA VAL A 128 11.010 -0.051 9.630 1.00 51.41 C ATOM 2018 C VAL A 128 12.136 0.040 8.607 1.00 61.33 C ATOM 2019 O VAL A 128 12.766 -0.963 8.271 1.00 43.20 O ATOM 2020 CB VAL A 128 9.657 -0.005 8.896 1.00 43.42 C ATOM 2021 CG1 VAL A 128 9.536 -1.170 7.925 1.00 33.34 C ATOM 2022 CG2 VAL A 128 8.509 -0.010 9.893 1.00 54.01 C ATOM 0 H VAL A 128 11.177 0.690 11.585 1.00 34.02 H new ATOM 0 HA VAL A 128 11.090 -0.995 10.170 1.00 51.41 H new ATOM 0 HB VAL A 128 9.606 0.921 8.323 1.00 43.42 H new ATOM 0 HG11 VAL A 128 8.574 -1.121 7.416 1.00 33.34 H new ATOM 0 HG12 VAL A 128 10.339 -1.116 7.190 1.00 33.34 H new ATOM 0 HG13 VAL A 128 9.609 -2.109 8.473 1.00 33.34 H new ATOM 0 HG21 VAL A 128 7.561 0.023 9.356 1.00 54.01 H new ATOM 0 HG22 VAL A 128 8.554 -0.918 10.495 1.00 54.01 H new ATOM 0 HG23 VAL A 128 8.588 0.861 10.543 1.00 54.01 H new TER 2032 VAL A 128