USER MOD reduce.3.24.130724 H: found=0, std=0, add=1347, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1347 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 81 THR OG1 : rot -170:sc= 0 USER MOD Set 1.2: A 146 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Set 2.1: A 34 MET CE :methyl -159:sc= -2.56 (180deg=-2.59) USER MOD Set 2.2: A 51 MET CE :methyl 171:sc= -2.36! (180deg=-2.89!) USER MOD Set 3.1: A 46 SER OG : rot 167:sc= 1.8 USER MOD Set 3.2: A 49 MET CE :methyl 134:sc= -4.03! (180deg=-5.04!) USER MOD Set 4.1: A 38 GLN :FLIP amide:sc= 0.0477 F(o=-0.48,f=0.15) USER MOD Set 4.2: A 48 TYR OH : rot 30:sc= 0.104 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -167:sc= -0.0119 (180deg=-0.201) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 ASN : amide:sc= -0.033 K(o=-0.033,f=-2!) USER MOD Single : A 10 HIS : no HD1:sc= -0.0627 X(o=-0.063,f=-0.017) USER MOD Single : A 13 HIS : no HD1:sc= 0.648 K(o=0.65,f=-3.7!) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 THR OG1 : rot -80:sc= 0.711 USER MOD Single : A 25 LYS NZ :NH3+ -167:sc= -0.0703 (180deg=-0.341) USER MOD Single : A 29 TYR OH : rot 15:sc= 0.483 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0124) USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 61 ASN : amide:sc= -0.288 X(o=-0.29,f=-0.27) USER MOD Single : A 74 THR OG1 : rot 180:sc= 0 USER MOD Single : A 75 GLN : amide:sc= 0.905 K(o=0.9,f=-5.4!) USER MOD Single : A 76 ASN : amide:sc= -1.66! C(o=-1.7!,f=-9!) USER MOD Single : A 85 LYS NZ :NH3+ -155:sc= 1.86 (180deg=0.648) USER MOD Single : A 91 SER OG : rot 55:sc= 0.103 USER MOD Single : A 92 THR OG1 : rot 180:sc= -0.129 USER MOD Single : A 99 SER OG : rot -88:sc= 0.0958 USER MOD Single : A 105 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 THR OG1 : rot 130:sc= -1.44! USER MOD Single : A 112 MET CE :methyl -135:sc= -0.0866 (180deg=-1.76) USER MOD Single : A 115 LYS NZ :NH3+ -150:sc= -1.02 (180deg=-2.04) USER MOD Single : A 126 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0553) USER MOD Single : A 130 THR OG1 : rot 180:sc= 0 USER MOD Single : A 134 GLN : amide:sc= 0.909 K(o=0.91,f=0.00077) USER MOD Single : A 135 SER OG : rot -5:sc= -2.97! USER MOD Single : A 142 LYS NZ :NH3+ -169:sc= 0.0155 (180deg=-0.0753) USER MOD Single : A 145 GLN : amide:sc= 0 X(o=0,f=-0.005) USER MOD Single : A 150 SER OG : rot 180:sc= 0 USER MOD Single : A 152 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 157 SER OG : rot 180:sc= 0.072 USER MOD Single : A 160 SER OG : rot 180:sc= 0 USER MOD Single : A 164 THR OG1 : rot 180:sc= 0 USER MOD Single : A 168 MET CE :methyl -140:sc= -0.378 (180deg=-1.39!) USER MOD Single : A 169 GLN :FLIP amide:sc= 0 F(o=-0.73,f=0) USER MOD Single : A 171 THR OG1 : rot 49:sc= 0.398 USER MOD Single : A 172 THR OG1 : rot 180:sc= 0 USER MOD Single : A 173 SER OG : rot 180:sc= -0.18 USER MOD Single : A 180 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -13.371 29.938 0.122 1.00 33.65 N ATOM 2 CA MET A 1 -12.925 31.329 -0.114 1.00 33.45 C ATOM 3 C MET A 1 -13.134 31.701 -1.577 1.00 33.18 C ATOM 4 O MET A 1 -12.256 31.488 -2.412 1.00 33.13 O ATOM 5 CB MET A 1 -11.448 31.488 0.254 1.00 33.33 C ATOM 6 CG MET A 1 -11.102 30.977 1.641 1.00 33.70 C ATOM 7 SD MET A 1 -12.086 31.746 2.940 1.00 34.05 S ATOM 8 CE MET A 1 -11.426 30.932 4.392 1.00 34.32 C ATOM 0 H1 MET A 1 -13.434 29.763 1.145 1.00 33.65 H new ATOM 0 H2 MET A 1 -14.305 29.794 -0.312 1.00 33.65 H new ATOM 0 H3 MET A 1 -12.687 29.278 -0.301 1.00 33.65 H new ATOM 0 HA MET A 1 -13.516 31.994 0.515 1.00 33.45 H new ATOM 0 HB2 MET A 1 -10.842 30.957 -0.480 1.00 33.33 H new ATOM 0 HB3 MET A 1 -11.178 32.542 0.188 1.00 33.33 H new ATOM 0 HG2 MET A 1 -11.250 29.897 1.672 1.00 33.70 H new ATOM 0 HG3 MET A 1 -10.045 31.160 1.837 1.00 33.70 H new ATOM 0 HE1 MET A 1 -11.936 31.303 5.281 1.00 34.32 H new ATOM 0 HE2 MET A 1 -11.580 29.856 4.308 1.00 34.32 H new ATOM 0 HE3 MET A 1 -10.359 31.140 4.473 1.00 34.32 H new ATOM 20 N GLY A 2 -14.307 32.238 -1.886 1.00 33.09 N ATOM 21 CA GLY A 2 -14.617 32.609 -3.251 1.00 32.90 C ATOM 22 C GLY A 2 -14.570 34.107 -3.459 1.00 32.89 C ATOM 23 O GLY A 2 -13.854 34.806 -2.735 1.00 32.86 O ATOM 0 H GLY A 2 -15.051 32.423 -1.213 1.00 33.09 H new ATOM 0 HA2 GLY A 2 -13.910 32.127 -3.926 1.00 32.90 H new ATOM 0 HA3 GLY A 2 -15.609 32.238 -3.511 1.00 32.90 H new ATOM 27 N SER A 3 -15.335 34.591 -4.441 1.00 32.98 N ATOM 28 CA SER A 3 -15.416 36.019 -4.770 1.00 33.04 C ATOM 29 C SER A 3 -14.151 36.488 -5.499 1.00 32.62 C ATOM 30 O SER A 3 -14.221 37.069 -6.583 1.00 32.63 O ATOM 31 CB SER A 3 -15.661 36.851 -3.503 1.00 33.70 C ATOM 32 OG SER A 3 -15.786 38.232 -3.799 1.00 34.12 O ATOM 0 H SER A 3 -15.919 34.001 -5.034 1.00 32.98 H new ATOM 0 HA SER A 3 -16.261 36.166 -5.443 1.00 33.04 H new ATOM 0 HB2 SER A 3 -16.567 36.502 -3.008 1.00 33.70 H new ATOM 0 HB3 SER A 3 -14.838 36.702 -2.805 1.00 33.70 H new ATOM 0 HG SER A 3 -15.943 38.731 -2.970 1.00 34.12 H new ATOM 38 N ALA A 4 -13.000 36.239 -4.897 1.00 32.32 N ATOM 39 CA ALA A 4 -11.729 36.606 -5.488 1.00 31.97 C ATOM 40 C ALA A 4 -10.801 35.403 -5.502 1.00 31.64 C ATOM 41 O ALA A 4 -10.786 34.613 -4.558 1.00 31.19 O ATOM 42 CB ALA A 4 -11.101 37.758 -4.719 1.00 31.74 C ATOM 0 H ALA A 4 -12.923 35.779 -3.990 1.00 32.32 H new ATOM 0 HA ALA A 4 -11.895 36.932 -6.515 1.00 31.97 H new ATOM 0 HB1 ALA A 4 -10.147 38.022 -5.175 1.00 31.74 H new ATOM 0 HB2 ALA A 4 -11.768 38.620 -4.746 1.00 31.74 H new ATOM 0 HB3 ALA A 4 -10.938 37.458 -3.684 1.00 31.74 H new ATOM 48 N THR A 5 -10.037 35.262 -6.574 1.00 31.95 N ATOM 49 CA THR A 5 -9.130 34.137 -6.725 1.00 31.80 C ATOM 50 C THR A 5 -7.868 34.340 -5.884 1.00 31.31 C ATOM 51 O THR A 5 -6.768 34.519 -6.413 1.00 31.16 O ATOM 52 CB THR A 5 -8.748 33.941 -8.203 1.00 32.30 C ATOM 53 OG1 THR A 5 -9.894 34.194 -9.031 1.00 32.53 O ATOM 54 CG2 THR A 5 -8.248 32.526 -8.450 1.00 32.74 C ATOM 0 H THR A 5 -10.028 35.917 -7.356 1.00 31.95 H new ATOM 0 HA THR A 5 -9.645 33.243 -6.373 1.00 31.80 H new ATOM 0 HB THR A 5 -7.949 34.640 -8.450 1.00 32.30 H new ATOM 0 HG1 THR A 5 -9.651 34.071 -9.972 1.00 32.53 H new ATOM 0 HG21 THR A 5 -7.984 32.412 -9.501 1.00 32.74 H new ATOM 0 HG22 THR A 5 -7.369 32.338 -7.833 1.00 32.74 H new ATOM 0 HG23 THR A 5 -9.032 31.813 -8.193 1.00 32.74 H new ATOM 62 N VAL A 6 -8.043 34.327 -4.574 1.00 31.15 N ATOM 63 CA VAL A 6 -6.940 34.508 -3.646 1.00 30.77 C ATOM 64 C VAL A 6 -6.557 33.179 -3.009 1.00 30.24 C ATOM 65 O VAL A 6 -7.392 32.283 -2.860 1.00 30.59 O ATOM 66 CB VAL A 6 -7.288 35.530 -2.543 1.00 31.07 C ATOM 67 CG1 VAL A 6 -7.450 36.921 -3.137 1.00 31.29 C ATOM 68 CG2 VAL A 6 -8.549 35.120 -1.798 1.00 31.20 C ATOM 0 H VAL A 6 -8.949 34.191 -4.125 1.00 31.15 H new ATOM 0 HA VAL A 6 -6.095 34.894 -4.216 1.00 30.77 H new ATOM 0 HB VAL A 6 -6.464 35.550 -1.829 1.00 31.07 H new ATOM 0 HG11 VAL A 6 -7.695 37.629 -2.345 1.00 31.29 H new ATOM 0 HG12 VAL A 6 -6.519 37.222 -3.617 1.00 31.29 H new ATOM 0 HG13 VAL A 6 -8.252 36.910 -3.875 1.00 31.29 H new ATOM 0 HG21 VAL A 6 -8.772 35.857 -1.026 1.00 31.20 H new ATOM 0 HG22 VAL A 6 -9.383 35.064 -2.498 1.00 31.20 H new ATOM 0 HG23 VAL A 6 -8.397 34.145 -1.335 1.00 31.20 H new ATOM 78 N ASN A 7 -5.292 33.055 -2.645 1.00 29.46 N ATOM 79 CA ASN A 7 -4.781 31.825 -2.062 1.00 28.96 C ATOM 80 C ASN A 7 -4.730 31.935 -0.548 1.00 28.50 C ATOM 81 O ASN A 7 -4.462 33.010 -0.006 1.00 28.42 O ATOM 82 CB ASN A 7 -3.383 31.507 -2.607 1.00 28.74 C ATOM 83 CG ASN A 7 -3.396 31.082 -4.066 1.00 28.54 C ATOM 84 OD1 ASN A 7 -4.275 31.465 -4.836 1.00 28.57 O ATOM 85 ND2 ASN A 7 -2.415 30.287 -4.457 1.00 28.41 N ATOM 0 H ASN A 7 -4.597 33.795 -2.743 1.00 29.46 H new ATOM 0 HA ASN A 7 -5.457 31.015 -2.336 1.00 28.96 H new ATOM 0 HB2 ASN A 7 -2.748 32.386 -2.496 1.00 28.74 H new ATOM 0 HB3 ASN A 7 -2.937 30.713 -2.007 1.00 28.74 H new ATOM 0 HD21 ASN A 7 -2.370 29.971 -5.426 1.00 28.41 H new ATOM 0 HD22 ASN A 7 -1.703 29.990 -3.790 1.00 28.41 H new ATOM 92 N GLY A 8 -4.994 30.831 0.130 1.00 28.28 N ATOM 93 CA GLY A 8 -4.951 30.827 1.577 1.00 27.93 C ATOM 94 C GLY A 8 -3.682 30.193 2.109 1.00 27.61 C ATOM 95 O GLY A 8 -2.661 30.173 1.418 1.00 27.61 O ATOM 0 H GLY A 8 -5.238 29.936 -0.295 1.00 28.28 H new ATOM 0 HA2 GLY A 8 -5.025 31.851 1.944 1.00 27.93 H new ATOM 0 HA3 GLY A 8 -5.815 30.286 1.963 1.00 27.93 H new ATOM 99 N PRO A 9 -3.719 29.668 3.343 1.00 27.42 N ATOM 100 CA PRO A 9 -2.572 28.988 3.957 1.00 27.20 C ATOM 101 C PRO A 9 -2.198 27.720 3.193 1.00 26.67 C ATOM 102 O PRO A 9 -1.199 27.682 2.471 1.00 26.59 O ATOM 103 CB PRO A 9 -3.078 28.633 5.365 1.00 27.23 C ATOM 104 CG PRO A 9 -4.264 29.505 5.592 1.00 27.37 C ATOM 105 CD PRO A 9 -4.882 29.704 4.242 1.00 27.51 C ATOM 0 HA PRO A 9 -1.675 29.608 3.960 1.00 27.20 H new ATOM 0 HB2 PRO A 9 -3.347 27.579 5.431 1.00 27.23 H new ATOM 0 HB3 PRO A 9 -2.309 28.813 6.116 1.00 27.23 H new ATOM 0 HG2 PRO A 9 -4.968 29.038 6.280 1.00 27.37 H new ATOM 0 HG3 PRO A 9 -3.971 30.458 6.033 1.00 27.37 H new ATOM 0 HD2 PRO A 9 -5.600 28.919 4.006 1.00 27.51 H new ATOM 0 HD3 PRO A 9 -5.414 30.653 4.177 1.00 27.51 H new ATOM 113 N HIS A 10 -3.014 26.687 3.352 1.00 26.41 N ATOM 114 CA HIS A 10 -2.744 25.388 2.754 1.00 25.98 C ATOM 115 C HIS A 10 -4.050 24.638 2.535 1.00 25.20 C ATOM 116 O HIS A 10 -4.225 23.501 2.980 1.00 24.97 O ATOM 117 CB HIS A 10 -1.774 24.571 3.631 1.00 26.32 C ATOM 118 CG HIS A 10 -2.172 24.464 5.077 1.00 26.28 C ATOM 119 ND1 HIS A 10 -1.734 25.343 6.044 1.00 26.46 N ATOM 120 CD2 HIS A 10 -2.952 23.563 5.721 1.00 26.19 C ATOM 121 CE1 HIS A 10 -2.230 24.989 7.214 1.00 26.48 C ATOM 122 NE2 HIS A 10 -2.972 23.913 7.048 1.00 26.32 N ATOM 0 H HIS A 10 -3.876 26.725 3.896 1.00 26.41 H new ATOM 0 HA HIS A 10 -2.264 25.539 1.787 1.00 25.98 H new ATOM 0 HB2 HIS A 10 -1.689 23.567 3.216 1.00 26.32 H new ATOM 0 HB3 HIS A 10 -0.784 25.024 3.573 1.00 26.32 H new ATOM 0 HD2 HIS A 10 -3.464 22.724 5.273 1.00 26.19 H new ATOM 0 HE1 HIS A 10 -2.057 25.496 8.151 1.00 26.48 H new ATOM 0 HE2 HIS A 10 -3.478 23.421 7.784 1.00 26.32 H new ATOM 131 N ASP A 11 -4.968 25.302 1.852 1.00 24.90 N ATOM 132 CA ASP A 11 -6.283 24.741 1.580 1.00 24.25 C ATOM 133 C ASP A 11 -6.319 24.160 0.176 1.00 23.73 C ATOM 134 O ASP A 11 -6.658 24.848 -0.787 1.00 23.90 O ATOM 135 CB ASP A 11 -7.357 25.821 1.747 1.00 24.28 C ATOM 136 CG ASP A 11 -8.756 25.317 1.457 1.00 24.24 C ATOM 137 OD1 ASP A 11 -9.088 24.192 1.889 1.00 24.02 O ATOM 138 OD2 ASP A 11 -9.530 26.034 0.789 1.00 24.51 O1- ATOM 0 H ASP A 11 -4.826 26.238 1.473 1.00 24.90 H new ATOM 0 HA ASP A 11 -6.486 23.940 2.291 1.00 24.25 H new ATOM 0 HB2 ASP A 11 -7.320 26.207 2.766 1.00 24.28 H new ATOM 0 HB3 ASP A 11 -7.132 26.655 1.082 1.00 24.28 H new ATOM 143 N GLY A 12 -5.945 22.895 0.064 1.00 23.19 N ATOM 144 CA GLY A 12 -5.889 22.251 -1.230 1.00 22.76 C ATOM 145 C GLY A 12 -7.261 21.858 -1.733 1.00 21.82 C ATOM 146 O GLY A 12 -8.126 21.459 -0.953 1.00 21.65 O ATOM 0 H GLY A 12 -5.678 22.301 0.849 1.00 23.19 H new ATOM 0 HA2 GLY A 12 -5.419 22.923 -1.948 1.00 22.76 H new ATOM 0 HA3 GLY A 12 -5.260 21.363 -1.165 1.00 22.76 H new ATOM 150 N HIS A 13 -7.472 21.981 -3.034 1.00 21.31 N ATOM 151 CA HIS A 13 -8.746 21.611 -3.636 1.00 20.46 C ATOM 152 C HIS A 13 -8.536 20.516 -4.665 1.00 19.83 C ATOM 153 O HIS A 13 -9.010 20.607 -5.797 1.00 19.78 O ATOM 154 CB HIS A 13 -9.436 22.817 -4.281 1.00 20.39 C ATOM 155 CG HIS A 13 -9.642 23.963 -3.339 1.00 20.50 C ATOM 156 ND1 HIS A 13 -9.266 25.251 -3.633 1.00 20.49 N ATOM 157 CD2 HIS A 13 -10.172 24.003 -2.096 1.00 20.77 C ATOM 158 CE1 HIS A 13 -9.552 26.033 -2.614 1.00 20.74 C ATOM 159 NE2 HIS A 13 -10.102 25.303 -1.661 1.00 20.92 N ATOM 0 H HIS A 13 -6.779 22.334 -3.694 1.00 21.31 H new ATOM 0 HA HIS A 13 -9.396 21.242 -2.843 1.00 20.46 H new ATOM 0 HB2 HIS A 13 -8.840 23.156 -5.128 1.00 20.39 H new ATOM 0 HB3 HIS A 13 -10.402 22.504 -4.676 1.00 20.39 H new ATOM 0 HD2 HIS A 13 -10.576 23.166 -1.546 1.00 20.77 H new ATOM 0 HE1 HIS A 13 -9.367 27.096 -2.565 1.00 20.74 H new ATOM 0 HE2 HIS A 13 -10.421 25.647 -0.755 1.00 20.92 H new ATOM 168 N ASP A 14 -7.810 19.487 -4.264 1.00 19.48 N ATOM 169 CA ASP A 14 -7.589 18.324 -5.109 1.00 18.98 C ATOM 170 C ASP A 14 -8.517 17.194 -4.681 1.00 18.18 C ATOM 171 O ASP A 14 -8.271 16.528 -3.671 1.00 18.03 O ATOM 172 CB ASP A 14 -6.130 17.862 -5.035 1.00 19.31 C ATOM 173 CG ASP A 14 -5.162 18.868 -5.626 1.00 19.60 C ATOM 174 OD1 ASP A 14 -5.145 19.033 -6.864 1.00 19.65 O1- ATOM 175 OD2 ASP A 14 -4.420 19.515 -4.855 1.00 19.89 O ATOM 0 H ASP A 14 -7.360 19.433 -3.350 1.00 19.48 H new ATOM 0 HA ASP A 14 -7.806 18.600 -6.141 1.00 18.98 H new ATOM 0 HB2 ASP A 14 -5.865 17.678 -3.994 1.00 19.31 H new ATOM 0 HB3 ASP A 14 -6.027 16.913 -5.562 1.00 19.31 H new ATOM 180 N PRO A 15 -9.618 16.985 -5.422 1.00 17.80 N ATOM 181 CA PRO A 15 -10.599 15.948 -5.113 1.00 17.14 C ATOM 182 C PRO A 15 -10.112 14.561 -5.519 1.00 16.68 C ATOM 183 O PRO A 15 -10.406 14.083 -6.619 1.00 16.69 O ATOM 184 CB PRO A 15 -11.836 16.346 -5.939 1.00 17.09 C ATOM 185 CG PRO A 15 -11.501 17.650 -6.589 1.00 17.72 C ATOM 186 CD PRO A 15 -10.003 17.739 -6.618 1.00 18.12 C ATOM 0 HA PRO A 15 -10.797 15.886 -4.043 1.00 17.14 H new ATOM 0 HB2 PRO A 15 -12.066 15.586 -6.686 1.00 17.09 H new ATOM 0 HB3 PRO A 15 -12.715 16.443 -5.302 1.00 17.09 H new ATOM 0 HG2 PRO A 15 -11.912 17.698 -7.597 1.00 17.72 H new ATOM 0 HG3 PRO A 15 -11.928 18.483 -6.031 1.00 17.72 H new ATOM 0 HD2 PRO A 15 -9.588 17.300 -7.525 1.00 18.12 H new ATOM 0 HD3 PRO A 15 -9.657 18.772 -6.576 1.00 18.12 H new ATOM 194 N ALA A 16 -9.367 13.925 -4.627 1.00 16.42 N ATOM 195 CA ALA A 16 -8.839 12.592 -4.879 1.00 16.13 C ATOM 196 C ALA A 16 -9.935 11.545 -4.737 1.00 15.32 C ATOM 197 O ALA A 16 -9.886 10.492 -5.375 1.00 15.30 O ATOM 198 CB ALA A 16 -7.691 12.289 -3.927 1.00 16.58 C ATOM 0 H ALA A 16 -9.114 14.313 -3.718 1.00 16.42 H new ATOM 0 HA ALA A 16 -8.463 12.559 -5.901 1.00 16.13 H new ATOM 0 HB1 ALA A 16 -7.306 11.289 -4.127 1.00 16.58 H new ATOM 0 HB2 ALA A 16 -6.895 13.020 -4.072 1.00 16.58 H new ATOM 0 HB3 ALA A 16 -8.048 12.341 -2.898 1.00 16.58 H new ATOM 204 N ALA A 17 -10.922 11.842 -3.896 1.00 14.80 N ATOM 205 CA ALA A 17 -12.057 10.952 -3.703 1.00 14.13 C ATOM 206 C ALA A 17 -12.940 10.943 -4.944 1.00 13.59 C ATOM 207 O ALA A 17 -13.781 11.827 -5.132 1.00 13.72 O ATOM 208 CB ALA A 17 -12.857 11.370 -2.479 1.00 14.36 C ATOM 0 H ALA A 17 -10.956 12.695 -3.337 1.00 14.80 H new ATOM 0 HA ALA A 17 -11.683 9.941 -3.539 1.00 14.13 H new ATOM 0 HB1 ALA A 17 -13.702 10.694 -2.349 1.00 14.36 H new ATOM 0 HB2 ALA A 17 -12.219 11.328 -1.596 1.00 14.36 H new ATOM 0 HB3 ALA A 17 -13.223 12.388 -2.614 1.00 14.36 H new ATOM 214 N GLY A 18 -12.723 9.953 -5.794 1.00 13.17 N ATOM 215 CA GLY A 18 -13.467 9.844 -7.027 1.00 12.81 C ATOM 216 C GLY A 18 -12.540 9.662 -8.206 1.00 12.32 C ATOM 217 O GLY A 18 -12.050 8.556 -8.441 1.00 12.26 O ATOM 0 H GLY A 18 -12.035 9.214 -5.648 1.00 13.17 H new ATOM 0 HA2 GLY A 18 -14.155 9.000 -6.967 1.00 12.81 H new ATOM 0 HA3 GLY A 18 -14.072 10.739 -7.171 1.00 12.81 H new ATOM 221 N ALA A 19 -12.279 10.763 -8.911 1.00 12.17 N ATOM 222 CA ALA A 19 -11.380 10.803 -10.064 1.00 11.91 C ATOM 223 C ALA A 19 -11.877 9.946 -11.230 1.00 11.79 C ATOM 224 O ALA A 19 -12.181 10.469 -12.304 1.00 11.90 O ATOM 225 CB ALA A 19 -9.986 10.401 -9.630 1.00 11.75 C ATOM 0 H ALA A 19 -12.694 11.669 -8.692 1.00 12.17 H new ATOM 0 HA ALA A 19 -11.357 11.826 -10.439 1.00 11.91 H new ATOM 0 HB1 ALA A 19 -9.315 10.430 -10.488 1.00 11.75 H new ATOM 0 HB2 ALA A 19 -9.629 11.092 -8.867 1.00 11.75 H new ATOM 0 HB3 ALA A 19 -10.009 9.390 -9.222 1.00 11.75 H new ATOM 231 N GLU A 20 -11.963 8.643 -11.004 1.00 11.76 N ATOM 232 CA GLU A 20 -12.403 7.686 -12.018 1.00 11.81 C ATOM 233 C GLU A 20 -11.447 7.656 -13.213 1.00 11.36 C ATOM 234 O GLU A 20 -11.792 8.029 -14.338 1.00 11.31 O ATOM 235 CB GLU A 20 -13.830 8.013 -12.464 1.00 12.34 C ATOM 236 CG GLU A 20 -14.433 6.954 -13.370 1.00 12.69 C ATOM 237 CD GLU A 20 -15.875 7.236 -13.711 1.00 13.43 C ATOM 238 OE1 GLU A 20 -16.130 8.180 -14.486 1.00 13.82 O ATOM 239 OE2 GLU A 20 -16.760 6.512 -13.206 1.00 13.77 O1- ATOM 0 H GLU A 20 -11.729 8.214 -10.109 1.00 11.76 H new ATOM 0 HA GLU A 20 -12.395 6.691 -11.574 1.00 11.81 H new ATOM 0 HB2 GLU A 20 -14.461 8.130 -11.583 1.00 12.34 H new ATOM 0 HB3 GLU A 20 -13.830 8.970 -12.985 1.00 12.34 H new ATOM 0 HG2 GLU A 20 -13.851 6.894 -14.290 1.00 12.69 H new ATOM 0 HG3 GLU A 20 -14.362 5.981 -12.883 1.00 12.69 H new ATOM 246 N LEU A 21 -10.223 7.237 -12.921 1.00 11.26 N ATOM 247 CA LEU A 21 -9.218 6.976 -13.943 1.00 11.08 C ATOM 248 C LEU A 21 -8.374 5.771 -13.547 1.00 10.75 C ATOM 249 O LEU A 21 -8.799 4.630 -13.687 1.00 10.51 O ATOM 250 CB LEU A 21 -8.303 8.180 -14.208 1.00 11.53 C ATOM 251 CG LEU A 21 -8.113 9.145 -13.044 1.00 11.78 C ATOM 252 CD1 LEU A 21 -6.693 9.689 -13.022 1.00 11.96 C ATOM 253 CD2 LEU A 21 -9.107 10.276 -13.178 1.00 12.13 C ATOM 0 H LEU A 21 -9.899 7.068 -11.969 1.00 11.26 H new ATOM 0 HA LEU A 21 -9.758 6.774 -14.868 1.00 11.08 H new ATOM 0 HB2 LEU A 21 -7.324 7.807 -14.508 1.00 11.53 H new ATOM 0 HB3 LEU A 21 -8.705 8.737 -15.054 1.00 11.53 H new ATOM 0 HG LEU A 21 -8.283 8.616 -12.106 1.00 11.78 H new ATOM 0 HD11 LEU A 21 -6.579 10.376 -12.183 1.00 11.96 H new ATOM 0 HD12 LEU A 21 -5.989 8.864 -12.913 1.00 11.96 H new ATOM 0 HD13 LEU A 21 -6.491 10.218 -13.954 1.00 11.96 H new ATOM 0 HD21 LEU A 21 -8.979 10.973 -12.349 1.00 12.13 H new ATOM 0 HD22 LEU A 21 -8.939 10.798 -14.120 1.00 12.13 H new ATOM 0 HD23 LEU A 21 -10.120 9.874 -13.161 1.00 12.13 H new ATOM 265 N LYS A 22 -7.189 6.026 -13.016 1.00 10.97 N ATOM 266 CA LYS A 22 -6.316 4.961 -12.569 1.00 10.97 C ATOM 267 C LYS A 22 -6.562 4.681 -11.091 1.00 10.51 C ATOM 268 O LYS A 22 -6.587 3.532 -10.652 1.00 10.50 O ATOM 269 CB LYS A 22 -4.857 5.353 -12.798 1.00 11.77 C ATOM 270 CG LYS A 22 -4.541 5.760 -14.233 1.00 12.31 C ATOM 271 CD LYS A 22 -4.918 4.679 -15.240 1.00 13.08 C ATOM 272 CE LYS A 22 -4.141 3.390 -15.013 1.00 13.66 C ATOM 273 NZ LYS A 22 -4.491 2.350 -16.015 1.00 14.10 N1+ ATOM 0 H LYS A 22 -6.812 6.965 -12.885 1.00 10.97 H new ATOM 0 HA LYS A 22 -6.529 4.057 -13.140 1.00 10.97 H new ATOM 0 HB2 LYS A 22 -4.605 6.179 -12.133 1.00 11.77 H new ATOM 0 HB3 LYS A 22 -4.218 4.514 -12.520 1.00 11.77 H new ATOM 0 HG2 LYS A 22 -5.076 6.679 -14.473 1.00 12.31 H new ATOM 0 HG3 LYS A 22 -3.477 5.978 -14.320 1.00 12.31 H new ATOM 0 HD2 LYS A 22 -5.986 4.475 -15.170 1.00 13.08 H new ATOM 0 HD3 LYS A 22 -4.729 5.043 -16.250 1.00 13.08 H new ATOM 0 HE2 LYS A 22 -3.072 3.597 -15.062 1.00 13.66 H new ATOM 0 HE3 LYS A 22 -4.347 3.013 -14.011 1.00 13.66 H new ATOM 0 HZ1 LYS A 22 -3.941 1.488 -15.827 1.00 14.10 H new ATOM 0 HZ2 LYS A 22 -5.506 2.134 -15.951 1.00 14.10 H new ATOM 0 HZ3 LYS A 22 -4.271 2.699 -16.969 1.00 14.10 H new ATOM 287 N THR A 23 -6.743 5.748 -10.331 1.00 10.33 N ATOM 288 CA THR A 23 -6.980 5.650 -8.902 1.00 10.01 C ATOM 289 C THR A 23 -7.846 6.820 -8.449 1.00 10.01 C ATOM 290 O THR A 23 -7.811 7.890 -9.059 1.00 10.38 O ATOM 291 CB THR A 23 -5.643 5.640 -8.128 1.00 10.64 C ATOM 292 OG1 THR A 23 -4.815 4.574 -8.616 1.00 10.93 O ATOM 293 CG2 THR A 23 -5.863 5.462 -6.632 1.00 11.05 C ATOM 0 H THR A 23 -6.730 6.704 -10.687 1.00 10.33 H new ATOM 0 HA THR A 23 -7.500 4.715 -8.692 1.00 10.01 H new ATOM 0 HB THR A 23 -5.155 6.601 -8.288 1.00 10.64 H new ATOM 0 HG1 THR A 23 -5.101 3.727 -8.214 1.00 10.93 H new ATOM 0 HG21 THR A 23 -4.901 5.460 -6.120 1.00 11.05 H new ATOM 0 HG22 THR A 23 -6.473 6.282 -6.254 1.00 11.05 H new ATOM 0 HG23 THR A 23 -6.373 4.516 -6.449 1.00 11.05 H new ATOM 301 N GLY A 24 -8.645 6.604 -7.413 1.00 9.82 N ATOM 302 CA GLY A 24 -9.512 7.651 -6.910 1.00 10.05 C ATOM 303 C GLY A 24 -10.623 7.095 -6.056 1.00 9.39 C ATOM 304 O GLY A 24 -10.935 7.629 -4.994 1.00 9.61 O ATOM 0 H GLY A 24 -8.708 5.719 -6.910 1.00 9.82 H new ATOM 0 HA2 GLY A 24 -8.925 8.360 -6.326 1.00 10.05 H new ATOM 0 HA3 GLY A 24 -9.939 8.203 -7.747 1.00 10.05 H new ATOM 308 N LYS A 25 -11.227 6.021 -6.531 1.00 8.70 N ATOM 309 CA LYS A 25 -12.273 5.347 -5.789 1.00 8.11 C ATOM 310 C LYS A 25 -12.246 3.870 -6.148 1.00 7.19 C ATOM 311 O LYS A 25 -13.233 3.260 -6.520 1.00 6.94 O ATOM 312 CB LYS A 25 -13.645 6.031 -6.024 1.00 8.62 C ATOM 313 CG LYS A 25 -14.434 5.614 -7.269 1.00 9.02 C ATOM 314 CD LYS A 25 -13.681 5.853 -8.567 1.00 9.74 C ATOM 315 CE LYS A 25 -14.537 5.486 -9.771 1.00 10.22 C ATOM 316 NZ LYS A 25 -15.033 4.084 -9.703 1.00 10.38 N1+ ATOM 0 H LYS A 25 -11.009 5.596 -7.432 1.00 8.70 H new ATOM 0 HA LYS A 25 -12.100 5.425 -4.716 1.00 8.11 H new ATOM 0 HB2 LYS A 25 -14.269 5.843 -5.150 1.00 8.62 H new ATOM 0 HB3 LYS A 25 -13.481 7.107 -6.073 1.00 8.62 H new ATOM 0 HG2 LYS A 25 -14.686 4.556 -7.193 1.00 9.02 H new ATOM 0 HG3 LYS A 25 -15.374 6.165 -7.296 1.00 9.02 H new ATOM 0 HD2 LYS A 25 -13.385 6.900 -8.632 1.00 9.74 H new ATOM 0 HD3 LYS A 25 -12.765 5.262 -8.574 1.00 9.74 H new ATOM 0 HE2 LYS A 25 -15.386 6.167 -9.832 1.00 10.22 H new ATOM 0 HE3 LYS A 25 -13.955 5.620 -10.683 1.00 10.22 H new ATOM 0 HZ1 LYS A 25 -15.419 3.807 -10.628 1.00 10.38 H new ATOM 0 HZ2 LYS A 25 -14.248 3.450 -9.451 1.00 10.38 H new ATOM 0 HZ3 LYS A 25 -15.779 4.014 -8.982 1.00 10.38 H new ATOM 330 N ARG A 26 -11.063 3.313 -6.010 1.00 6.90 N ATOM 331 CA ARG A 26 -10.804 1.923 -6.334 1.00 6.23 C ATOM 332 C ARG A 26 -10.475 1.159 -5.062 1.00 5.83 C ATOM 333 O ARG A 26 -9.795 1.679 -4.186 1.00 6.27 O ATOM 334 CB ARG A 26 -9.656 1.863 -7.335 1.00 6.68 C ATOM 335 CG ARG A 26 -10.082 2.273 -8.732 1.00 7.16 C ATOM 336 CD ARG A 26 -10.475 1.066 -9.572 1.00 7.38 C ATOM 337 NE ARG A 26 -9.325 0.215 -9.887 1.00 7.54 N ATOM 338 CZ ARG A 26 -9.234 -1.076 -9.565 1.00 7.99 C ATOM 339 NH1 ARG A 26 -10.183 -1.661 -8.845 1.00 8.33 N1+ ATOM 340 NH2 ARG A 26 -8.178 -1.784 -9.951 1.00 8.37 N ATOM 0 H ARG A 26 -10.244 3.815 -5.667 1.00 6.90 H new ATOM 0 HA ARG A 26 -11.683 1.460 -6.783 1.00 6.23 H new ATOM 0 HB2 ARG A 26 -8.850 2.515 -6.998 1.00 6.68 H new ATOM 0 HB3 ARG A 26 -9.255 0.850 -7.363 1.00 6.68 H new ATOM 0 HG2 ARG A 26 -10.923 2.963 -8.669 1.00 7.16 H new ATOM 0 HG3 ARG A 26 -9.267 2.807 -9.220 1.00 7.16 H new ATOM 0 HD2 ARG A 26 -11.223 0.481 -9.037 1.00 7.38 H new ATOM 0 HD3 ARG A 26 -10.939 1.405 -10.498 1.00 7.38 H new ATOM 0 HE ARG A 26 -8.542 0.638 -10.386 1.00 7.54 H new ATOM 0 HH11 ARG A 26 -10.991 -1.123 -8.533 1.00 8.33 H new ATOM 0 HH12 ARG A 26 -10.104 -2.649 -8.604 1.00 8.33 H new ATOM 0 HH21 ARG A 26 -7.437 -1.340 -10.494 1.00 8.37 H new ATOM 0 HH22 ARG A 26 -8.108 -2.771 -9.705 1.00 8.37 H new ATOM 354 N ILE A 27 -10.993 -0.064 -4.973 1.00 5.15 N ATOM 355 CA ILE A 27 -10.947 -0.853 -3.745 1.00 4.81 C ATOM 356 C ILE A 27 -9.551 -0.968 -3.179 1.00 5.34 C ATOM 357 O ILE A 27 -8.634 -1.475 -3.825 1.00 5.76 O ATOM 358 CB ILE A 27 -11.462 -2.285 -3.943 1.00 4.32 C ATOM 359 CG1 ILE A 27 -12.837 -2.310 -4.600 1.00 4.09 C ATOM 360 CG2 ILE A 27 -11.503 -3.011 -2.609 1.00 4.22 C ATOM 361 CD1 ILE A 27 -13.969 -1.918 -3.693 1.00 4.18 C ATOM 0 H ILE A 27 -11.456 -0.535 -5.750 1.00 5.15 H new ATOM 0 HA ILE A 27 -11.593 -0.309 -3.055 1.00 4.81 H new ATOM 0 HB ILE A 27 -10.771 -2.796 -4.614 1.00 4.32 H new ATOM 0 HG12 ILE A 27 -12.827 -1.639 -5.459 1.00 4.09 H new ATOM 0 HG13 ILE A 27 -13.025 -3.314 -4.982 1.00 4.09 H new ATOM 0 HG21 ILE A 27 -11.870 -4.027 -2.759 1.00 4.22 H new ATOM 0 HG22 ILE A 27 -10.500 -3.046 -2.183 1.00 4.22 H new ATOM 0 HG23 ILE A 27 -12.169 -2.482 -1.927 1.00 4.22 H new ATOM 0 HD11 ILE A 27 -14.909 -1.964 -4.243 1.00 4.18 H new ATOM 0 HD12 ILE A 27 -14.011 -2.603 -2.846 1.00 4.18 H new ATOM 0 HD13 ILE A 27 -13.810 -0.902 -3.331 1.00 4.18 H new ATOM 373 N LEU A 28 -9.427 -0.507 -1.957 1.00 5.52 N ATOM 374 CA LEU A 28 -8.214 -0.670 -1.189 1.00 6.20 C ATOM 375 C LEU A 28 -8.326 -1.889 -0.274 1.00 6.05 C ATOM 376 O LEU A 28 -7.358 -2.621 -0.090 1.00 6.59 O ATOM 377 CB LEU A 28 -7.977 0.589 -0.366 1.00 6.86 C ATOM 378 CG LEU A 28 -6.954 1.590 -0.924 1.00 7.51 C ATOM 379 CD1 LEU A 28 -5.568 0.967 -0.973 1.00 8.22 C ATOM 380 CD2 LEU A 28 -7.366 2.086 -2.299 1.00 7.71 C ATOM 0 H LEU A 28 -10.167 -0.006 -1.465 1.00 5.52 H new ATOM 0 HA LEU A 28 -7.373 -0.828 -1.864 1.00 6.20 H new ATOM 0 HB2 LEU A 28 -8.930 1.105 -0.249 1.00 6.86 H new ATOM 0 HB3 LEU A 28 -7.652 0.289 0.630 1.00 6.86 H new ATOM 0 HG LEU A 28 -6.924 2.448 -0.253 1.00 7.51 H new ATOM 0 HD11 LEU A 28 -4.857 1.691 -1.371 1.00 8.22 H new ATOM 0 HD12 LEU A 28 -5.264 0.676 0.032 1.00 8.22 H new ATOM 0 HD13 LEU A 28 -5.587 0.087 -1.616 1.00 8.22 H new ATOM 0 HD21 LEU A 28 -6.623 2.793 -2.668 1.00 7.71 H new ATOM 0 HD22 LEU A 28 -7.436 1.241 -2.985 1.00 7.71 H new ATOM 0 HD23 LEU A 28 -8.335 2.580 -2.232 1.00 7.71 H new ATOM 392 N TYR A 29 -9.524 -2.109 0.280 1.00 5.47 N ATOM 393 CA TYR A 29 -9.749 -3.201 1.229 1.00 5.43 C ATOM 394 C TYR A 29 -11.238 -3.347 1.560 1.00 4.86 C ATOM 395 O TYR A 29 -12.089 -2.656 0.993 1.00 4.58 O ATOM 396 CB TYR A 29 -8.964 -2.948 2.517 1.00 6.20 C ATOM 397 CG TYR A 29 -9.498 -1.794 3.336 1.00 6.41 C ATOM 398 CD1 TYR A 29 -9.212 -0.488 2.986 1.00 6.76 C ATOM 399 CD2 TYR A 29 -10.300 -2.014 4.441 1.00 6.48 C ATOM 400 CE1 TYR A 29 -9.707 0.572 3.716 1.00 7.24 C ATOM 401 CE2 TYR A 29 -10.805 -0.961 5.177 1.00 6.91 C ATOM 402 CZ TYR A 29 -10.504 0.331 4.813 1.00 7.33 C ATOM 403 OH TYR A 29 -11.009 1.387 5.540 1.00 7.99 O ATOM 0 H TYR A 29 -10.351 -1.544 0.086 1.00 5.47 H new ATOM 0 HA TYR A 29 -9.404 -4.125 0.765 1.00 5.43 H new ATOM 0 HB2 TYR A 29 -8.980 -3.852 3.126 1.00 6.20 H new ATOM 0 HB3 TYR A 29 -7.922 -2.752 2.265 1.00 6.20 H new ATOM 0 HD1 TYR A 29 -8.589 -0.294 2.125 1.00 6.76 H new ATOM 0 HD2 TYR A 29 -10.535 -3.027 4.733 1.00 6.48 H new ATOM 0 HE1 TYR A 29 -9.471 1.586 3.429 1.00 7.24 H new ATOM 0 HE2 TYR A 29 -11.433 -1.151 6.035 1.00 6.91 H new ATOM 0 HH TYR A 29 -10.914 2.215 5.024 1.00 7.99 H new ATOM 413 N TRP A 30 -11.525 -4.260 2.488 1.00 4.95 N ATOM 414 CA TRP A 30 -12.885 -4.583 2.910 1.00 4.73 C ATOM 415 C TRP A 30 -13.061 -4.321 4.401 1.00 5.18 C ATOM 416 O TRP A 30 -12.093 -4.365 5.156 1.00 5.61 O ATOM 417 CB TRP A 30 -13.168 -6.055 2.634 1.00 4.74 C ATOM 418 CG TRP A 30 -13.828 -6.311 1.319 1.00 4.48 C ATOM 419 CD1 TRP A 30 -15.138 -6.626 1.115 1.00 4.66 C ATOM 420 CD2 TRP A 30 -13.218 -6.277 0.028 1.00 4.33 C ATOM 421 NE1 TRP A 30 -15.376 -6.808 -0.224 1.00 4.65 N ATOM 422 CE2 TRP A 30 -14.213 -6.598 -0.911 1.00 4.37 C ATOM 423 CE3 TRP A 30 -11.924 -6.016 -0.425 1.00 4.46 C ATOM 424 CZ2 TRP A 30 -13.955 -6.659 -2.274 1.00 4.41 C ATOM 425 CZ3 TRP A 30 -11.670 -6.077 -1.779 1.00 4.49 C ATOM 426 CH2 TRP A 30 -12.679 -6.399 -2.688 1.00 4.40 C ATOM 0 H TRP A 30 -10.810 -4.802 2.973 1.00 4.95 H new ATOM 0 HA TRP A 30 -13.578 -3.954 2.351 1.00 4.73 H new ATOM 0 HB2 TRP A 30 -12.229 -6.608 2.671 1.00 4.74 H new ATOM 0 HB3 TRP A 30 -13.801 -6.448 3.429 1.00 4.74 H new ATOM 0 HD1 TRP A 30 -15.881 -6.719 1.894 1.00 4.66 H new ATOM 0 HE1 TRP A 30 -16.273 -7.059 -0.639 1.00 4.65 H new ATOM 0 HE3 TRP A 30 -11.136 -5.771 0.272 1.00 4.46 H new ATOM 0 HZ2 TRP A 30 -14.734 -6.903 -2.981 1.00 4.41 H new ATOM 0 HZ3 TRP A 30 -10.674 -5.872 -2.142 1.00 4.49 H new ATOM 0 HH2 TRP A 30 -12.446 -6.444 -3.742 1.00 4.40 H new ATOM 437 N ARG A 31 -14.297 -4.058 4.807 1.00 5.31 N ATOM 438 CA ARG A 31 -14.614 -3.706 6.188 1.00 5.89 C ATOM 439 C ARG A 31 -16.106 -3.873 6.451 1.00 6.18 C ATOM 440 O ARG A 31 -16.923 -3.712 5.540 1.00 6.15 O ATOM 441 CB ARG A 31 -14.229 -2.247 6.433 1.00 6.39 C ATOM 442 CG ARG A 31 -14.972 -1.281 5.523 1.00 6.58 C ATOM 443 CD ARG A 31 -14.430 0.135 5.630 1.00 7.25 C ATOM 444 NE ARG A 31 -15.117 1.046 4.715 1.00 7.68 N ATOM 445 CZ ARG A 31 -14.648 2.238 4.347 1.00 8.49 C ATOM 446 NH1 ARG A 31 -13.455 2.652 4.762 1.00 8.90 N1+ ATOM 447 NH2 ARG A 31 -15.365 3.010 3.539 1.00 9.06 N ATOM 0 H ARG A 31 -15.108 -4.082 4.189 1.00 5.31 H new ATOM 0 HA ARG A 31 -14.058 -4.364 6.856 1.00 5.89 H new ATOM 0 HB2 ARG A 31 -14.435 -1.991 7.472 1.00 6.39 H new ATOM 0 HB3 ARG A 31 -13.156 -2.129 6.282 1.00 6.39 H new ATOM 0 HG2 ARG A 31 -14.893 -1.622 4.491 1.00 6.58 H new ATOM 0 HG3 ARG A 31 -16.031 -1.284 5.779 1.00 6.58 H new ATOM 0 HD2 ARG A 31 -14.544 0.492 6.653 1.00 7.25 H new ATOM 0 HD3 ARG A 31 -13.362 0.134 5.410 1.00 7.25 H new ATOM 0 HE ARG A 31 -16.015 0.749 4.333 1.00 7.68 H new ATOM 0 HH11 ARG A 31 -12.890 2.056 5.367 1.00 8.90 H new ATOM 0 HH12 ARG A 31 -13.104 3.566 4.475 1.00 8.90 H new ATOM 0 HH21 ARG A 31 -16.273 2.690 3.201 1.00 9.06 H new ATOM 0 HH22 ARG A 31 -15.008 3.923 3.256 1.00 9.06 H new ATOM 461 N ASP A 32 -16.469 -4.216 7.686 1.00 6.64 N ATOM 462 CA ASP A 32 -17.869 -4.169 8.086 1.00 7.19 C ATOM 463 C ASP A 32 -18.295 -2.718 8.164 1.00 7.82 C ATOM 464 O ASP A 32 -17.565 -1.873 8.683 1.00 8.07 O ATOM 465 CB ASP A 32 -18.141 -4.768 9.479 1.00 7.56 C ATOM 466 CG ASP A 32 -17.455 -6.077 9.773 1.00 7.94 C ATOM 467 OD1 ASP A 32 -16.218 -6.113 9.666 1.00 8.31 O1- ATOM 468 OD2 ASP A 32 -18.143 -7.075 10.045 1.00 8.10 O ATOM 0 H ASP A 32 -15.824 -4.524 8.414 1.00 6.64 H new ATOM 0 HA ASP A 32 -18.416 -4.753 7.346 1.00 7.19 H new ATOM 0 HB2 ASP A 32 -17.836 -4.042 10.232 1.00 7.56 H new ATOM 0 HB3 ASP A 32 -19.216 -4.909 9.590 1.00 7.56 H new ATOM 473 N PRO A 33 -19.491 -2.412 7.665 1.00 8.28 N ATOM 474 CA PRO A 33 -20.129 -1.121 7.900 1.00 9.11 C ATOM 475 C PRO A 33 -20.389 -0.909 9.388 1.00 9.74 C ATOM 476 O PRO A 33 -20.723 0.190 9.821 1.00 10.41 O ATOM 477 CB PRO A 33 -21.456 -1.199 7.141 1.00 9.60 C ATOM 478 CG PRO A 33 -21.359 -2.394 6.253 1.00 8.98 C ATOM 479 CD PRO A 33 -20.286 -3.290 6.806 1.00 8.23 C ATOM 0 HA PRO A 33 -19.504 -0.292 7.568 1.00 9.11 H new ATOM 0 HB2 PRO A 33 -22.294 -1.294 7.831 1.00 9.60 H new ATOM 0 HB3 PRO A 33 -21.625 -0.294 6.558 1.00 9.60 H new ATOM 0 HG2 PRO A 33 -22.313 -2.920 6.214 1.00 8.98 H new ATOM 0 HG3 PRO A 33 -21.118 -2.094 5.233 1.00 8.98 H new ATOM 0 HD2 PRO A 33 -20.712 -4.120 7.370 1.00 8.23 H new ATOM 0 HD3 PRO A 33 -19.680 -3.723 6.010 1.00 8.23 H new ATOM 487 N MET A 34 -20.235 -1.984 10.158 1.00 9.60 N ATOM 488 CA MET A 34 -20.392 -1.935 11.603 1.00 10.19 C ATOM 489 C MET A 34 -19.040 -1.833 12.302 1.00 9.99 C ATOM 490 O MET A 34 -18.974 -1.799 13.530 1.00 10.53 O ATOM 491 CB MET A 34 -21.132 -3.173 12.124 1.00 10.40 C ATOM 492 CG MET A 34 -22.636 -3.148 11.903 1.00 10.85 C ATOM 493 SD MET A 34 -23.236 -4.428 10.774 1.00 10.55 S ATOM 494 CE MET A 34 -22.658 -3.811 9.209 1.00 10.30 C ATOM 0 H MET A 34 -19.999 -2.908 9.796 1.00 9.60 H new ATOM 0 HA MET A 34 -20.980 -1.045 11.828 1.00 10.19 H new ATOM 0 HB2 MET A 34 -20.721 -4.058 11.638 1.00 10.40 H new ATOM 0 HB3 MET A 34 -20.936 -3.275 13.191 1.00 10.40 H new ATOM 0 HG2 MET A 34 -23.136 -3.263 12.865 1.00 10.85 H new ATOM 0 HG3 MET A 34 -22.919 -2.171 11.511 1.00 10.85 H new ATOM 0 HE1 MET A 34 -23.242 -4.258 8.404 1.00 10.30 H new ATOM 0 HE2 MET A 34 -22.771 -2.727 9.181 1.00 10.30 H new ATOM 0 HE3 MET A 34 -21.607 -4.070 9.082 1.00 10.30 H new ATOM 504 N VAL A 35 -17.960 -1.777 11.528 1.00 9.32 N ATOM 505 CA VAL A 35 -16.627 -1.605 12.107 1.00 9.27 C ATOM 506 C VAL A 35 -15.829 -0.482 11.403 1.00 9.25 C ATOM 507 O VAL A 35 -14.661 -0.653 11.050 1.00 8.98 O ATOM 508 CB VAL A 35 -15.833 -2.934 12.084 1.00 8.70 C ATOM 509 CG1 VAL A 35 -16.660 -4.050 12.707 1.00 8.84 C ATOM 510 CG2 VAL A 35 -15.388 -3.298 10.674 1.00 7.95 C ATOM 0 H VAL A 35 -17.978 -1.847 10.511 1.00 9.32 H new ATOM 0 HA VAL A 35 -16.768 -1.305 13.145 1.00 9.27 H new ATOM 0 HB VAL A 35 -14.929 -2.799 12.678 1.00 8.70 H new ATOM 0 HG11 VAL A 35 -16.091 -4.980 12.685 1.00 8.84 H new ATOM 0 HG12 VAL A 35 -16.897 -3.794 13.740 1.00 8.84 H new ATOM 0 HG13 VAL A 35 -17.584 -4.177 12.143 1.00 8.84 H new ATOM 0 HG21 VAL A 35 -14.834 -4.236 10.698 1.00 7.95 H new ATOM 0 HG22 VAL A 35 -16.263 -3.410 10.034 1.00 7.95 H new ATOM 0 HG23 VAL A 35 -14.748 -2.509 10.279 1.00 7.95 H new ATOM 520 N PRO A 36 -16.429 0.713 11.235 1.00 9.74 N ATOM 521 CA PRO A 36 -15.812 1.813 10.487 1.00 9.85 C ATOM 522 C PRO A 36 -14.378 2.095 10.934 1.00 10.22 C ATOM 523 O PRO A 36 -14.127 2.385 12.104 1.00 10.95 O ATOM 524 CB PRO A 36 -16.714 3.020 10.784 1.00 10.65 C ATOM 525 CG PRO A 36 -17.574 2.597 11.926 1.00 11.10 C ATOM 526 CD PRO A 36 -17.724 1.113 11.791 1.00 10.41 C ATOM 0 HA PRO A 36 -15.738 1.578 9.425 1.00 9.85 H new ATOM 0 HB2 PRO A 36 -16.123 3.899 11.041 1.00 10.65 H new ATOM 0 HB3 PRO A 36 -17.316 3.284 9.915 1.00 10.65 H new ATOM 0 HG2 PRO A 36 -17.116 2.859 12.880 1.00 11.10 H new ATOM 0 HG3 PRO A 36 -18.544 3.094 11.891 1.00 11.10 H new ATOM 0 HD2 PRO A 36 -17.918 0.636 12.751 1.00 10.41 H new ATOM 0 HD3 PRO A 36 -18.549 0.847 11.130 1.00 10.41 H new ATOM 534 N GLY A 37 -13.445 1.991 9.997 1.00 9.82 N ATOM 535 CA GLY A 37 -12.051 2.221 10.310 1.00 10.31 C ATOM 536 C GLY A 37 -11.220 0.957 10.211 1.00 9.86 C ATOM 537 O GLY A 37 -10.016 1.017 9.964 1.00 10.21 O ATOM 0 H GLY A 37 -13.631 1.751 9.023 1.00 9.82 H new ATOM 0 HA2 GLY A 37 -11.648 2.972 9.630 1.00 10.31 H new ATOM 0 HA3 GLY A 37 -11.970 2.628 11.318 1.00 10.31 H new ATOM 541 N GLN A 38 -11.866 -0.187 10.393 1.00 9.21 N ATOM 542 CA GLN A 38 -11.180 -1.471 10.365 1.00 8.88 C ATOM 543 C GLN A 38 -10.705 -1.806 8.956 1.00 8.38 C ATOM 544 O GLN A 38 -11.493 -2.157 8.081 1.00 8.00 O ATOM 545 CB GLN A 38 -12.101 -2.565 10.898 1.00 8.51 C ATOM 546 CG GLN A 38 -11.509 -3.960 10.887 1.00 8.11 C ATOM 547 CD GLN A 38 -10.143 -4.043 11.529 1.00 8.18 C ATOM 548 OE1 GLN A 38 -9.117 -3.968 10.709 1.00 8.47 O flip ATOM 549 NE2 GLN A 38 -10.016 -4.207 12.742 1.00 8.21 N flip ATOM 0 H GLN A 38 -12.870 -0.251 10.562 1.00 9.21 H new ATOM 0 HA GLN A 38 -10.301 -1.408 11.006 1.00 8.88 H new ATOM 0 HB2 GLN A 38 -12.385 -2.315 11.920 1.00 8.51 H new ATOM 0 HB3 GLN A 38 -13.016 -2.570 10.306 1.00 8.51 H new ATOM 0 HG2 GLN A 38 -12.187 -4.637 11.406 1.00 8.11 H new ATOM 0 HG3 GLN A 38 -11.439 -4.308 9.856 1.00 8.11 H new ATOM 0 HE21 GLN A 38 -10.842 -4.259 13.339 1.00 8.21 H new ATOM 0 HE22 GLN A 38 -9.085 -4.291 13.151 1.00 8.21 H new ATOM 558 N ARG A 39 -9.407 -1.685 8.754 1.00 8.53 N ATOM 559 CA ARG A 39 -8.787 -2.000 7.486 1.00 8.21 C ATOM 560 C ARG A 39 -8.376 -3.460 7.443 1.00 8.04 C ATOM 561 O ARG A 39 -7.366 -3.853 8.027 1.00 8.70 O ATOM 562 CB ARG A 39 -7.573 -1.123 7.294 1.00 8.96 C ATOM 563 CG ARG A 39 -6.941 -1.290 5.934 1.00 8.86 C ATOM 564 CD ARG A 39 -5.855 -0.273 5.733 1.00 9.10 C ATOM 565 NE ARG A 39 -4.756 -0.458 6.681 1.00 10.02 N ATOM 566 CZ ARG A 39 -4.157 0.531 7.344 1.00 10.60 C ATOM 567 NH1 ARG A 39 -4.525 1.791 7.145 1.00 10.42 N1+ ATOM 568 NH2 ARG A 39 -3.188 0.259 8.205 1.00 11.51 N ATOM 0 H ARG A 39 -8.753 -1.364 9.468 1.00 8.53 H new ATOM 0 HA ARG A 39 -9.504 -1.818 6.685 1.00 8.21 H new ATOM 0 HB2 ARG A 39 -7.858 -0.080 7.432 1.00 8.96 H new ATOM 0 HB3 ARG A 39 -6.837 -1.356 8.063 1.00 8.96 H new ATOM 0 HG2 ARG A 39 -6.529 -2.295 5.838 1.00 8.86 H new ATOM 0 HG3 ARG A 39 -7.699 -1.181 5.158 1.00 8.86 H new ATOM 0 HD2 ARG A 39 -5.473 -0.346 4.715 1.00 9.10 H new ATOM 0 HD3 ARG A 39 -6.269 0.729 5.847 1.00 9.10 H new ATOM 0 HE ARG A 39 -4.426 -1.409 6.846 1.00 10.02 H new ATOM 0 HH11 ARG A 39 -5.270 2.006 6.482 1.00 10.42 H new ATOM 0 HH12 ARG A 39 -4.063 2.544 7.655 1.00 10.42 H new ATOM 0 HH21 ARG A 39 -2.900 -0.707 8.361 1.00 11.51 H new ATOM 0 HH22 ARG A 39 -2.729 1.016 8.712 1.00 11.51 H new ATOM 582 N PHE A 40 -9.183 -4.261 6.770 1.00 7.31 N ATOM 583 CA PHE A 40 -8.897 -5.679 6.626 1.00 7.34 C ATOM 584 C PHE A 40 -7.925 -5.905 5.485 1.00 7.47 C ATOM 585 O PHE A 40 -7.941 -5.196 4.483 1.00 7.06 O ATOM 586 CB PHE A 40 -10.175 -6.474 6.369 1.00 6.76 C ATOM 587 CG PHE A 40 -11.051 -6.624 7.575 1.00 6.92 C ATOM 588 CD1 PHE A 40 -10.815 -7.629 8.495 1.00 7.27 C ATOM 589 CD2 PHE A 40 -12.118 -5.771 7.781 1.00 6.93 C ATOM 590 CE1 PHE A 40 -11.628 -7.782 9.596 1.00 7.50 C ATOM 591 CE2 PHE A 40 -12.936 -5.916 8.883 1.00 7.26 C ATOM 592 CZ PHE A 40 -12.690 -6.924 9.792 1.00 7.49 C ATOM 0 H PHE A 40 -10.042 -3.954 6.314 1.00 7.31 H new ATOM 0 HA PHE A 40 -8.452 -6.026 7.559 1.00 7.34 H new ATOM 0 HB2 PHE A 40 -10.743 -5.984 5.578 1.00 6.76 H new ATOM 0 HB3 PHE A 40 -9.907 -7.465 6.002 1.00 6.76 H new ATOM 0 HD1 PHE A 40 -9.983 -8.302 8.348 1.00 7.27 H new ATOM 0 HD2 PHE A 40 -12.314 -4.981 7.071 1.00 6.93 H new ATOM 0 HE1 PHE A 40 -11.434 -8.573 10.305 1.00 7.50 H new ATOM 0 HE2 PHE A 40 -13.766 -5.242 9.033 1.00 7.26 H new ATOM 0 HZ PHE A 40 -13.328 -7.041 10.656 1.00 7.49 H new ATOM 602 N ASP A 41 -7.099 -6.929 5.663 1.00 8.18 N ATOM 603 CA ASP A 41 -6.023 -7.261 4.736 1.00 8.62 C ATOM 604 C ASP A 41 -6.566 -7.655 3.376 1.00 8.07 C ATOM 605 O ASP A 41 -5.869 -7.535 2.369 1.00 8.18 O ATOM 606 CB ASP A 41 -5.196 -8.416 5.304 1.00 9.62 C ATOM 607 CG ASP A 41 -4.339 -8.004 6.484 1.00 10.23 C ATOM 608 OD1 ASP A 41 -4.860 -7.964 7.618 1.00 10.61 O ATOM 609 OD2 ASP A 41 -3.143 -7.705 6.284 1.00 10.48 O1- ATOM 0 H ASP A 41 -7.158 -7.559 6.463 1.00 8.18 H new ATOM 0 HA ASP A 41 -5.399 -6.376 4.612 1.00 8.62 H new ATOM 0 HB2 ASP A 41 -5.866 -9.219 5.611 1.00 9.62 H new ATOM 0 HB3 ASP A 41 -4.555 -8.818 4.519 1.00 9.62 H new ATOM 614 N LYS A 42 -7.800 -8.147 3.354 1.00 7.60 N ATOM 615 CA LYS A 42 -8.431 -8.583 2.117 1.00 7.23 C ATOM 616 C LYS A 42 -9.903 -8.930 2.337 1.00 6.69 C ATOM 617 O LYS A 42 -10.326 -9.068 3.488 1.00 6.78 O ATOM 618 CB LYS A 42 -7.678 -9.782 1.512 1.00 8.14 C ATOM 619 CG LYS A 42 -7.460 -10.923 2.494 1.00 8.90 C ATOM 620 CD LYS A 42 -6.654 -12.046 1.865 1.00 9.77 C ATOM 621 CE LYS A 42 -6.433 -13.191 2.839 1.00 10.52 C ATOM 622 NZ LYS A 42 -5.613 -14.277 2.243 1.00 10.91 N1+ ATOM 0 H LYS A 42 -8.384 -8.253 4.184 1.00 7.60 H new ATOM 0 HA LYS A 42 -8.383 -7.754 1.411 1.00 7.23 H new ATOM 0 HB2 LYS A 42 -8.236 -10.155 0.653 1.00 8.14 H new ATOM 0 HB3 LYS A 42 -6.711 -9.443 1.141 1.00 8.14 H new ATOM 0 HG2 LYS A 42 -6.941 -10.551 3.378 1.00 8.90 H new ATOM 0 HG3 LYS A 42 -8.424 -11.307 2.828 1.00 8.90 H new ATOM 0 HD2 LYS A 42 -7.173 -12.415 0.980 1.00 9.77 H new ATOM 0 HD3 LYS A 42 -5.691 -11.660 1.532 1.00 9.77 H new ATOM 0 HE2 LYS A 42 -5.940 -12.815 3.735 1.00 10.52 H new ATOM 0 HE3 LYS A 42 -7.397 -13.594 3.150 1.00 10.52 H new ATOM 0 HZ1 LYS A 42 -5.486 -15.038 2.940 1.00 10.91 H new ATOM 0 HZ2 LYS A 42 -6.095 -14.654 1.402 1.00 10.91 H new ATOM 0 HZ3 LYS A 42 -4.683 -13.900 1.969 1.00 10.91 H new ATOM 636 N PRO A 43 -10.703 -9.045 1.263 1.00 6.27 N ATOM 637 CA PRO A 43 -12.123 -9.446 1.337 1.00 6.04 C ATOM 638 C PRO A 43 -12.360 -10.732 2.153 1.00 6.80 C ATOM 639 O PRO A 43 -11.419 -11.434 2.544 1.00 7.51 O ATOM 640 CB PRO A 43 -12.513 -9.656 -0.141 1.00 6.00 C ATOM 641 CG PRO A 43 -11.213 -9.700 -0.875 1.00 6.35 C ATOM 642 CD PRO A 43 -10.319 -8.763 -0.122 1.00 6.19 C ATOM 0 HA PRO A 43 -12.720 -8.694 1.852 1.00 6.04 H new ATOM 0 HB2 PRO A 43 -13.074 -10.581 -0.275 1.00 6.00 H new ATOM 0 HB3 PRO A 43 -13.145 -8.845 -0.503 1.00 6.00 H new ATOM 0 HG2 PRO A 43 -10.803 -10.710 -0.893 1.00 6.35 H new ATOM 0 HG3 PRO A 43 -11.333 -9.386 -1.912 1.00 6.35 H new ATOM 0 HD2 PRO A 43 -9.264 -8.966 -0.305 1.00 6.19 H new ATOM 0 HD3 PRO A 43 -10.494 -7.722 -0.393 1.00 6.19 H new ATOM 650 N GLY A 44 -13.625 -11.029 2.427 1.00 6.81 N ATOM 651 CA GLY A 44 -13.960 -12.233 3.162 1.00 7.59 C ATOM 652 C GLY A 44 -15.124 -12.027 4.108 1.00 7.56 C ATOM 653 O GLY A 44 -15.846 -11.036 4.004 1.00 7.08 O ATOM 0 H GLY A 44 -14.424 -10.457 2.153 1.00 6.81 H new ATOM 0 HA2 GLY A 44 -14.204 -13.029 2.458 1.00 7.59 H new ATOM 0 HA3 GLY A 44 -13.089 -12.564 3.728 1.00 7.59 H new ATOM 657 N LYS A 45 -15.316 -12.971 5.018 1.00 8.20 N ATOM 658 CA LYS A 45 -16.339 -12.866 6.040 1.00 8.37 C ATOM 659 C LYS A 45 -15.731 -12.253 7.289 1.00 8.15 C ATOM 660 O LYS A 45 -14.583 -12.538 7.640 1.00 8.27 O ATOM 661 CB LYS A 45 -16.903 -14.246 6.359 1.00 9.30 C ATOM 662 CG LYS A 45 -18.164 -14.218 7.203 1.00 9.65 C ATOM 663 CD LYS A 45 -18.155 -15.322 8.226 1.00 10.42 C ATOM 664 CE LYS A 45 -17.944 -16.692 7.594 1.00 11.07 C ATOM 665 NZ LYS A 45 -19.011 -17.036 6.617 1.00 11.68 N1+ ATOM 0 H LYS A 45 -14.766 -13.829 5.066 1.00 8.20 H new ATOM 0 HA LYS A 45 -17.150 -12.233 5.680 1.00 8.37 H new ATOM 0 HB2 LYS A 45 -17.115 -14.765 5.424 1.00 9.30 H new ATOM 0 HB3 LYS A 45 -16.142 -14.826 6.881 1.00 9.30 H new ATOM 0 HG2 LYS A 45 -18.249 -13.254 7.704 1.00 9.65 H new ATOM 0 HG3 LYS A 45 -19.038 -14.321 6.560 1.00 9.65 H new ATOM 0 HD2 LYS A 45 -17.365 -15.134 8.954 1.00 10.42 H new ATOM 0 HD3 LYS A 45 -19.099 -15.317 8.771 1.00 10.42 H new ATOM 0 HE2 LYS A 45 -16.976 -16.713 7.093 1.00 11.07 H new ATOM 0 HE3 LYS A 45 -17.914 -17.450 8.377 1.00 11.07 H new ATOM 0 HZ1 LYS A 45 -18.861 -18.003 6.265 1.00 11.68 H new ATOM 0 HZ2 LYS A 45 -19.939 -16.977 7.082 1.00 11.68 H new ATOM 0 HZ3 LYS A 45 -18.980 -16.369 5.820 1.00 11.68 H new ATOM 679 N SER A 46 -16.504 -11.407 7.941 1.00 8.03 N ATOM 680 CA SER A 46 -16.064 -10.706 9.129 1.00 7.98 C ATOM 681 C SER A 46 -15.706 -11.672 10.251 1.00 8.64 C ATOM 682 O SER A 46 -16.368 -12.691 10.448 1.00 9.20 O ATOM 683 CB SER A 46 -17.164 -9.755 9.597 1.00 8.03 C ATOM 684 OG SER A 46 -16.801 -9.092 10.795 1.00 8.36 O ATOM 0 H SER A 46 -17.459 -11.186 7.660 1.00 8.03 H new ATOM 0 HA SER A 46 -15.166 -10.142 8.876 1.00 7.98 H new ATOM 0 HB2 SER A 46 -17.365 -9.019 8.819 1.00 8.03 H new ATOM 0 HB3 SER A 46 -18.087 -10.313 9.754 1.00 8.03 H new ATOM 0 HG SER A 46 -17.419 -8.349 10.958 1.00 8.36 H new ATOM 690 N PRO A 47 -14.625 -11.377 10.982 1.00 8.70 N ATOM 691 CA PRO A 47 -14.266 -12.111 12.195 1.00 9.38 C ATOM 692 C PRO A 47 -15.179 -11.748 13.356 1.00 9.63 C ATOM 693 O PRO A 47 -15.308 -12.484 14.335 1.00 10.25 O ATOM 694 CB PRO A 47 -12.839 -11.647 12.475 1.00 9.45 C ATOM 695 CG PRO A 47 -12.760 -10.288 11.878 1.00 8.81 C ATOM 696 CD PRO A 47 -13.645 -10.321 10.664 1.00 8.26 C ATOM 0 HA PRO A 47 -14.358 -13.190 12.074 1.00 9.38 H new ATOM 0 HB2 PRO A 47 -12.634 -11.622 13.545 1.00 9.45 H new ATOM 0 HB3 PRO A 47 -12.108 -12.320 12.026 1.00 9.45 H new ATOM 0 HG2 PRO A 47 -13.096 -9.530 12.586 1.00 8.81 H new ATOM 0 HG3 PRO A 47 -11.734 -10.039 11.607 1.00 8.81 H new ATOM 0 HD2 PRO A 47 -14.131 -9.360 10.495 1.00 8.26 H new ATOM 0 HD3 PRO A 47 -13.080 -10.556 9.762 1.00 8.26 H new ATOM 704 N TYR A 48 -15.806 -10.586 13.221 1.00 9.26 N ATOM 705 CA TYR A 48 -16.665 -10.034 14.244 1.00 9.61 C ATOM 706 C TYR A 48 -18.079 -10.557 14.061 1.00 9.96 C ATOM 707 O TYR A 48 -18.765 -10.886 15.022 1.00 10.49 O ATOM 708 CB TYR A 48 -16.668 -8.516 14.128 1.00 9.34 C ATOM 709 CG TYR A 48 -15.304 -7.869 14.202 1.00 9.17 C ATOM 710 CD1 TYR A 48 -14.436 -8.142 15.250 1.00 9.63 C ATOM 711 CD2 TYR A 48 -14.888 -6.978 13.219 1.00 8.69 C ATOM 712 CE1 TYR A 48 -13.192 -7.547 15.320 1.00 9.70 C ATOM 713 CE2 TYR A 48 -13.644 -6.379 13.281 1.00 8.75 C ATOM 714 CZ TYR A 48 -12.801 -6.667 14.332 1.00 9.30 C ATOM 715 OH TYR A 48 -11.561 -6.073 14.399 1.00 9.57 O ATOM 0 H TYR A 48 -15.728 -10.001 12.389 1.00 9.26 H new ATOM 0 HA TYR A 48 -16.297 -10.328 15.227 1.00 9.61 H new ATOM 0 HB2 TYR A 48 -17.134 -8.239 13.182 1.00 9.34 H new ATOM 0 HB3 TYR A 48 -17.292 -8.107 14.923 1.00 9.34 H new ATOM 0 HD1 TYR A 48 -14.739 -8.832 16.024 1.00 9.63 H new ATOM 0 HD2 TYR A 48 -15.547 -6.750 12.394 1.00 8.69 H new ATOM 0 HE1 TYR A 48 -12.529 -7.769 16.143 1.00 9.70 H new ATOM 0 HE2 TYR A 48 -13.334 -5.689 12.510 1.00 8.75 H new ATOM 0 HH TYR A 48 -10.935 -6.672 14.857 1.00 9.57 H new ATOM 725 N MET A 49 -18.516 -10.585 12.810 1.00 9.74 N ATOM 726 CA MET A 49 -19.856 -11.024 12.468 1.00 10.23 C ATOM 727 C MET A 49 -19.856 -11.986 11.293 1.00 10.20 C ATOM 728 O MET A 49 -18.966 -11.939 10.454 1.00 9.87 O ATOM 729 CB MET A 49 -20.729 -9.831 12.132 1.00 10.28 C ATOM 730 CG MET A 49 -21.277 -9.142 13.351 1.00 10.38 C ATOM 731 SD MET A 49 -21.166 -7.349 13.260 1.00 10.09 S ATOM 732 CE MET A 49 -19.399 -7.176 13.127 1.00 9.55 C ATOM 0 H MET A 49 -17.952 -10.305 12.008 1.00 9.74 H new ATOM 0 HA MET A 49 -20.254 -11.546 13.338 1.00 10.23 H new ATOM 0 HB2 MET A 49 -20.149 -9.117 11.548 1.00 10.28 H new ATOM 0 HB3 MET A 49 -21.557 -10.159 11.504 1.00 10.28 H new ATOM 0 HG2 MET A 49 -22.320 -9.429 13.485 1.00 10.38 H new ATOM 0 HG3 MET A 49 -20.736 -9.489 14.231 1.00 10.38 H new ATOM 0 HE1 MET A 49 -19.162 -6.465 12.336 1.00 9.55 H new ATOM 0 HE2 MET A 49 -18.997 -6.814 14.073 1.00 9.55 H new ATOM 0 HE3 MET A 49 -18.955 -8.143 12.891 1.00 9.55 H new ATOM 742 N ASP A 50 -20.874 -12.820 11.201 1.00 10.69 N ATOM 743 CA ASP A 50 -20.997 -13.726 10.068 1.00 10.83 C ATOM 744 C ASP A 50 -21.620 -13.016 8.871 1.00 10.64 C ATOM 745 O ASP A 50 -22.695 -13.365 8.387 1.00 11.23 O ATOM 746 CB ASP A 50 -21.784 -14.986 10.441 1.00 11.76 C ATOM 747 CG ASP A 50 -23.173 -14.693 10.982 1.00 12.21 C ATOM 748 OD1 ASP A 50 -23.281 -14.075 12.065 1.00 12.33 O1- ATOM 749 OD2 ASP A 50 -24.166 -15.079 10.324 1.00 12.54 O ATOM 0 H ASP A 50 -21.624 -12.892 11.889 1.00 10.69 H new ATOM 0 HA ASP A 50 -19.994 -14.044 9.785 1.00 10.83 H new ATOM 0 HB2 ASP A 50 -21.872 -15.624 9.561 1.00 11.76 H new ATOM 0 HB3 ASP A 50 -21.223 -15.548 11.187 1.00 11.76 H new ATOM 754 N MET A 51 -20.926 -11.994 8.414 1.00 9.87 N ATOM 755 CA MET A 51 -21.291 -11.288 7.197 1.00 9.64 C ATOM 756 C MET A 51 -20.067 -11.125 6.325 1.00 8.84 C ATOM 757 O MET A 51 -18.961 -10.946 6.837 1.00 8.36 O ATOM 758 CB MET A 51 -21.877 -9.903 7.499 1.00 9.70 C ATOM 759 CG MET A 51 -21.535 -9.369 8.879 1.00 9.43 C ATOM 760 SD MET A 51 -20.912 -7.674 8.899 1.00 9.38 S ATOM 761 CE MET A 51 -21.913 -6.892 7.642 1.00 9.04 C ATOM 0 H MET A 51 -20.093 -11.627 8.874 1.00 9.87 H new ATOM 0 HA MET A 51 -22.052 -11.877 6.684 1.00 9.64 H new ATOM 0 HB2 MET A 51 -21.518 -9.198 6.750 1.00 9.70 H new ATOM 0 HB3 MET A 51 -22.961 -9.950 7.398 1.00 9.70 H new ATOM 0 HG2 MET A 51 -22.426 -9.422 9.505 1.00 9.43 H new ATOM 0 HG3 MET A 51 -20.788 -10.022 9.331 1.00 9.43 H new ATOM 0 HE1 MET A 51 -21.746 -5.815 7.662 1.00 9.04 H new ATOM 0 HE2 MET A 51 -21.639 -7.284 6.663 1.00 9.04 H new ATOM 0 HE3 MET A 51 -22.966 -7.100 7.834 1.00 9.04 H new ATOM 771 N PRO A 52 -20.227 -11.220 5.002 1.00 8.77 N ATOM 772 CA PRO A 52 -19.160 -10.859 4.089 1.00 8.04 C ATOM 773 C PRO A 52 -18.893 -9.370 4.197 1.00 7.35 C ATOM 774 O PRO A 52 -19.832 -8.568 4.209 1.00 7.56 O ATOM 775 CB PRO A 52 -19.706 -11.228 2.705 1.00 8.35 C ATOM 776 CG PRO A 52 -21.187 -11.269 2.873 1.00 9.16 C ATOM 777 CD PRO A 52 -21.438 -11.679 4.300 1.00 9.51 C ATOM 0 HA PRO A 52 -18.217 -11.365 4.297 1.00 8.04 H new ATOM 0 HB2 PRO A 52 -19.414 -10.492 1.956 1.00 8.35 H new ATOM 0 HB3 PRO A 52 -19.320 -12.191 2.372 1.00 8.35 H new ATOM 0 HG2 PRO A 52 -21.629 -10.295 2.665 1.00 9.16 H new ATOM 0 HG3 PRO A 52 -21.638 -11.979 2.179 1.00 9.16 H new ATOM 0 HD2 PRO A 52 -22.337 -11.211 4.701 1.00 9.51 H new ATOM 0 HD3 PRO A 52 -21.572 -12.757 4.391 1.00 9.51 H new ATOM 785 N LEU A 53 -17.630 -8.999 4.305 1.00 6.71 N ATOM 786 CA LEU A 53 -17.274 -7.607 4.504 1.00 6.20 C ATOM 787 C LEU A 53 -17.743 -6.759 3.330 1.00 5.97 C ATOM 788 O LEU A 53 -17.972 -7.275 2.234 1.00 6.05 O ATOM 789 CB LEU A 53 -15.769 -7.463 4.733 1.00 5.79 C ATOM 790 CG LEU A 53 -15.240 -8.271 5.914 1.00 6.23 C ATOM 791 CD1 LEU A 53 -13.725 -8.322 5.901 1.00 6.10 C ATOM 792 CD2 LEU A 53 -15.740 -7.669 7.212 1.00 6.57 C ATOM 0 H LEU A 53 -16.837 -9.639 4.258 1.00 6.71 H new ATOM 0 HA LEU A 53 -17.781 -7.244 5.398 1.00 6.20 H new ATOM 0 HB2 LEU A 53 -15.243 -7.773 3.830 1.00 5.79 H new ATOM 0 HB3 LEU A 53 -15.535 -6.410 4.893 1.00 5.79 H new ATOM 0 HG LEU A 53 -15.609 -9.293 5.830 1.00 6.23 H new ATOM 0 HD11 LEU A 53 -13.373 -8.904 6.753 1.00 6.10 H new ATOM 0 HD12 LEU A 53 -13.385 -8.789 4.977 1.00 6.10 H new ATOM 0 HD13 LEU A 53 -13.326 -7.309 5.964 1.00 6.10 H new ATOM 0 HD21 LEU A 53 -15.360 -8.249 8.053 1.00 6.57 H new ATOM 0 HD22 LEU A 53 -15.391 -6.640 7.294 1.00 6.57 H new ATOM 0 HD23 LEU A 53 -16.830 -7.684 7.224 1.00 6.57 H new ATOM 804 N ILE A 54 -17.884 -5.471 3.548 1.00 5.92 N ATOM 805 CA ILE A 54 -18.424 -4.602 2.529 1.00 5.98 C ATOM 806 C ILE A 54 -17.309 -3.856 1.839 1.00 5.33 C ATOM 807 O ILE A 54 -16.420 -3.296 2.484 1.00 5.16 O ATOM 808 CB ILE A 54 -19.436 -3.607 3.119 1.00 6.77 C ATOM 809 CG1 ILE A 54 -20.630 -4.370 3.700 1.00 7.56 C ATOM 810 CG2 ILE A 54 -19.901 -2.597 2.076 1.00 7.04 C ATOM 811 CD1 ILE A 54 -21.318 -5.280 2.706 1.00 7.89 C ATOM 0 H ILE A 54 -17.633 -5.004 4.419 1.00 5.92 H new ATOM 0 HA ILE A 54 -18.947 -5.223 1.802 1.00 5.98 H new ATOM 0 HB ILE A 54 -18.943 -3.049 3.915 1.00 6.77 H new ATOM 0 HG12 ILE A 54 -20.291 -4.965 4.548 1.00 7.56 H new ATOM 0 HG13 ILE A 54 -21.355 -3.653 4.084 1.00 7.56 H new ATOM 0 HG21 ILE A 54 -20.616 -1.910 2.529 1.00 7.04 H new ATOM 0 HG22 ILE A 54 -19.043 -2.036 1.705 1.00 7.04 H new ATOM 0 HG23 ILE A 54 -20.377 -3.122 1.248 1.00 7.04 H new ATOM 0 HD11 ILE A 54 -22.153 -5.785 3.192 1.00 7.89 H new ATOM 0 HD12 ILE A 54 -21.689 -4.689 1.868 1.00 7.89 H new ATOM 0 HD13 ILE A 54 -20.608 -6.022 2.340 1.00 7.89 H new ATOM 823 N PRO A 55 -17.319 -3.876 0.516 1.00 5.13 N ATOM 824 CA PRO A 55 -16.302 -3.220 -0.269 1.00 4.65 C ATOM 825 C PRO A 55 -16.512 -1.716 -0.384 1.00 5.10 C ATOM 826 O PRO A 55 -17.632 -1.224 -0.527 1.00 5.77 O ATOM 827 CB PRO A 55 -16.423 -3.905 -1.623 1.00 4.51 C ATOM 828 CG PRO A 55 -17.864 -4.258 -1.724 1.00 5.22 C ATOM 829 CD PRO A 55 -18.313 -4.569 -0.327 1.00 5.58 C ATOM 0 HA PRO A 55 -15.314 -3.309 0.182 1.00 4.65 H new ATOM 0 HB2 PRO A 55 -16.117 -3.243 -2.433 1.00 4.51 H new ATOM 0 HB3 PRO A 55 -15.791 -4.791 -1.679 1.00 4.51 H new ATOM 0 HG2 PRO A 55 -18.439 -3.433 -2.144 1.00 5.22 H new ATOM 0 HG3 PRO A 55 -18.010 -5.115 -2.381 1.00 5.22 H new ATOM 0 HD2 PRO A 55 -19.323 -4.204 -0.139 1.00 5.58 H new ATOM 0 HD3 PRO A 55 -18.322 -5.642 -0.138 1.00 5.58 H new ATOM 837 N VAL A 56 -15.401 -1.018 -0.296 1.00 5.00 N ATOM 838 CA VAL A 56 -15.335 0.432 -0.398 1.00 5.69 C ATOM 839 C VAL A 56 -15.820 0.958 -1.750 1.00 5.96 C ATOM 840 O VAL A 56 -15.886 0.229 -2.737 1.00 5.52 O ATOM 841 CB VAL A 56 -13.898 0.899 -0.172 1.00 5.77 C ATOM 842 CG1 VAL A 56 -13.406 0.507 1.213 1.00 5.82 C ATOM 843 CG2 VAL A 56 -13.023 0.312 -1.248 1.00 5.28 C ATOM 0 H VAL A 56 -14.490 -1.452 -0.147 1.00 5.00 H new ATOM 0 HA VAL A 56 -16.000 0.831 0.368 1.00 5.69 H new ATOM 0 HB VAL A 56 -13.857 1.987 -0.227 1.00 5.77 H new ATOM 0 HG11 VAL A 56 -12.381 0.852 1.346 1.00 5.82 H new ATOM 0 HG12 VAL A 56 -14.044 0.965 1.969 1.00 5.82 H new ATOM 0 HG13 VAL A 56 -13.440 -0.577 1.318 1.00 5.82 H new ATOM 0 HG21 VAL A 56 -11.994 0.638 -1.098 1.00 5.28 H new ATOM 0 HG22 VAL A 56 -13.070 -0.776 -1.202 1.00 5.28 H new ATOM 0 HG23 VAL A 56 -13.372 0.649 -2.224 1.00 5.28 H new ATOM 853 N TYR A 57 -16.125 2.246 -1.723 1.00 6.83 N ATOM 854 CA TYR A 57 -16.656 3.055 -2.832 1.00 7.44 C ATOM 855 C TYR A 57 -17.047 2.280 -4.090 1.00 7.10 C ATOM 856 O TYR A 57 -18.216 1.940 -4.270 1.00 7.48 O ATOM 857 CB TYR A 57 -15.635 4.143 -3.176 1.00 7.84 C ATOM 858 CG TYR A 57 -14.267 3.902 -2.566 1.00 7.40 C ATOM 859 CD1 TYR A 57 -13.302 3.168 -3.242 1.00 6.79 C ATOM 860 CD2 TYR A 57 -13.943 4.406 -1.317 1.00 7.77 C ATOM 861 CE1 TYR A 57 -12.057 2.942 -2.688 1.00 6.66 C ATOM 862 CE2 TYR A 57 -12.706 4.192 -0.758 1.00 7.62 C ATOM 863 CZ TYR A 57 -11.759 3.464 -1.446 1.00 7.11 C ATOM 864 OH TYR A 57 -10.522 3.242 -0.889 1.00 7.23 O ATOM 0 H TYR A 57 -16.004 2.799 -0.875 1.00 6.83 H new ATOM 0 HA TYR A 57 -17.595 3.476 -2.474 1.00 7.44 H new ATOM 0 HB2 TYR A 57 -15.535 4.207 -4.260 1.00 7.84 H new ATOM 0 HB3 TYR A 57 -16.013 5.106 -2.833 1.00 7.84 H new ATOM 0 HD1 TYR A 57 -13.529 2.766 -4.219 1.00 6.79 H new ATOM 0 HD2 TYR A 57 -14.678 4.979 -0.771 1.00 7.77 H new ATOM 0 HE1 TYR A 57 -11.321 2.360 -3.224 1.00 6.66 H new ATOM 0 HE2 TYR A 57 -12.476 4.593 0.218 1.00 7.62 H new ATOM 0 HH TYR A 57 -10.475 3.679 -0.013 1.00 7.23 H new ATOM 874 N GLU A 58 -16.057 2.018 -4.942 1.00 6.59 N ATOM 875 CA GLU A 58 -16.265 1.411 -6.256 1.00 6.41 C ATOM 876 C GLU A 58 -17.149 0.184 -6.165 1.00 6.15 C ATOM 877 O GLU A 58 -18.075 0.009 -6.960 1.00 6.62 O ATOM 878 CB GLU A 58 -14.902 1.042 -6.850 1.00 5.89 C ATOM 879 CG GLU A 58 -14.563 -0.440 -6.880 1.00 5.18 C ATOM 880 CD GLU A 58 -13.324 -0.728 -7.714 1.00 5.25 C ATOM 881 OE1 GLU A 58 -13.437 -0.824 -8.947 1.00 5.61 O1- ATOM 882 OE2 GLU A 58 -12.227 -0.857 -7.136 1.00 5.25 O ATOM 0 H GLU A 58 -15.079 2.223 -4.738 1.00 6.59 H new ATOM 0 HA GLU A 58 -16.772 2.129 -6.901 1.00 6.41 H new ATOM 0 HB2 GLU A 58 -14.858 1.425 -7.870 1.00 5.89 H new ATOM 0 HB3 GLU A 58 -14.129 1.559 -6.282 1.00 5.89 H new ATOM 0 HG2 GLU A 58 -14.405 -0.796 -5.862 1.00 5.18 H new ATOM 0 HG3 GLU A 58 -15.409 -0.997 -7.284 1.00 5.18 H new ATOM 889 N GLU A 59 -16.874 -0.629 -5.162 1.00 5.59 N ATOM 890 CA GLU A 59 -17.488 -1.934 -5.027 1.00 5.52 C ATOM 891 C GLU A 59 -17.422 -2.674 -6.363 1.00 5.43 C ATOM 892 O GLU A 59 -18.435 -2.962 -7.008 1.00 6.06 O ATOM 893 CB GLU A 59 -18.929 -1.834 -4.490 1.00 6.40 C ATOM 894 CG GLU A 59 -19.663 -3.164 -4.383 1.00 6.94 C ATOM 895 CD GLU A 59 -21.005 -3.037 -3.694 1.00 7.89 C ATOM 896 OE1 GLU A 59 -21.051 -3.134 -2.449 1.00 8.12 O ATOM 897 OE2 GLU A 59 -22.026 -2.843 -4.390 1.00 8.58 O1- ATOM 0 H GLU A 59 -16.216 -0.401 -4.416 1.00 5.59 H new ATOM 0 HA GLU A 59 -16.929 -2.509 -4.289 1.00 5.52 H new ATOM 0 HB2 GLU A 59 -18.903 -1.369 -3.505 1.00 6.40 H new ATOM 0 HB3 GLU A 59 -19.499 -1.171 -5.141 1.00 6.40 H new ATOM 0 HG2 GLU A 59 -19.810 -3.575 -5.382 1.00 6.94 H new ATOM 0 HG3 GLU A 59 -19.043 -3.873 -3.834 1.00 6.94 H new ATOM 904 N GLU A 60 -16.197 -2.944 -6.771 1.00 4.88 N ATOM 905 CA GLU A 60 -15.927 -3.752 -7.937 1.00 5.05 C ATOM 906 C GLU A 60 -14.716 -4.608 -7.686 1.00 5.18 C ATOM 907 O GLU A 60 -13.900 -4.881 -8.564 1.00 5.82 O ATOM 908 CB GLU A 60 -15.767 -2.929 -9.222 1.00 5.91 C ATOM 909 CG GLU A 60 -17.028 -2.207 -9.675 1.00 6.37 C ATOM 910 CD GLU A 60 -16.821 -1.432 -10.959 1.00 7.13 C ATOM 911 OE1 GLU A 60 -16.779 -2.060 -12.040 1.00 7.41 O1- ATOM 912 OE2 GLU A 60 -16.688 -0.190 -10.897 1.00 7.64 O ATOM 0 H GLU A 60 -15.359 -2.606 -6.298 1.00 4.88 H new ATOM 0 HA GLU A 60 -16.798 -4.387 -8.102 1.00 5.05 H new ATOM 0 HB2 GLU A 60 -14.978 -2.193 -9.070 1.00 5.91 H new ATOM 0 HB3 GLU A 60 -15.436 -3.591 -10.022 1.00 5.91 H new ATOM 0 HG2 GLU A 60 -17.828 -2.934 -9.818 1.00 6.37 H new ATOM 0 HG3 GLU A 60 -17.354 -1.524 -8.890 1.00 6.37 H new ATOM 919 N ASN A 61 -14.647 -5.000 -6.439 1.00 4.82 N ATOM 920 CA ASN A 61 -13.824 -6.114 -5.960 1.00 5.21 C ATOM 921 C ASN A 61 -12.345 -5.925 -6.204 1.00 4.96 C ATOM 922 O ASN A 61 -11.542 -6.857 -6.109 1.00 5.37 O ATOM 923 CB ASN A 61 -14.316 -7.316 -6.682 1.00 5.66 C ATOM 924 CG ASN A 61 -13.818 -8.639 -6.127 1.00 6.39 C ATOM 925 OD1 ASN A 61 -13.549 -8.770 -4.932 1.00 6.60 O ATOM 926 ND2 ASN A 61 -13.701 -9.633 -6.993 1.00 7.02 N ATOM 0 H ASN A 61 -15.175 -4.546 -5.694 1.00 4.82 H new ATOM 0 HA ASN A 61 -13.920 -6.199 -4.878 1.00 5.21 H new ATOM 0 HB2 ASN A 61 -15.406 -7.316 -6.660 1.00 5.66 H new ATOM 0 HB3 ASN A 61 -14.019 -7.242 -7.728 1.00 5.66 H new ATOM 0 HD21 ASN A 61 -13.378 -10.548 -6.679 1.00 7.02 H new ATOM 0 HD22 ASN A 61 -13.934 -9.484 -7.975 1.00 7.02 H new ATOM 933 N ALA A 62 -12.035 -4.704 -6.544 1.00 4.60 N ATOM 934 CA ALA A 62 -10.682 -4.227 -6.776 1.00 4.73 C ATOM 935 C ALA A 62 -10.087 -4.805 -8.035 1.00 4.93 C ATOM 936 O ALA A 62 -9.023 -4.379 -8.488 1.00 5.41 O ATOM 937 CB ALA A 62 -9.853 -4.553 -5.577 1.00 4.86 C ATOM 0 H ALA A 62 -12.740 -3.978 -6.674 1.00 4.60 H new ATOM 0 HA ALA A 62 -10.704 -3.147 -6.924 1.00 4.73 H new ATOM 0 HB1 ALA A 62 -8.833 -4.202 -5.733 1.00 4.86 H new ATOM 0 HB2 ALA A 62 -10.275 -4.063 -4.699 1.00 4.86 H new ATOM 0 HB3 ALA A 62 -9.846 -5.632 -5.422 1.00 4.86 H new ATOM 943 N ASP A 63 -10.814 -5.731 -8.612 1.00 4.87 N ATOM 944 CA ASP A 63 -10.346 -6.473 -9.748 1.00 5.36 C ATOM 945 C ASP A 63 -11.527 -7.142 -10.444 1.00 5.66 C ATOM 946 O ASP A 63 -12.676 -6.771 -10.216 1.00 6.14 O ATOM 947 CB ASP A 63 -9.337 -7.504 -9.258 1.00 5.84 C ATOM 948 CG ASP A 63 -8.491 -8.071 -10.376 1.00 6.49 C ATOM 949 OD1 ASP A 63 -7.485 -7.436 -10.737 1.00 6.76 O1- ATOM 950 OD2 ASP A 63 -8.834 -9.158 -10.900 1.00 7.01 O ATOM 0 H ASP A 63 -11.751 -5.989 -8.302 1.00 4.87 H new ATOM 0 HA ASP A 63 -9.864 -5.815 -10.471 1.00 5.36 H new ATOM 0 HB2 ASP A 63 -8.687 -7.045 -8.513 1.00 5.84 H new ATOM 0 HB3 ASP A 63 -9.867 -8.317 -8.761 1.00 5.84 H new ATOM 955 N GLY A 64 -11.244 -8.129 -11.270 1.00 5.66 N ATOM 956 CA GLY A 64 -12.264 -8.762 -12.066 1.00 6.25 C ATOM 957 C GLY A 64 -12.143 -10.258 -12.006 1.00 6.54 C ATOM 958 O GLY A 64 -12.603 -10.960 -12.907 1.00 7.20 O ATOM 0 H GLY A 64 -10.307 -8.509 -11.405 1.00 5.66 H new ATOM 0 HA2 GLY A 64 -13.249 -8.459 -11.710 1.00 6.25 H new ATOM 0 HA3 GLY A 64 -12.182 -8.428 -13.100 1.00 6.25 H new ATOM 962 N ALA A 65 -11.478 -10.733 -10.952 1.00 6.34 N ATOM 963 CA ALA A 65 -11.376 -12.158 -10.673 1.00 6.92 C ATOM 964 C ALA A 65 -10.633 -12.889 -11.786 1.00 7.26 C ATOM 965 O ALA A 65 -10.994 -14.006 -12.172 1.00 7.82 O ATOM 966 CB ALA A 65 -12.764 -12.732 -10.468 1.00 7.42 C ATOM 0 H ALA A 65 -10.999 -10.141 -10.274 1.00 6.34 H new ATOM 0 HA ALA A 65 -10.797 -12.298 -9.760 1.00 6.92 H new ATOM 0 HB1 ALA A 65 -12.689 -13.799 -10.259 1.00 7.42 H new ATOM 0 HB2 ALA A 65 -13.245 -12.231 -9.628 1.00 7.42 H new ATOM 0 HB3 ALA A 65 -13.358 -12.580 -11.369 1.00 7.42 H new ATOM 972 N ALA A 66 -9.591 -12.248 -12.296 1.00 7.17 N ATOM 973 CA ALA A 66 -8.785 -12.820 -13.364 1.00 7.77 C ATOM 974 C ALA A 66 -7.399 -12.197 -13.371 1.00 7.57 C ATOM 975 O ALA A 66 -6.393 -12.894 -13.483 1.00 8.11 O ATOM 976 CB ALA A 66 -9.463 -12.619 -14.709 1.00 8.65 C ATOM 0 H ALA A 66 -9.283 -11.327 -11.985 1.00 7.17 H new ATOM 0 HA ALA A 66 -8.684 -13.891 -13.186 1.00 7.77 H new ATOM 0 HB1 ALA A 66 -8.846 -13.053 -15.496 1.00 8.65 H new ATOM 0 HB2 ALA A 66 -10.438 -13.107 -14.702 1.00 8.65 H new ATOM 0 HB3 ALA A 66 -9.592 -11.553 -14.896 1.00 8.65 H new ATOM 982 N VAL A 67 -7.354 -10.879 -13.249 1.00 6.98 N ATOM 983 CA VAL A 67 -6.089 -10.167 -13.156 1.00 6.95 C ATOM 984 C VAL A 67 -5.476 -10.425 -11.789 1.00 6.91 C ATOM 985 O VAL A 67 -4.433 -11.068 -11.664 1.00 7.31 O ATOM 986 CB VAL A 67 -6.280 -8.641 -13.325 1.00 6.72 C ATOM 987 CG1 VAL A 67 -4.952 -7.953 -13.598 1.00 6.95 C ATOM 988 CG2 VAL A 67 -7.299 -8.327 -14.410 1.00 6.89 C ATOM 0 H VAL A 67 -8.179 -10.281 -13.212 1.00 6.98 H new ATOM 0 HA VAL A 67 -5.440 -10.527 -13.955 1.00 6.95 H new ATOM 0 HB VAL A 67 -6.672 -8.249 -12.386 1.00 6.72 H new ATOM 0 HG11 VAL A 67 -5.114 -6.881 -13.713 1.00 6.95 H new ATOM 0 HG12 VAL A 67 -4.272 -8.130 -12.764 1.00 6.95 H new ATOM 0 HG13 VAL A 67 -4.516 -8.354 -14.513 1.00 6.95 H new ATOM 0 HG21 VAL A 67 -7.410 -7.247 -14.503 1.00 6.89 H new ATOM 0 HG22 VAL A 67 -6.959 -8.740 -15.359 1.00 6.89 H new ATOM 0 HG23 VAL A 67 -8.260 -8.769 -14.146 1.00 6.89 H new ATOM 998 N ARG A 68 -6.178 -9.929 -10.781 1.00 6.66 N ATOM 999 CA ARG A 68 -5.822 -10.068 -9.380 1.00 6.87 C ATOM 1000 C ARG A 68 -4.519 -9.384 -9.008 1.00 7.21 C ATOM 1001 O ARG A 68 -3.489 -9.535 -9.670 1.00 7.68 O ATOM 1002 CB ARG A 68 -5.831 -11.512 -8.942 1.00 7.41 C ATOM 1003 CG ARG A 68 -7.029 -11.822 -8.074 1.00 7.79 C ATOM 1004 CD ARG A 68 -7.013 -13.248 -7.559 1.00 8.65 C ATOM 1005 NE ARG A 68 -8.132 -13.495 -6.652 1.00 8.94 N ATOM 1006 CZ ARG A 68 -8.021 -14.086 -5.463 1.00 9.70 C ATOM 1007 NH1 ARG A 68 -6.840 -14.510 -5.032 1.00 10.21 N1+ ATOM 1008 NH2 ARG A 68 -9.096 -14.250 -4.706 1.00 10.14 N ATOM 0 H ARG A 68 -7.039 -9.401 -10.922 1.00 6.66 H new ATOM 0 HA ARG A 68 -6.601 -9.541 -8.829 1.00 6.87 H new ATOM 0 HB2 ARG A 68 -5.839 -12.159 -9.819 1.00 7.41 H new ATOM 0 HB3 ARG A 68 -4.916 -11.732 -8.392 1.00 7.41 H new ATOM 0 HG2 ARG A 68 -7.051 -11.133 -7.229 1.00 7.79 H new ATOM 0 HG3 ARG A 68 -7.942 -11.655 -8.645 1.00 7.79 H new ATOM 0 HD2 ARG A 68 -7.062 -13.941 -8.399 1.00 8.65 H new ATOM 0 HD3 ARG A 68 -6.073 -13.440 -7.042 1.00 8.65 H new ATOM 0 HE ARG A 68 -9.060 -13.195 -6.949 1.00 8.94 H new ATOM 0 HH11 ARG A 68 -6.010 -14.384 -5.612 1.00 10.21 H new ATOM 0 HH12 ARG A 68 -6.762 -14.962 -4.121 1.00 10.21 H new ATOM 0 HH21 ARG A 68 -10.005 -13.924 -5.034 1.00 10.14 H new ATOM 0 HH22 ARG A 68 -9.014 -14.702 -3.795 1.00 10.14 H new ATOM 1022 N ILE A 69 -4.587 -8.632 -7.925 1.00 7.25 N ATOM 1023 CA ILE A 69 -3.450 -7.880 -7.427 1.00 7.89 C ATOM 1024 C ILE A 69 -2.366 -8.811 -6.908 1.00 8.72 C ATOM 1025 O ILE A 69 -2.647 -9.926 -6.460 1.00 8.86 O ATOM 1026 CB ILE A 69 -3.858 -6.934 -6.285 1.00 7.93 C ATOM 1027 CG1 ILE A 69 -5.183 -6.235 -6.606 1.00 7.29 C ATOM 1028 CG2 ILE A 69 -2.760 -5.919 -6.055 1.00 8.79 C ATOM 1029 CD1 ILE A 69 -5.683 -5.335 -5.496 1.00 7.43 C ATOM 0 H ILE A 69 -5.433 -8.525 -7.365 1.00 7.25 H new ATOM 0 HA ILE A 69 -3.070 -7.296 -8.266 1.00 7.89 H new ATOM 0 HB ILE A 69 -4.002 -7.517 -5.375 1.00 7.93 H new ATOM 0 HG12 ILE A 69 -5.061 -5.644 -7.513 1.00 7.29 H new ATOM 0 HG13 ILE A 69 -5.940 -6.990 -6.817 1.00 7.29 H new ATOM 0 HG21 ILE A 69 -3.048 -5.248 -5.246 1.00 8.79 H new ATOM 0 HG22 ILE A 69 -1.838 -6.435 -5.787 1.00 8.79 H new ATOM 0 HG23 ILE A 69 -2.602 -5.342 -6.966 1.00 8.79 H new ATOM 0 HD11 ILE A 69 -6.625 -4.876 -5.796 1.00 7.43 H new ATOM 0 HD12 ILE A 69 -5.839 -5.924 -4.592 1.00 7.43 H new ATOM 0 HD13 ILE A 69 -4.946 -4.556 -5.299 1.00 7.43 H new ATOM 1041 N ASP A 70 -1.132 -8.334 -6.947 1.00 9.49 N ATOM 1042 CA ASP A 70 0.007 -9.107 -6.492 1.00 10.50 C ATOM 1043 C ASP A 70 0.162 -9.006 -4.976 1.00 10.98 C ATOM 1044 O ASP A 70 1.250 -8.747 -4.457 1.00 11.84 O ATOM 1045 CB ASP A 70 1.269 -8.629 -7.211 1.00 11.29 C ATOM 1046 CG ASP A 70 2.449 -9.562 -7.020 1.00 12.36 C ATOM 1047 OD1 ASP A 70 2.351 -10.744 -7.420 1.00 12.66 O1- ATOM 1048 OD2 ASP A 70 3.464 -9.128 -6.435 1.00 13.02 O ATOM 0 H ASP A 70 -0.895 -7.404 -7.294 1.00 9.49 H new ATOM 0 HA ASP A 70 -0.156 -10.158 -6.732 1.00 10.50 H new ATOM 0 HB2 ASP A 70 1.059 -8.531 -8.276 1.00 11.29 H new ATOM 0 HB3 ASP A 70 1.535 -7.637 -6.846 1.00 11.29 H new ATOM 1053 N GLY A 71 -0.943 -9.207 -4.272 1.00 10.56 N ATOM 1054 CA GLY A 71 -0.945 -9.127 -2.824 1.00 11.12 C ATOM 1055 C GLY A 71 -0.552 -7.752 -2.325 1.00 11.32 C ATOM 1056 O GLY A 71 0.074 -7.610 -1.272 1.00 12.13 O ATOM 0 H GLY A 71 -1.850 -9.427 -4.684 1.00 10.56 H new ATOM 0 HA2 GLY A 71 -1.938 -9.377 -2.450 1.00 11.12 H new ATOM 0 HA3 GLY A 71 -0.256 -9.869 -2.420 1.00 11.12 H new ATOM 1060 N ARG A 72 -0.907 -6.741 -3.098 1.00 10.73 N ATOM 1061 CA ARG A 72 -0.669 -5.364 -2.714 1.00 11.04 C ATOM 1062 C ARG A 72 -1.978 -4.742 -2.265 1.00 10.55 C ATOM 1063 O ARG A 72 -3.006 -4.849 -2.938 1.00 9.83 O ATOM 1064 CB ARG A 72 -0.058 -4.577 -3.884 1.00 11.16 C ATOM 1065 CG ARG A 72 -0.969 -3.507 -4.471 1.00 10.42 C ATOM 1066 CD ARG A 72 -0.318 -2.815 -5.660 1.00 10.89 C ATOM 1067 NE ARG A 72 -1.303 -2.259 -6.592 1.00 11.31 N ATOM 1068 CZ ARG A 72 -1.045 -1.997 -7.876 1.00 11.83 C ATOM 1069 NH1 ARG A 72 0.177 -2.181 -8.366 1.00 12.00 N1+ ATOM 1070 NH2 ARG A 72 -2.007 -1.551 -8.672 1.00 12.38 N ATOM 0 H ARG A 72 -1.365 -6.851 -4.003 1.00 10.73 H new ATOM 0 HA ARG A 72 0.042 -5.332 -1.889 1.00 11.04 H new ATOM 0 HB2 ARG A 72 0.864 -4.105 -3.545 1.00 11.16 H new ATOM 0 HB3 ARG A 72 0.214 -5.278 -4.674 1.00 11.16 H new ATOM 0 HG2 ARG A 72 -1.911 -3.959 -4.782 1.00 10.42 H new ATOM 0 HG3 ARG A 72 -1.207 -2.770 -3.705 1.00 10.42 H new ATOM 0 HD2 ARG A 72 0.330 -2.015 -5.301 1.00 10.89 H new ATOM 0 HD3 ARG A 72 0.316 -3.527 -6.188 1.00 10.89 H new ATOM 0 HE ARG A 72 -2.239 -2.061 -6.240 1.00 11.31 H new ATOM 0 HH11 ARG A 72 0.923 -2.524 -7.761 1.00 12.00 H new ATOM 0 HH12 ARG A 72 0.369 -1.979 -9.347 1.00 12.00 H new ATOM 0 HH21 ARG A 72 -2.947 -1.407 -8.304 1.00 12.38 H new ATOM 0 HH22 ARG A 72 -1.807 -1.352 -9.652 1.00 12.38 H new ATOM 1084 N VAL A 73 -1.938 -4.136 -1.101 1.00 11.11 N ATOM 1085 CA VAL A 73 -3.113 -3.538 -0.508 1.00 10.97 C ATOM 1086 C VAL A 73 -2.969 -2.040 -0.579 1.00 10.92 C ATOM 1087 O VAL A 73 -3.366 -1.282 0.304 1.00 11.44 O ATOM 1088 CB VAL A 73 -3.311 -4.006 0.935 1.00 11.58 C ATOM 1089 CG1 VAL A 73 -4.708 -3.663 1.430 1.00 11.61 C ATOM 1090 CG2 VAL A 73 -3.041 -5.499 1.036 1.00 11.56 C ATOM 0 H VAL A 73 -1.092 -4.043 -0.539 1.00 11.11 H new ATOM 0 HA VAL A 73 -3.999 -3.850 -1.061 1.00 10.97 H new ATOM 0 HB VAL A 73 -2.601 -3.483 1.575 1.00 11.58 H new ATOM 0 HG11 VAL A 73 -4.824 -4.006 2.458 1.00 11.61 H new ATOM 0 HG12 VAL A 73 -4.854 -2.584 1.389 1.00 11.61 H new ATOM 0 HG13 VAL A 73 -5.449 -4.153 0.798 1.00 11.61 H new ATOM 0 HG21 VAL A 73 -3.184 -5.826 2.066 1.00 11.56 H new ATOM 0 HG22 VAL A 73 -3.730 -6.038 0.386 1.00 11.56 H new ATOM 0 HG23 VAL A 73 -2.016 -5.705 0.729 1.00 11.56 H new ATOM 1100 N THR A 74 -2.348 -1.654 -1.659 1.00 10.48 N ATOM 1101 CA THR A 74 -2.106 -0.286 -1.986 1.00 10.58 C ATOM 1102 C THR A 74 -2.471 -0.032 -3.446 1.00 10.71 C ATOM 1103 O THR A 74 -1.612 0.041 -4.330 1.00 10.65 O ATOM 1104 CB THR A 74 -0.642 0.101 -1.674 1.00 10.38 C ATOM 1105 OG1 THR A 74 -0.340 1.412 -2.170 1.00 10.63 O ATOM 1106 CG2 THR A 74 0.326 -0.921 -2.254 1.00 9.98 C ATOM 0 H THR A 74 -1.987 -2.307 -2.354 1.00 10.48 H new ATOM 0 HA THR A 74 -2.739 0.351 -1.368 1.00 10.58 H new ATOM 0 HB THR A 74 -0.525 0.109 -0.590 1.00 10.38 H new ATOM 0 HG1 THR A 74 0.591 1.635 -1.959 1.00 10.63 H new ATOM 0 HG21 THR A 74 1.349 -0.626 -2.021 1.00 9.98 H new ATOM 0 HG22 THR A 74 0.123 -1.901 -1.821 1.00 9.98 H new ATOM 0 HG23 THR A 74 0.200 -0.969 -3.336 1.00 9.98 H new ATOM 1114 N GLN A 75 -3.768 0.070 -3.692 1.00 11.10 N ATOM 1115 CA GLN A 75 -4.295 0.251 -5.032 1.00 11.47 C ATOM 1116 C GLN A 75 -4.175 1.706 -5.464 1.00 11.19 C ATOM 1117 O GLN A 75 -5.154 2.447 -5.508 1.00 11.49 O ATOM 1118 CB GLN A 75 -5.744 -0.220 -5.106 1.00 12.23 C ATOM 1119 CG GLN A 75 -6.252 -0.288 -6.528 1.00 12.99 C ATOM 1120 CD GLN A 75 -5.584 -1.386 -7.326 1.00 13.67 C ATOM 1121 OE1 GLN A 75 -4.533 -1.174 -7.925 1.00 13.95 O ATOM 1122 NE2 GLN A 75 -6.186 -2.564 -7.344 1.00 14.09 N ATOM 0 H GLN A 75 -4.484 0.029 -2.966 1.00 11.10 H new ATOM 0 HA GLN A 75 -3.705 -0.356 -5.719 1.00 11.47 H new ATOM 0 HB2 GLN A 75 -5.828 -1.204 -4.645 1.00 12.23 H new ATOM 0 HB3 GLN A 75 -6.374 0.457 -4.529 1.00 12.23 H new ATOM 0 HG2 GLN A 75 -7.329 -0.453 -6.519 1.00 12.99 H new ATOM 0 HG3 GLN A 75 -6.080 0.670 -7.019 1.00 12.99 H new ATOM 0 HE21 GLN A 75 -7.058 -2.699 -6.833 1.00 14.09 H new ATOM 0 HE22 GLN A 75 -5.778 -3.337 -7.869 1.00 14.09 H new ATOM 1131 N ASN A 76 -2.952 2.100 -5.766 1.00 10.79 N ATOM 1132 CA ASN A 76 -2.674 3.432 -6.278 1.00 10.66 C ATOM 1133 C ASN A 76 -1.673 3.339 -7.410 1.00 11.04 C ATOM 1134 O ASN A 76 -0.489 3.078 -7.211 1.00 11.22 O ATOM 1135 CB ASN A 76 -2.120 4.332 -5.176 1.00 10.19 C ATOM 1136 CG ASN A 76 -2.135 5.801 -5.558 1.00 9.94 C ATOM 1137 OD1 ASN A 76 -2.015 6.160 -6.729 1.00 10.12 O ATOM 1138 ND2 ASN A 76 -2.285 6.665 -4.566 1.00 9.78 N ATOM 0 H ASN A 76 -2.126 1.510 -5.665 1.00 10.79 H new ATOM 0 HA ASN A 76 -3.605 3.866 -6.643 1.00 10.66 H new ATOM 0 HB2 ASN A 76 -2.706 4.191 -4.268 1.00 10.19 H new ATOM 0 HB3 ASN A 76 -1.098 4.031 -4.946 1.00 10.19 H new ATOM 0 HD21 ASN A 76 -2.304 7.666 -4.760 1.00 9.78 H new ATOM 0 HD22 ASN A 76 -2.382 6.329 -3.608 1.00 9.78 H new ATOM 1145 N LEU A 77 -2.192 3.549 -8.605 1.00 11.36 N ATOM 1146 CA LEU A 77 -1.442 3.388 -9.841 1.00 11.92 C ATOM 1147 C LEU A 77 -0.469 4.539 -10.041 1.00 11.78 C ATOM 1148 O LEU A 77 0.321 4.548 -10.986 1.00 12.15 O ATOM 1149 CB LEU A 77 -2.416 3.313 -11.016 1.00 12.58 C ATOM 1150 CG LEU A 77 -3.046 1.939 -11.284 1.00 13.28 C ATOM 1151 CD1 LEU A 77 -1.972 0.886 -11.513 1.00 13.59 C ATOM 1152 CD2 LEU A 77 -3.968 1.523 -10.145 1.00 13.71 C ATOM 0 H LEU A 77 -3.159 3.840 -8.749 1.00 11.36 H new ATOM 0 HA LEU A 77 -0.864 2.466 -9.784 1.00 11.92 H new ATOM 0 HB2 LEU A 77 -3.218 4.030 -10.843 1.00 12.58 H new ATOM 0 HB3 LEU A 77 -1.892 3.632 -11.917 1.00 12.58 H new ATOM 0 HG LEU A 77 -3.646 2.021 -12.190 1.00 13.28 H new ATOM 0 HD11 LEU A 77 -2.443 -0.079 -11.701 1.00 13.59 H new ATOM 0 HD12 LEU A 77 -1.365 1.167 -12.373 1.00 13.59 H new ATOM 0 HD13 LEU A 77 -1.338 0.815 -10.629 1.00 13.59 H new ATOM 0 HD21 LEU A 77 -4.399 0.546 -10.364 1.00 13.71 H new ATOM 0 HD22 LEU A 77 -3.398 1.469 -9.217 1.00 13.71 H new ATOM 0 HD23 LEU A 77 -4.767 2.256 -10.038 1.00 13.71 H new ATOM 1164 N GLY A 78 -0.571 5.522 -9.156 1.00 11.41 N ATOM 1165 CA GLY A 78 0.276 6.689 -9.214 1.00 11.44 C ATOM 1166 C GLY A 78 1.294 6.703 -8.109 1.00 10.55 C ATOM 1167 O GLY A 78 2.243 7.486 -8.129 1.00 10.48 O ATOM 0 H GLY A 78 -1.240 5.526 -8.386 1.00 11.41 H new ATOM 0 HA2 GLY A 78 0.786 6.719 -10.177 1.00 11.44 H new ATOM 0 HA3 GLY A 78 -0.339 7.587 -9.151 1.00 11.44 H new ATOM 1171 N VAL A 79 1.095 5.832 -7.141 1.00 9.99 N ATOM 1172 CA VAL A 79 1.890 5.839 -5.937 1.00 9.16 C ATOM 1173 C VAL A 79 2.249 4.418 -5.522 1.00 8.69 C ATOM 1174 O VAL A 79 1.500 3.735 -4.824 1.00 8.93 O ATOM 1175 CB VAL A 79 1.136 6.569 -4.803 1.00 9.21 C ATOM 1176 CG1 VAL A 79 1.796 6.347 -3.446 1.00 8.66 C ATOM 1177 CG2 VAL A 79 1.052 8.056 -5.097 1.00 9.75 C ATOM 0 H VAL A 79 0.381 5.104 -7.169 1.00 9.99 H new ATOM 0 HA VAL A 79 2.817 6.376 -6.135 1.00 9.16 H new ATOM 0 HB VAL A 79 0.131 6.149 -4.759 1.00 9.21 H new ATOM 0 HG11 VAL A 79 1.234 6.877 -2.677 1.00 8.66 H new ATOM 0 HG12 VAL A 79 1.807 5.281 -3.217 1.00 8.66 H new ATOM 0 HG13 VAL A 79 2.819 6.723 -3.473 1.00 8.66 H new ATOM 0 HG21 VAL A 79 0.518 8.557 -4.289 1.00 9.75 H new ATOM 0 HG22 VAL A 79 2.058 8.468 -5.178 1.00 9.75 H new ATOM 0 HG23 VAL A 79 0.520 8.212 -6.035 1.00 9.75 H new ATOM 1187 N ARG A 80 3.393 3.970 -6.003 1.00 8.26 N ATOM 1188 CA ARG A 80 3.927 2.674 -5.630 1.00 8.04 C ATOM 1189 C ARG A 80 5.026 2.885 -4.603 1.00 7.16 C ATOM 1190 O ARG A 80 6.020 3.550 -4.880 1.00 6.61 O ATOM 1191 CB ARG A 80 4.481 1.960 -6.867 1.00 8.39 C ATOM 1192 CG ARG A 80 4.215 0.459 -6.891 1.00 8.96 C ATOM 1193 CD ARG A 80 5.017 -0.290 -5.837 1.00 9.63 C ATOM 1194 NE ARG A 80 6.446 -0.331 -6.147 1.00 10.25 N ATOM 1195 CZ ARG A 80 7.361 -0.920 -5.372 1.00 10.94 C ATOM 1196 NH1 ARG A 80 7.001 -1.497 -4.232 1.00 11.11 N1+ ATOM 1197 NH2 ARG A 80 8.634 -0.935 -5.739 1.00 11.64 N ATOM 0 H ARG A 80 3.975 4.490 -6.659 1.00 8.26 H new ATOM 0 HA ARG A 80 3.140 2.052 -5.204 1.00 8.04 H new ATOM 0 HB2 ARG A 80 4.044 2.410 -7.759 1.00 8.39 H new ATOM 0 HB3 ARG A 80 5.557 2.128 -6.919 1.00 8.39 H new ATOM 0 HG2 ARG A 80 3.152 0.279 -6.731 1.00 8.96 H new ATOM 0 HG3 ARG A 80 4.460 0.065 -7.877 1.00 8.96 H new ATOM 0 HD2 ARG A 80 4.872 0.187 -4.868 1.00 9.63 H new ATOM 0 HD3 ARG A 80 4.637 -1.308 -5.751 1.00 9.63 H new ATOM 0 HE ARG A 80 6.763 0.117 -7.007 1.00 10.25 H new ATOM 0 HH11 ARG A 80 6.022 -1.492 -3.945 1.00 11.11 H new ATOM 0 HH12 ARG A 80 7.703 -1.946 -3.643 1.00 11.11 H new ATOM 0 HH21 ARG A 80 8.917 -0.496 -6.615 1.00 11.64 H new ATOM 0 HH22 ARG A 80 9.331 -1.385 -5.145 1.00 11.64 H new ATOM 1211 N THR A 81 4.830 2.349 -3.415 1.00 7.24 N ATOM 1212 CA THR A 81 5.742 2.576 -2.314 1.00 6.59 C ATOM 1213 C THR A 81 6.532 1.318 -2.010 1.00 6.82 C ATOM 1214 O THR A 81 5.979 0.218 -2.014 1.00 7.73 O ATOM 1215 CB THR A 81 4.991 2.998 -1.035 1.00 6.98 C ATOM 1216 OG1 THR A 81 4.046 1.984 -0.668 1.00 8.00 O ATOM 1217 CG2 THR A 81 4.260 4.320 -1.215 1.00 7.05 C ATOM 0 H THR A 81 4.039 1.747 -3.187 1.00 7.24 H new ATOM 0 HA THR A 81 6.414 3.379 -2.617 1.00 6.59 H new ATOM 0 HB THR A 81 5.734 3.125 -0.248 1.00 6.98 H new ATOM 0 HG1 THR A 81 3.465 2.321 0.046 1.00 8.00 H new ATOM 0 HG21 THR A 81 3.745 4.580 -0.290 1.00 7.05 H new ATOM 0 HG22 THR A 81 4.978 5.102 -1.462 1.00 7.05 H new ATOM 0 HG23 THR A 81 3.533 4.227 -2.022 1.00 7.05 H new ATOM 1225 N ALA A 82 7.809 1.487 -1.733 1.00 6.18 N ATOM 1226 CA ALA A 82 8.657 0.380 -1.354 1.00 6.65 C ATOM 1227 C ALA A 82 8.964 0.481 0.128 1.00 6.65 C ATOM 1228 O ALA A 82 9.343 1.548 0.618 1.00 5.88 O ATOM 1229 CB ALA A 82 9.934 0.374 -2.183 1.00 6.36 C ATOM 0 H ALA A 82 8.284 2.389 -1.764 1.00 6.18 H new ATOM 0 HA ALA A 82 8.141 -0.561 -1.547 1.00 6.65 H new ATOM 0 HB1 ALA A 82 10.559 -0.467 -1.882 1.00 6.36 H new ATOM 0 HB2 ALA A 82 9.682 0.279 -3.239 1.00 6.36 H new ATOM 0 HB3 ALA A 82 10.477 1.305 -2.022 1.00 6.36 H new ATOM 1235 N GLU A 83 8.763 -0.609 0.840 1.00 7.70 N ATOM 1236 CA GLU A 83 8.938 -0.624 2.272 1.00 8.10 C ATOM 1237 C GLU A 83 10.413 -0.650 2.615 1.00 7.90 C ATOM 1238 O GLU A 83 11.188 -1.388 2.009 1.00 8.21 O ATOM 1239 CB GLU A 83 8.211 -1.822 2.895 1.00 9.47 C ATOM 1240 CG GLU A 83 8.251 -1.847 4.413 1.00 10.14 C ATOM 1241 CD GLU A 83 7.445 -2.987 4.995 1.00 11.52 C ATOM 1242 OE1 GLU A 83 8.005 -4.094 5.158 1.00 12.15 O ATOM 1243 OE2 GLU A 83 6.249 -2.786 5.295 1.00 12.06 O1- ATOM 0 H GLU A 83 8.475 -1.503 0.442 1.00 7.70 H new ATOM 0 HA GLU A 83 8.502 0.285 2.687 1.00 8.10 H new ATOM 0 HB2 GLU A 83 7.171 -1.812 2.569 1.00 9.47 H new ATOM 0 HB3 GLU A 83 8.656 -2.742 2.515 1.00 9.47 H new ATOM 0 HG2 GLU A 83 9.286 -1.932 4.745 1.00 10.14 H new ATOM 0 HG3 GLU A 83 7.869 -0.902 4.799 1.00 10.14 H new ATOM 1250 N VAL A 84 10.795 0.174 3.562 1.00 7.58 N ATOM 1251 CA VAL A 84 12.163 0.242 4.013 1.00 7.50 C ATOM 1252 C VAL A 84 12.595 -1.069 4.629 1.00 8.74 C ATOM 1253 O VAL A 84 11.907 -1.645 5.476 1.00 9.71 O ATOM 1254 CB VAL A 84 12.369 1.371 5.030 1.00 7.28 C ATOM 1255 CG1 VAL A 84 13.777 1.324 5.597 1.00 7.49 C ATOM 1256 CG2 VAL A 84 12.102 2.709 4.374 1.00 6.28 C ATOM 0 H VAL A 84 10.164 0.817 4.041 1.00 7.58 H new ATOM 0 HA VAL A 84 12.775 0.448 3.135 1.00 7.50 H new ATOM 0 HB VAL A 84 11.667 1.238 5.853 1.00 7.28 H new ATOM 0 HG11 VAL A 84 13.906 2.132 6.317 1.00 7.49 H new ATOM 0 HG12 VAL A 84 13.938 0.367 6.093 1.00 7.49 H new ATOM 0 HG13 VAL A 84 14.499 1.439 4.788 1.00 7.49 H new ATOM 0 HG21 VAL A 84 12.250 3.507 5.102 1.00 6.28 H new ATOM 0 HG22 VAL A 84 12.788 2.848 3.538 1.00 6.28 H new ATOM 0 HG23 VAL A 84 11.075 2.737 4.009 1.00 6.28 H new ATOM 1266 N LYS A 85 13.732 -1.535 4.167 1.00 8.82 N ATOM 1267 CA LYS A 85 14.351 -2.730 4.687 1.00 10.03 C ATOM 1268 C LYS A 85 15.804 -2.776 4.266 1.00 10.02 C ATOM 1269 O LYS A 85 16.187 -2.260 3.214 1.00 9.25 O ATOM 1270 CB LYS A 85 13.588 -3.992 4.265 1.00 10.75 C ATOM 1271 CG LYS A 85 12.924 -3.941 2.903 1.00 10.58 C ATOM 1272 CD LYS A 85 13.925 -3.889 1.769 1.00 11.03 C ATOM 1273 CE LYS A 85 13.857 -2.554 1.065 1.00 10.50 C ATOM 1274 NZ LYS A 85 14.807 -2.477 -0.073 1.00 11.02 N1+ ATOM 0 H LYS A 85 14.257 -1.091 3.413 1.00 8.82 H new ATOM 0 HA LYS A 85 14.311 -2.700 5.776 1.00 10.03 H new ATOM 0 HB2 LYS A 85 14.281 -4.833 4.278 1.00 10.75 H new ATOM 0 HB3 LYS A 85 12.823 -4.197 5.013 1.00 10.75 H new ATOM 0 HG2 LYS A 85 12.287 -4.817 2.780 1.00 10.58 H new ATOM 0 HG3 LYS A 85 12.276 -3.066 2.851 1.00 10.58 H new ATOM 0 HD2 LYS A 85 14.931 -4.052 2.156 1.00 11.03 H new ATOM 0 HD3 LYS A 85 13.722 -4.692 1.060 1.00 11.03 H new ATOM 0 HE2 LYS A 85 12.843 -2.386 0.703 1.00 10.50 H new ATOM 0 HE3 LYS A 85 14.077 -1.758 1.776 1.00 10.50 H new ATOM 0 HZ1 LYS A 85 15.048 -1.482 -0.257 1.00 11.02 H new ATOM 0 HZ2 LYS A 85 15.672 -3.006 0.160 1.00 11.02 H new ATOM 0 HZ3 LYS A 85 14.367 -2.889 -0.921 1.00 11.02 H new ATOM 1288 N LEU A 86 16.613 -3.336 5.146 1.00 10.96 N ATOM 1289 CA LEU A 86 18.051 -3.396 4.944 1.00 11.21 C ATOM 1290 C LEU A 86 18.408 -4.394 3.864 1.00 11.85 C ATOM 1291 O LEU A 86 17.628 -5.288 3.547 1.00 12.43 O ATOM 1292 CB LEU A 86 18.803 -3.750 6.230 1.00 12.08 C ATOM 1293 CG LEU A 86 18.748 -2.698 7.336 1.00 11.90 C ATOM 1294 CD1 LEU A 86 17.426 -2.765 8.085 1.00 11.97 C ATOM 1295 CD2 LEU A 86 19.917 -2.873 8.284 1.00 12.76 C ATOM 0 H LEU A 86 16.295 -3.761 6.017 1.00 10.96 H new ATOM 0 HA LEU A 86 18.359 -2.398 4.632 1.00 11.21 H new ATOM 0 HB2 LEU A 86 18.399 -4.684 6.621 1.00 12.08 H new ATOM 0 HB3 LEU A 86 19.848 -3.934 5.980 1.00 12.08 H new ATOM 0 HG LEU A 86 18.820 -1.712 6.878 1.00 11.90 H new ATOM 0 HD11 LEU A 86 17.412 -2.006 8.867 1.00 11.97 H new ATOM 0 HD12 LEU A 86 16.605 -2.586 7.391 1.00 11.97 H new ATOM 0 HD13 LEU A 86 17.312 -3.751 8.535 1.00 11.97 H new ATOM 0 HD21 LEU A 86 19.866 -2.117 9.068 1.00 12.76 H new ATOM 0 HD22 LEU A 86 19.876 -3.865 8.734 1.00 12.76 H new ATOM 0 HD23 LEU A 86 20.851 -2.763 7.734 1.00 12.76 H new ATOM 1307 N GLY A 87 19.613 -4.260 3.334 1.00 11.89 N ATOM 1308 CA GLY A 87 20.038 -5.122 2.256 1.00 12.65 C ATOM 1309 C GLY A 87 21.340 -4.689 1.642 1.00 12.97 C ATOM 1310 O GLY A 87 21.428 -4.472 0.438 1.00 13.25 O ATOM 0 H GLY A 87 20.303 -3.570 3.632 1.00 11.89 H new ATOM 0 HA2 GLY A 87 20.139 -6.141 2.630 1.00 12.65 H new ATOM 0 HA3 GLY A 87 19.267 -5.140 1.486 1.00 12.65 H new ATOM 1314 N ARG A 88 22.353 -4.556 2.469 1.00 13.08 N ATOM 1315 CA ARG A 88 23.658 -4.132 1.995 1.00 13.46 C ATOM 1316 C ARG A 88 24.530 -5.316 1.603 1.00 14.71 C ATOM 1317 O ARG A 88 24.109 -6.466 1.703 1.00 15.30 O ATOM 1318 CB ARG A 88 24.372 -3.285 3.051 1.00 13.18 C ATOM 1319 CG ARG A 88 24.067 -3.666 4.485 1.00 13.67 C ATOM 1320 CD ARG A 88 24.615 -5.025 4.851 1.00 14.20 C ATOM 1321 NE ARG A 88 23.752 -6.137 4.435 1.00 14.90 N ATOM 1322 CZ ARG A 88 23.174 -6.992 5.280 1.00 15.63 C ATOM 1323 NH1 ARG A 88 23.372 -6.879 6.589 1.00 15.77 N1+ ATOM 1324 NH2 ARG A 88 22.411 -7.971 4.809 1.00 16.35 N ATOM 0 H ARG A 88 22.302 -4.734 3.472 1.00 13.08 H new ATOM 0 HA ARG A 88 23.493 -3.526 1.104 1.00 13.46 H new ATOM 0 HB2 ARG A 88 25.447 -3.361 2.891 1.00 13.18 H new ATOM 0 HB3 ARG A 88 24.101 -2.240 2.902 1.00 13.18 H new ATOM 0 HG2 ARG A 88 24.488 -2.916 5.154 1.00 13.67 H new ATOM 0 HG3 ARG A 88 22.988 -3.660 4.638 1.00 13.67 H new ATOM 0 HD2 ARG A 88 25.597 -5.147 4.394 1.00 14.20 H new ATOM 0 HD3 ARG A 88 24.758 -5.071 5.931 1.00 14.20 H new ATOM 0 HE ARG A 88 23.584 -6.264 3.437 1.00 14.90 H new ATOM 0 HH11 ARG A 88 23.969 -6.136 6.952 1.00 15.77 H new ATOM 0 HH12 ARG A 88 22.927 -7.536 7.231 1.00 15.77 H new ATOM 0 HH21 ARG A 88 22.268 -8.068 3.804 1.00 16.35 H new ATOM 0 HH22 ARG A 88 21.968 -8.627 5.452 1.00 16.35 H new ATOM 1338 N LEU A 89 25.746 -5.015 1.183 1.00 15.20 N ATOM 1339 CA LEU A 89 26.770 -6.024 0.974 1.00 16.46 C ATOM 1340 C LEU A 89 28.086 -5.539 1.569 1.00 16.93 C ATOM 1341 O LEU A 89 28.711 -4.609 1.059 1.00 16.94 O ATOM 1342 CB LEU A 89 26.951 -6.364 -0.512 1.00 16.92 C ATOM 1343 CG LEU A 89 25.765 -7.063 -1.187 1.00 17.63 C ATOM 1344 CD1 LEU A 89 26.060 -7.300 -2.658 1.00 18.22 C ATOM 1345 CD2 LEU A 89 25.450 -8.380 -0.494 1.00 17.91 C ATOM 0 H LEU A 89 26.052 -4.064 0.977 1.00 15.20 H new ATOM 0 HA LEU A 89 26.450 -6.938 1.475 1.00 16.46 H new ATOM 0 HB2 LEU A 89 27.160 -5.441 -1.053 1.00 16.92 H new ATOM 0 HB3 LEU A 89 27.830 -7.000 -0.615 1.00 16.92 H new ATOM 0 HG LEU A 89 24.893 -6.414 -1.104 1.00 17.63 H new ATOM 0 HD11 LEU A 89 25.209 -7.797 -3.124 1.00 18.22 H new ATOM 0 HD12 LEU A 89 26.238 -6.345 -3.152 1.00 18.22 H new ATOM 0 HD13 LEU A 89 26.945 -7.929 -2.755 1.00 18.22 H new ATOM 0 HD21 LEU A 89 24.605 -8.859 -0.989 1.00 17.91 H new ATOM 0 HD22 LEU A 89 26.320 -9.035 -0.545 1.00 17.91 H new ATOM 0 HD23 LEU A 89 25.199 -8.191 0.550 1.00 17.91 H new ATOM 1357 N GLY A 90 28.475 -6.150 2.671 1.00 17.39 N ATOM 1358 CA GLY A 90 29.725 -5.809 3.327 1.00 17.91 C ATOM 1359 C GLY A 90 29.521 -5.550 4.801 1.00 17.35 C ATOM 1360 O GLY A 90 28.478 -5.912 5.351 1.00 17.38 O ATOM 0 H GLY A 90 27.943 -6.887 3.133 1.00 17.39 H new ATOM 0 HA2 GLY A 90 30.441 -6.620 3.194 1.00 17.91 H new ATOM 0 HA3 GLY A 90 30.155 -4.925 2.857 1.00 17.91 H new ATOM 1364 N SER A 91 30.493 -4.925 5.457 1.00 16.99 N ATOM 1365 CA SER A 91 30.325 -4.584 6.859 1.00 16.48 C ATOM 1366 C SER A 91 29.712 -3.194 6.989 1.00 15.54 C ATOM 1367 O SER A 91 30.387 -2.208 7.287 1.00 15.66 O ATOM 1368 CB SER A 91 31.669 -4.651 7.581 1.00 16.77 C ATOM 1369 OG SER A 91 32.672 -3.953 6.856 1.00 17.11 O ATOM 0 H SER A 91 31.386 -4.650 5.048 1.00 16.99 H new ATOM 0 HA SER A 91 29.650 -5.304 7.322 1.00 16.48 H new ATOM 0 HB2 SER A 91 31.572 -4.223 8.579 1.00 16.77 H new ATOM 0 HB3 SER A 91 31.966 -5.692 7.709 1.00 16.77 H new ATOM 0 HG SER A 91 32.377 -3.033 6.693 1.00 17.11 H new ATOM 1375 N THR A 92 28.425 -3.140 6.720 1.00 14.73 N ATOM 1376 CA THR A 92 27.608 -1.952 6.901 1.00 13.85 C ATOM 1377 C THR A 92 26.175 -2.415 7.082 1.00 13.26 C ATOM 1378 O THR A 92 25.894 -3.588 6.879 1.00 13.32 O ATOM 1379 CB THR A 92 27.694 -0.979 5.703 1.00 13.23 C ATOM 1380 OG1 THR A 92 29.020 -0.980 5.156 1.00 13.97 O ATOM 1381 CG2 THR A 92 27.337 0.438 6.129 1.00 12.68 C ATOM 0 H THR A 92 27.902 -3.939 6.361 1.00 14.73 H new ATOM 0 HA THR A 92 27.972 -1.403 7.769 1.00 13.85 H new ATOM 0 HB THR A 92 26.983 -1.316 4.948 1.00 13.23 H new ATOM 0 HG1 THR A 92 29.061 -0.361 4.397 1.00 13.97 H new ATOM 0 HG21 THR A 92 27.405 1.104 5.269 1.00 12.68 H new ATOM 0 HG22 THR A 92 26.320 0.455 6.522 1.00 12.68 H new ATOM 0 HG23 THR A 92 28.030 0.771 6.902 1.00 12.68 H new ATOM 1389 N GLU A 93 25.289 -1.543 7.513 1.00 12.87 N ATOM 1390 CA GLU A 93 23.864 -1.830 7.450 1.00 12.37 C ATOM 1391 C GLU A 93 23.093 -0.578 7.072 1.00 11.13 C ATOM 1392 O GLU A 93 23.081 0.400 7.816 1.00 10.78 O ATOM 1393 CB GLU A 93 23.366 -2.426 8.763 1.00 13.03 C ATOM 1394 CG GLU A 93 23.259 -3.942 8.732 1.00 13.80 C ATOM 1395 CD GLU A 93 23.123 -4.544 10.115 1.00 14.57 C ATOM 1396 OE1 GLU A 93 24.141 -4.651 10.828 1.00 14.94 O ATOM 1397 OE2 GLU A 93 21.993 -4.922 10.492 1.00 14.92 O1- ATOM 0 H GLU A 93 25.524 -0.633 7.909 1.00 12.87 H new ATOM 0 HA GLU A 93 23.692 -2.577 6.675 1.00 12.37 H new ATOM 0 HB2 GLU A 93 24.041 -2.133 9.567 1.00 13.03 H new ATOM 0 HB3 GLU A 93 22.389 -2.004 8.998 1.00 13.03 H new ATOM 0 HG2 GLU A 93 22.398 -4.230 8.128 1.00 13.80 H new ATOM 0 HG3 GLU A 93 24.142 -4.355 8.245 1.00 13.80 H new ATOM 1404 N ARG A 94 22.468 -0.599 5.898 1.00 10.57 N ATOM 1405 CA ARG A 94 21.752 0.567 5.406 1.00 9.39 C ATOM 1406 C ARG A 94 20.327 0.190 5.045 1.00 8.96 C ATOM 1407 O ARG A 94 20.024 -0.987 4.834 1.00 9.64 O ATOM 1408 CB ARG A 94 22.441 1.165 4.173 1.00 9.13 C ATOM 1409 CG ARG A 94 23.887 1.600 4.388 1.00 9.07 C ATOM 1410 CD ARG A 94 24.005 2.775 5.348 1.00 9.14 C ATOM 1411 NE ARG A 94 25.357 3.332 5.360 1.00 9.49 N ATOM 1412 CZ ARG A 94 25.875 4.027 6.375 1.00 9.84 C ATOM 1413 NH1 ARG A 94 25.177 4.205 7.491 1.00 9.96 N1+ ATOM 1414 NH2 ARG A 94 27.092 4.546 6.270 1.00 10.27 N ATOM 0 H ARG A 94 22.444 -1.407 5.275 1.00 10.57 H new ATOM 0 HA ARG A 94 21.749 1.313 6.201 1.00 9.39 H new ATOM 0 HB2 ARG A 94 22.415 0.430 3.369 1.00 9.13 H new ATOM 0 HB3 ARG A 94 21.865 2.027 3.836 1.00 9.13 H new ATOM 0 HG2 ARG A 94 24.462 0.759 4.775 1.00 9.07 H new ATOM 0 HG3 ARG A 94 24.328 1.873 3.429 1.00 9.07 H new ATOM 0 HD2 ARG A 94 23.295 3.551 5.062 1.00 9.14 H new ATOM 0 HD3 ARG A 94 23.736 2.451 6.354 1.00 9.14 H new ATOM 0 HE ARG A 94 25.943 3.179 4.539 1.00 9.49 H new ATOM 0 HH11 ARG A 94 24.240 3.810 7.575 1.00 9.96 H new ATOM 0 HH12 ARG A 94 25.578 4.737 8.264 1.00 9.96 H new ATOM 0 HH21 ARG A 94 27.631 4.414 5.414 1.00 10.27 H new ATOM 0 HH22 ARG A 94 27.489 5.077 7.045 1.00 10.27 H new ATOM 1428 N LEU A 95 19.465 1.184 4.981 1.00 7.97 N ATOM 1429 CA LEU A 95 18.091 0.994 4.557 1.00 7.54 C ATOM 1430 C LEU A 95 18.015 1.161 3.039 1.00 6.99 C ATOM 1431 O LEU A 95 18.271 2.235 2.509 1.00 6.27 O ATOM 1432 CB LEU A 95 17.202 2.035 5.248 1.00 6.93 C ATOM 1433 CG LEU A 95 17.118 1.971 6.783 1.00 7.79 C ATOM 1434 CD1 LEU A 95 16.831 0.557 7.257 1.00 8.88 C ATOM 1435 CD2 LEU A 95 18.382 2.515 7.434 1.00 7.89 C ATOM 0 H LEU A 95 19.697 2.148 5.222 1.00 7.97 H new ATOM 0 HA LEU A 95 17.746 -0.004 4.828 1.00 7.54 H new ATOM 0 HB2 LEU A 95 17.561 3.026 4.969 1.00 6.93 H new ATOM 0 HB3 LEU A 95 16.192 1.937 4.849 1.00 6.93 H new ATOM 0 HG LEU A 95 16.287 2.606 7.091 1.00 7.79 H new ATOM 0 HD11 LEU A 95 16.777 0.542 8.346 1.00 8.88 H new ATOM 0 HD12 LEU A 95 15.881 0.220 6.842 1.00 8.88 H new ATOM 0 HD13 LEU A 95 17.628 -0.107 6.924 1.00 8.88 H new ATOM 0 HD21 LEU A 95 18.288 2.455 8.518 1.00 7.89 H new ATOM 0 HD22 LEU A 95 19.240 1.926 7.111 1.00 7.89 H new ATOM 0 HD23 LEU A 95 18.524 3.555 7.140 1.00 7.89 H new ATOM 1447 N LEU A 96 17.685 0.080 2.345 1.00 7.59 N ATOM 1448 CA LEU A 96 17.717 0.071 0.884 1.00 7.52 C ATOM 1449 C LEU A 96 16.406 0.551 0.301 1.00 6.76 C ATOM 1450 O LEU A 96 15.333 0.109 0.705 1.00 6.96 O ATOM 1451 CB LEU A 96 18.039 -1.329 0.352 1.00 8.83 C ATOM 1452 CG LEU A 96 19.528 -1.678 0.254 1.00 9.65 C ATOM 1453 CD1 LEU A 96 20.226 -0.779 -0.755 1.00 9.37 C ATOM 1454 CD2 LEU A 96 20.194 -1.579 1.617 1.00 9.78 C ATOM 0 H LEU A 96 17.392 -0.801 2.767 1.00 7.59 H new ATOM 0 HA LEU A 96 18.505 0.757 0.574 1.00 7.52 H new ATOM 0 HB2 LEU A 96 17.555 -2.063 0.997 1.00 8.83 H new ATOM 0 HB3 LEU A 96 17.595 -1.432 -0.638 1.00 8.83 H new ATOM 0 HG LEU A 96 19.615 -2.708 -0.092 1.00 9.65 H new ATOM 0 HD11 LEU A 96 21.282 -1.044 -0.809 1.00 9.37 H new ATOM 0 HD12 LEU A 96 19.769 -0.909 -1.736 1.00 9.37 H new ATOM 0 HD13 LEU A 96 20.128 0.261 -0.444 1.00 9.37 H new ATOM 0 HD21 LEU A 96 21.251 -1.831 1.525 1.00 9.78 H new ATOM 0 HD22 LEU A 96 20.095 -0.562 1.997 1.00 9.78 H new ATOM 0 HD23 LEU A 96 19.715 -2.273 2.307 1.00 9.78 H new ATOM 1466 N VAL A 97 16.511 1.440 -0.668 1.00 6.13 N ATOM 1467 CA VAL A 97 15.354 2.040 -1.307 1.00 5.45 C ATOM 1468 C VAL A 97 15.660 2.291 -2.770 1.00 5.86 C ATOM 1469 O VAL A 97 16.800 2.564 -3.127 1.00 6.40 O ATOM 1470 CB VAL A 97 14.997 3.370 -0.623 1.00 4.23 C ATOM 1471 CG1 VAL A 97 16.197 4.289 -0.622 1.00 4.19 C ATOM 1472 CG2 VAL A 97 13.823 4.059 -1.267 1.00 4.01 C ATOM 0 H VAL A 97 17.404 1.768 -1.036 1.00 6.13 H new ATOM 0 HA VAL A 97 14.508 1.359 -1.218 1.00 5.45 H new ATOM 0 HB VAL A 97 14.707 3.134 0.401 1.00 4.23 H new ATOM 0 HG11 VAL A 97 15.935 5.229 -0.136 1.00 4.19 H new ATOM 0 HG12 VAL A 97 17.017 3.816 -0.081 1.00 4.19 H new ATOM 0 HG13 VAL A 97 16.506 4.486 -1.649 1.00 4.19 H new ATOM 0 HG21 VAL A 97 13.616 4.992 -0.743 1.00 4.01 H new ATOM 0 HG22 VAL A 97 14.054 4.273 -2.311 1.00 4.01 H new ATOM 0 HG23 VAL A 97 12.948 3.412 -1.214 1.00 4.01 H new ATOM 1482 N PRO A 98 14.658 2.178 -3.634 1.00 5.92 N ATOM 1483 CA PRO A 98 14.799 2.529 -5.042 1.00 6.55 C ATOM 1484 C PRO A 98 15.265 3.977 -5.189 1.00 6.22 C ATOM 1485 O PRO A 98 14.703 4.867 -4.555 1.00 5.29 O ATOM 1486 CB PRO A 98 13.383 2.319 -5.595 1.00 6.53 C ATOM 1487 CG PRO A 98 12.773 1.330 -4.664 1.00 6.39 C ATOM 1488 CD PRO A 98 13.310 1.700 -3.313 1.00 5.71 C ATOM 0 HA PRO A 98 15.543 1.935 -5.573 1.00 6.55 H new ATOM 0 HB2 PRO A 98 12.819 3.252 -5.611 1.00 6.53 H new ATOM 0 HB3 PRO A 98 13.406 1.942 -6.618 1.00 6.53 H new ATOM 0 HG2 PRO A 98 11.685 1.384 -4.686 1.00 6.39 H new ATOM 0 HG3 PRO A 98 13.047 0.310 -4.934 1.00 6.39 H new ATOM 0 HD2 PRO A 98 12.708 2.472 -2.833 1.00 5.71 H new ATOM 0 HD3 PRO A 98 13.332 0.846 -2.636 1.00 5.71 H new ATOM 1496 N SER A 99 16.293 4.211 -5.996 1.00 7.21 N ATOM 1497 CA SER A 99 16.929 5.527 -6.079 1.00 7.37 C ATOM 1498 C SER A 99 15.939 6.657 -6.412 1.00 7.21 C ATOM 1499 O SER A 99 16.176 7.816 -6.067 1.00 7.21 O ATOM 1500 CB SER A 99 18.055 5.490 -7.112 1.00 8.73 C ATOM 1501 OG SER A 99 17.629 4.838 -8.300 1.00 9.29 O ATOM 0 H SER A 99 16.708 3.506 -6.606 1.00 7.21 H new ATOM 0 HA SER A 99 17.332 5.750 -5.091 1.00 7.37 H new ATOM 0 HB2 SER A 99 18.375 6.506 -7.344 1.00 8.73 H new ATOM 0 HB3 SER A 99 18.919 4.971 -6.697 1.00 8.73 H new ATOM 0 HG SER A 99 17.792 3.875 -8.221 1.00 9.29 H new ATOM 1507 N GLU A 100 14.823 6.331 -7.051 1.00 7.31 N ATOM 1508 CA GLU A 100 13.844 7.352 -7.410 1.00 7.41 C ATOM 1509 C GLU A 100 12.799 7.553 -6.311 1.00 6.33 C ATOM 1510 O GLU A 100 11.837 8.294 -6.501 1.00 6.56 O ATOM 1511 CB GLU A 100 13.167 7.003 -8.735 1.00 8.22 C ATOM 1512 CG GLU A 100 14.140 6.922 -9.898 1.00 9.47 C ATOM 1513 CD GLU A 100 13.496 6.414 -11.167 1.00 10.34 C ATOM 1514 OE1 GLU A 100 12.682 7.151 -11.763 1.00 10.86 O ATOM 1515 OE2 GLU A 100 13.791 5.272 -11.573 1.00 10.65 O1- ATOM 0 H GLU A 100 14.574 5.382 -7.329 1.00 7.31 H new ATOM 0 HA GLU A 100 14.382 8.293 -7.525 1.00 7.41 H new ATOM 0 HB2 GLU A 100 12.652 6.048 -8.633 1.00 8.22 H new ATOM 0 HB3 GLU A 100 12.407 7.752 -8.956 1.00 8.22 H new ATOM 0 HG2 GLU A 100 14.563 7.910 -10.081 1.00 9.47 H new ATOM 0 HG3 GLU A 100 14.968 6.266 -9.628 1.00 9.47 H new ATOM 1522 N ALA A 101 12.980 6.916 -5.165 1.00 5.34 N ATOM 1523 CA ALA A 101 12.060 7.113 -4.048 1.00 4.45 C ATOM 1524 C ALA A 101 12.414 8.375 -3.279 1.00 4.45 C ATOM 1525 O ALA A 101 11.539 9.132 -2.855 1.00 4.62 O ATOM 1526 CB ALA A 101 12.076 5.913 -3.112 1.00 3.75 C ATOM 0 H ALA A 101 13.744 6.266 -4.981 1.00 5.34 H new ATOM 0 HA ALA A 101 11.056 7.220 -4.458 1.00 4.45 H new ATOM 0 HB1 ALA A 101 11.383 6.085 -2.289 1.00 3.75 H new ATOM 0 HB2 ALA A 101 11.775 5.020 -3.660 1.00 3.75 H new ATOM 0 HB3 ALA A 101 13.082 5.774 -2.716 1.00 3.75 H new ATOM 1532 N LEU A 102 13.703 8.605 -3.124 1.00 4.73 N ATOM 1533 CA LEU A 102 14.183 9.697 -2.305 1.00 5.07 C ATOM 1534 C LEU A 102 14.399 10.966 -3.124 1.00 6.33 C ATOM 1535 O LEU A 102 14.594 10.917 -4.341 1.00 6.97 O ATOM 1536 CB LEU A 102 15.467 9.274 -1.579 1.00 4.90 C ATOM 1537 CG LEU A 102 16.595 8.705 -2.455 1.00 5.36 C ATOM 1538 CD1 LEU A 102 17.305 9.803 -3.231 1.00 6.64 C ATOM 1539 CD2 LEU A 102 17.590 7.957 -1.590 1.00 4.98 C ATOM 0 H LEU A 102 14.438 8.047 -3.557 1.00 4.73 H new ATOM 0 HA LEU A 102 13.420 9.931 -1.562 1.00 5.07 H new ATOM 0 HB2 LEU A 102 15.856 10.139 -1.042 1.00 4.90 H new ATOM 0 HB3 LEU A 102 15.205 8.525 -0.831 1.00 4.90 H new ATOM 0 HG LEU A 102 16.149 8.020 -3.176 1.00 5.36 H new ATOM 0 HD11 LEU A 102 18.096 9.365 -3.839 1.00 6.64 H new ATOM 0 HD12 LEU A 102 16.590 10.312 -3.877 1.00 6.64 H new ATOM 0 HD13 LEU A 102 17.738 10.520 -2.533 1.00 6.64 H new ATOM 0 HD21 LEU A 102 18.387 7.556 -2.216 1.00 4.98 H new ATOM 0 HD22 LEU A 102 18.015 8.638 -0.853 1.00 4.98 H new ATOM 0 HD23 LEU A 102 17.084 7.138 -1.078 1.00 4.98 H new ATOM 1551 N ILE A 103 14.350 12.099 -2.440 1.00 6.87 N ATOM 1552 CA ILE A 103 14.568 13.394 -3.064 1.00 8.18 C ATOM 1553 C ILE A 103 15.747 14.091 -2.430 1.00 8.75 C ATOM 1554 O ILE A 103 15.620 14.651 -1.353 1.00 8.67 O ATOM 1555 CB ILE A 103 13.369 14.349 -2.885 1.00 8.80 C ATOM 1556 CG1 ILE A 103 12.037 13.704 -3.289 1.00 8.52 C ATOM 1557 CG2 ILE A 103 13.619 15.635 -3.655 1.00 10.20 C ATOM 1558 CD1 ILE A 103 12.039 13.079 -4.671 1.00 8.14 C ATOM 0 H ILE A 103 14.158 12.146 -1.439 1.00 6.87 H new ATOM 0 HA ILE A 103 14.728 13.186 -4.122 1.00 8.18 H new ATOM 0 HB ILE A 103 13.281 14.580 -1.823 1.00 8.80 H new ATOM 0 HG12 ILE A 103 11.781 12.938 -2.557 1.00 8.52 H new ATOM 0 HG13 ILE A 103 11.253 14.460 -3.246 1.00 8.52 H new ATOM 0 HG21 ILE A 103 12.770 16.307 -3.526 1.00 10.20 H new ATOM 0 HG22 ILE A 103 14.522 16.115 -3.278 1.00 10.20 H new ATOM 0 HG23 ILE A 103 13.744 15.407 -4.714 1.00 10.20 H new ATOM 0 HD11 ILE A 103 11.060 12.646 -4.876 1.00 8.14 H new ATOM 0 HD12 ILE A 103 12.261 13.843 -5.416 1.00 8.14 H new ATOM 0 HD13 ILE A 103 12.797 12.297 -4.716 1.00 8.14 H new ATOM 1570 N ARG A 104 16.881 14.111 -3.084 1.00 9.50 N ATOM 1571 CA ARG A 104 17.982 14.850 -2.529 1.00 10.25 C ATOM 1572 C ARG A 104 18.287 16.101 -3.322 1.00 11.48 C ATOM 1573 O ARG A 104 18.940 16.080 -4.362 1.00 12.12 O ATOM 1574 CB ARG A 104 19.209 13.982 -2.267 1.00 10.50 C ATOM 1575 CG ARG A 104 19.393 12.846 -3.236 1.00 9.82 C ATOM 1576 CD ARG A 104 19.855 13.355 -4.568 1.00 9.98 C ATOM 1577 NE ARG A 104 20.102 12.270 -5.518 1.00 10.43 N ATOM 1578 CZ ARG A 104 19.814 12.331 -6.817 1.00 10.83 C ATOM 1579 NH1 ARG A 104 19.272 13.428 -7.330 1.00 10.83 N1+ ATOM 1580 NH2 ARG A 104 20.068 11.292 -7.605 1.00 11.42 N ATOM 0 H ARG A 104 17.062 13.641 -3.971 1.00 9.50 H new ATOM 0 HA ARG A 104 17.662 15.191 -1.544 1.00 10.25 H new ATOM 0 HB2 ARG A 104 20.097 14.614 -2.296 1.00 10.50 H new ATOM 0 HB3 ARG A 104 19.140 13.574 -1.259 1.00 10.50 H new ATOM 0 HG2 ARG A 104 20.120 12.138 -2.840 1.00 9.82 H new ATOM 0 HG3 ARG A 104 18.454 12.306 -3.353 1.00 9.82 H new ATOM 0 HD2 ARG A 104 19.104 14.030 -4.978 1.00 9.98 H new ATOM 0 HD3 ARG A 104 20.768 13.936 -4.437 1.00 9.98 H new ATOM 0 HE ARG A 104 20.522 11.411 -5.162 1.00 10.43 H new ATOM 0 HH11 ARG A 104 19.075 14.228 -6.729 1.00 10.83 H new ATOM 0 HH12 ARG A 104 19.053 13.471 -8.325 1.00 10.83 H new ATOM 0 HH21 ARG A 104 20.484 10.446 -7.215 1.00 11.42 H new ATOM 0 HH22 ARG A 104 19.847 11.340 -8.600 1.00 11.42 H new ATOM 1594 N THR A 105 17.767 17.193 -2.813 1.00 11.91 N ATOM 1595 CA THR A 105 17.991 18.494 -3.386 1.00 13.15 C ATOM 1596 C THR A 105 18.932 19.286 -2.489 1.00 13.72 C ATOM 1597 O THR A 105 18.892 19.160 -1.259 1.00 13.20 O ATOM 1598 CB THR A 105 16.661 19.259 -3.581 1.00 13.31 C ATOM 1599 OG1 THR A 105 16.912 20.581 -4.074 1.00 14.61 O ATOM 1600 CG2 THR A 105 15.871 19.337 -2.281 1.00 12.61 C ATOM 0 H THR A 105 17.173 17.201 -1.984 1.00 11.91 H new ATOM 0 HA THR A 105 18.445 18.367 -4.369 1.00 13.15 H new ATOM 0 HB THR A 105 16.068 18.709 -4.311 1.00 13.31 H new ATOM 0 HG1 THR A 105 16.061 21.052 -4.194 1.00 14.61 H new ATOM 0 HG21 THR A 105 14.942 19.881 -2.452 1.00 12.61 H new ATOM 0 HG22 THR A 105 15.643 18.330 -1.933 1.00 12.61 H new ATOM 0 HG23 THR A 105 16.462 19.857 -1.527 1.00 12.61 H new ATOM 1608 N GLY A 106 19.802 20.067 -3.098 1.00 14.84 N ATOM 1609 CA GLY A 106 20.724 20.873 -2.336 1.00 15.52 C ATOM 1610 C GLY A 106 21.753 20.034 -1.610 1.00 14.91 C ATOM 1611 O GLY A 106 22.666 19.484 -2.231 1.00 14.86 O ATOM 0 H GLY A 106 19.887 20.158 -4.110 1.00 14.84 H new ATOM 0 HA2 GLY A 106 21.231 21.570 -3.003 1.00 15.52 H new ATOM 0 HA3 GLY A 106 20.169 21.471 -1.613 1.00 15.52 H new ATOM 1615 N ALA A 107 21.611 19.931 -0.295 1.00 14.57 N ATOM 1616 CA ALA A 107 22.594 19.231 0.514 1.00 14.09 C ATOM 1617 C ALA A 107 22.000 18.075 1.304 1.00 12.88 C ATOM 1618 O ALA A 107 22.621 17.593 2.256 1.00 12.64 O ATOM 1619 CB ALA A 107 23.282 20.207 1.454 1.00 14.99 C ATOM 0 H ALA A 107 20.828 20.322 0.230 1.00 14.57 H new ATOM 0 HA ALA A 107 23.321 18.800 -0.174 1.00 14.09 H new ATOM 0 HB1 ALA A 107 24.017 19.674 2.057 1.00 14.99 H new ATOM 0 HB2 ALA A 107 23.782 20.981 0.872 1.00 14.99 H new ATOM 0 HB3 ALA A 107 22.541 20.666 2.108 1.00 14.99 H new ATOM 1625 N ARG A 108 20.817 17.614 0.924 1.00 12.19 N ATOM 1626 CA ARG A 108 20.139 16.594 1.715 1.00 11.09 C ATOM 1627 C ARG A 108 19.080 15.844 0.936 1.00 10.26 C ATOM 1628 O ARG A 108 18.662 16.275 -0.134 1.00 10.63 O ATOM 1629 CB ARG A 108 19.518 17.238 2.938 1.00 11.48 C ATOM 1630 CG ARG A 108 18.815 18.528 2.593 1.00 12.49 C ATOM 1631 CD ARG A 108 18.410 19.269 3.841 1.00 12.62 C ATOM 1632 NE ARG A 108 17.870 20.593 3.532 1.00 13.67 N ATOM 1633 CZ ARG A 108 17.013 21.258 4.307 1.00 14.22 C ATOM 1634 NH1 ARG A 108 16.592 20.736 5.453 1.00 13.92 N1+ ATOM 1635 NH2 ARG A 108 16.573 22.452 3.927 1.00 15.20 N ATOM 0 H ARG A 108 20.314 17.921 0.091 1.00 12.19 H new ATOM 0 HA ARG A 108 20.891 15.860 2.007 1.00 11.09 H new ATOM 0 HB2 ARG A 108 18.808 16.547 3.392 1.00 11.48 H new ATOM 0 HB3 ARG A 108 20.293 17.433 3.680 1.00 11.48 H new ATOM 0 HG2 ARG A 108 19.472 19.155 1.990 1.00 12.49 H new ATOM 0 HG3 ARG A 108 17.933 18.316 1.989 1.00 12.49 H new ATOM 0 HD2 ARG A 108 17.663 18.689 4.383 1.00 12.62 H new ATOM 0 HD3 ARG A 108 19.273 19.372 4.499 1.00 12.62 H new ATOM 0 HE ARG A 108 18.170 21.038 2.664 1.00 13.67 H new ATOM 0 HH11 ARG A 108 16.924 19.818 5.748 1.00 13.92 H new ATOM 0 HH12 ARG A 108 15.936 21.253 6.039 1.00 13.92 H new ATOM 0 HH21 ARG A 108 16.891 22.856 3.046 1.00 15.20 H new ATOM 0 HH22 ARG A 108 15.917 22.965 4.516 1.00 15.20 H new ATOM 1649 N THR A 109 18.633 14.736 1.512 1.00 9.26 N ATOM 1650 CA THR A 109 17.663 13.867 0.877 1.00 8.38 C ATOM 1651 C THR A 109 16.346 13.871 1.650 1.00 8.15 C ATOM 1652 O THR A 109 16.318 14.166 2.843 1.00 8.42 O ATOM 1653 CB THR A 109 18.211 12.431 0.783 1.00 7.38 C ATOM 1654 OG1 THR A 109 19.615 12.465 0.493 1.00 7.95 O ATOM 1655 CG2 THR A 109 17.492 11.662 -0.305 1.00 6.64 C ATOM 0 H THR A 109 18.935 14.418 2.433 1.00 9.26 H new ATOM 0 HA THR A 109 17.477 14.243 -0.129 1.00 8.38 H new ATOM 0 HB THR A 109 18.046 11.933 1.738 1.00 7.38 H new ATOM 0 HG1 THR A 109 20.094 11.890 1.126 1.00 7.95 H new ATOM 0 HG21 THR A 109 17.891 10.649 -0.359 1.00 6.64 H new ATOM 0 HG22 THR A 109 16.427 11.621 -0.078 1.00 6.64 H new ATOM 0 HG23 THR A 109 17.640 12.162 -1.262 1.00 6.64 H new ATOM 1663 N ILE A 110 15.262 13.577 0.950 1.00 7.89 N ATOM 1664 CA ILE A 110 13.931 13.561 1.533 1.00 7.87 C ATOM 1665 C ILE A 110 13.186 12.295 1.094 1.00 6.75 C ATOM 1666 O ILE A 110 13.441 11.768 0.015 1.00 6.24 O ATOM 1667 CB ILE A 110 13.109 14.800 1.093 1.00 9.02 C ATOM 1668 CG1 ILE A 110 13.858 16.114 1.349 1.00 10.20 C ATOM 1669 CG2 ILE A 110 11.773 14.821 1.799 1.00 9.31 C ATOM 1670 CD1 ILE A 110 14.116 16.415 2.810 1.00 10.55 C ATOM 0 H ILE A 110 15.281 13.342 -0.042 1.00 7.89 H new ATOM 0 HA ILE A 110 14.043 13.579 2.617 1.00 7.87 H new ATOM 0 HB ILE A 110 12.952 14.716 0.018 1.00 9.02 H new ATOM 0 HG12 ILE A 110 14.813 16.082 0.824 1.00 10.20 H new ATOM 0 HG13 ILE A 110 13.284 16.934 0.918 1.00 10.20 H new ATOM 0 HG21 ILE A 110 11.207 15.696 1.480 1.00 9.31 H new ATOM 0 HG22 ILE A 110 11.216 13.918 1.550 1.00 9.31 H new ATOM 0 HG23 ILE A 110 11.932 14.864 2.877 1.00 9.31 H new ATOM 0 HD11 ILE A 110 14.650 17.361 2.898 1.00 10.55 H new ATOM 0 HD12 ILE A 110 13.166 16.483 3.341 1.00 10.55 H new ATOM 0 HD13 ILE A 110 14.718 15.617 3.245 1.00 10.55 H new ATOM 1682 N ALA A 111 12.290 11.806 1.935 1.00 6.58 N ATOM 1683 CA ALA A 111 11.465 10.643 1.614 1.00 5.74 C ATOM 1684 C ALA A 111 10.021 10.897 2.008 1.00 6.51 C ATOM 1685 O ALA A 111 9.754 11.343 3.123 1.00 7.39 O ATOM 1686 CB ALA A 111 11.984 9.405 2.327 1.00 5.00 C ATOM 0 H ALA A 111 12.111 12.200 2.859 1.00 6.58 H new ATOM 0 HA ALA A 111 11.516 10.474 0.538 1.00 5.74 H new ATOM 0 HB1 ALA A 111 11.356 8.550 2.075 1.00 5.00 H new ATOM 0 HB2 ALA A 111 13.009 9.208 2.014 1.00 5.00 H new ATOM 0 HB3 ALA A 111 11.959 9.568 3.404 1.00 5.00 H new ATOM 1692 N MET A 112 9.091 10.648 1.098 1.00 6.37 N ATOM 1693 CA MET A 112 7.681 10.750 1.438 1.00 7.19 C ATOM 1694 C MET A 112 7.235 9.440 2.073 1.00 6.90 C ATOM 1695 O MET A 112 6.973 8.454 1.378 1.00 6.29 O ATOM 1696 CB MET A 112 6.827 11.048 0.208 1.00 7.48 C ATOM 1697 CG MET A 112 5.426 11.528 0.564 1.00 8.19 C ATOM 1698 SD MET A 112 4.310 11.570 -0.851 1.00 8.85 S ATOM 1699 CE MET A 112 3.964 9.826 -1.058 1.00 8.24 C ATOM 0 H MET A 112 9.283 10.378 0.133 1.00 6.37 H new ATOM 0 HA MET A 112 7.549 11.576 2.137 1.00 7.19 H new ATOM 0 HB2 MET A 112 7.323 11.806 -0.398 1.00 7.48 H new ATOM 0 HB3 MET A 112 6.753 10.149 -0.404 1.00 7.48 H new ATOM 0 HG2 MET A 112 5.008 10.874 1.329 1.00 8.19 H new ATOM 0 HG3 MET A 112 5.490 12.526 0.998 1.00 8.19 H new ATOM 0 HE1 MET A 112 4.030 9.565 -2.114 1.00 8.24 H new ATOM 0 HE2 MET A 112 4.690 9.241 -0.493 1.00 8.24 H new ATOM 0 HE3 MET A 112 2.960 9.608 -0.693 1.00 8.24 H new ATOM 1709 N VAL A 113 7.158 9.442 3.392 1.00 7.60 N ATOM 1710 CA VAL A 113 6.901 8.239 4.151 1.00 7.75 C ATOM 1711 C VAL A 113 5.408 7.986 4.319 1.00 8.59 C ATOM 1712 O VAL A 113 4.637 8.898 4.622 1.00 9.48 O ATOM 1713 CB VAL A 113 7.575 8.317 5.540 1.00 8.42 C ATOM 1714 CG1 VAL A 113 7.003 9.456 6.375 1.00 9.69 C ATOM 1715 CG2 VAL A 113 7.449 6.994 6.275 1.00 8.72 C ATOM 0 H VAL A 113 7.272 10.279 3.963 1.00 7.60 H new ATOM 0 HA VAL A 113 7.326 7.407 3.589 1.00 7.75 H new ATOM 0 HB VAL A 113 8.634 8.523 5.382 1.00 8.42 H new ATOM 0 HG11 VAL A 113 7.500 9.481 7.345 1.00 9.69 H new ATOM 0 HG12 VAL A 113 7.166 10.402 5.859 1.00 9.69 H new ATOM 0 HG13 VAL A 113 5.934 9.300 6.519 1.00 9.69 H new ATOM 0 HG21 VAL A 113 7.930 7.072 7.250 1.00 8.72 H new ATOM 0 HG22 VAL A 113 6.395 6.751 6.409 1.00 8.72 H new ATOM 0 HG23 VAL A 113 7.931 6.208 5.694 1.00 8.72 H new ATOM 1725 N ALA A 114 5.009 6.745 4.098 1.00 8.43 N ATOM 1726 CA ALA A 114 3.647 6.327 4.368 1.00 9.31 C ATOM 1727 C ALA A 114 3.506 5.962 5.839 1.00 10.44 C ATOM 1728 O ALA A 114 3.818 4.840 6.243 1.00 10.70 O ATOM 1729 CB ALA A 114 3.251 5.153 3.482 1.00 8.96 C ATOM 0 H ALA A 114 5.612 6.009 3.731 1.00 8.43 H new ATOM 0 HA ALA A 114 2.975 7.154 4.141 1.00 9.31 H new ATOM 0 HB1 ALA A 114 2.225 4.859 3.704 1.00 8.96 H new ATOM 0 HB2 ALA A 114 3.325 5.446 2.435 1.00 8.96 H new ATOM 0 HB3 ALA A 114 3.919 4.313 3.672 1.00 8.96 H new ATOM 1735 N LYS A 115 3.069 6.921 6.640 1.00 11.26 N ATOM 1736 CA LYS A 115 2.906 6.699 8.069 1.00 12.43 C ATOM 1737 C LYS A 115 1.667 5.868 8.346 1.00 13.26 C ATOM 1738 O LYS A 115 0.671 5.955 7.625 1.00 13.19 O ATOM 1739 CB LYS A 115 2.798 8.029 8.822 1.00 13.13 C ATOM 1740 CG LYS A 115 4.126 8.733 9.049 1.00 13.19 C ATOM 1741 CD LYS A 115 3.952 9.922 9.982 1.00 14.08 C ATOM 1742 CE LYS A 115 5.286 10.519 10.407 1.00 14.36 C ATOM 1743 NZ LYS A 115 5.999 11.168 9.277 1.00 14.88 N1+ ATOM 0 H LYS A 115 2.821 7.859 6.326 1.00 11.26 H new ATOM 0 HA LYS A 115 3.787 6.161 8.419 1.00 12.43 H new ATOM 0 HB2 LYS A 115 2.138 8.695 8.266 1.00 13.13 H new ATOM 0 HB3 LYS A 115 2.327 7.848 9.788 1.00 13.13 H new ATOM 0 HG2 LYS A 115 4.846 8.034 9.474 1.00 13.19 H new ATOM 0 HG3 LYS A 115 4.533 9.069 8.095 1.00 13.19 H new ATOM 0 HD2 LYS A 115 3.355 10.687 9.485 1.00 14.08 H new ATOM 0 HD3 LYS A 115 3.397 9.609 10.867 1.00 14.08 H new ATOM 0 HE2 LYS A 115 5.119 11.251 11.197 1.00 14.36 H new ATOM 0 HE3 LYS A 115 5.915 9.735 10.828 1.00 14.36 H new ATOM 0 HZ1 LYS A 115 7.025 11.103 9.431 1.00 14.88 H new ATOM 0 HZ2 LYS A 115 5.751 10.688 8.388 1.00 14.88 H new ATOM 0 HZ3 LYS A 115 5.720 12.168 9.219 1.00 14.88 H new ATOM 1757 N GLY A 116 1.731 5.081 9.414 1.00 14.15 N ATOM 1758 CA GLY A 116 0.597 4.275 9.822 1.00 15.10 C ATOM 1759 C GLY A 116 -0.531 5.121 10.372 1.00 16.02 C ATOM 1760 O GLY A 116 -1.580 4.605 10.754 1.00 16.92 O ATOM 0 H GLY A 116 2.555 4.987 10.008 1.00 14.15 H new ATOM 0 HA2 GLY A 116 0.236 3.699 8.970 1.00 15.10 H new ATOM 0 HA3 GLY A 116 0.915 3.558 10.579 1.00 15.10 H new ATOM 1764 N GLU A 117 -0.311 6.432 10.410 1.00 15.88 N ATOM 1765 CA GLU A 117 -1.328 7.373 10.846 1.00 16.82 C ATOM 1766 C GLU A 117 -2.213 7.788 9.674 1.00 16.56 C ATOM 1767 O GLU A 117 -3.029 8.709 9.777 1.00 17.25 O ATOM 1768 CB GLU A 117 -0.691 8.605 11.488 1.00 17.04 C ATOM 1769 CG GLU A 117 0.191 8.266 12.673 1.00 17.42 C ATOM 1770 CD GLU A 117 0.463 9.462 13.562 1.00 17.95 C ATOM 1771 OE1 GLU A 117 -0.467 9.899 14.270 1.00 18.56 O ATOM 1772 OE2 GLU A 117 1.607 9.962 13.570 1.00 17.82 O1- ATOM 0 H GLU A 117 0.572 6.866 10.141 1.00 15.88 H new ATOM 0 HA GLU A 117 -1.947 6.877 11.593 1.00 16.82 H new ATOM 0 HB2 GLU A 117 -0.099 9.132 10.740 1.00 17.04 H new ATOM 0 HB3 GLU A 117 -1.477 9.287 11.811 1.00 17.04 H new ATOM 0 HG2 GLU A 117 -0.285 7.482 13.262 1.00 17.42 H new ATOM 0 HG3 GLU A 117 1.138 7.864 12.312 1.00 17.42 H new ATOM 1779 N GLY A 118 -2.036 7.092 8.554 1.00 15.62 N ATOM 1780 CA GLY A 118 -2.890 7.283 7.395 1.00 15.41 C ATOM 1781 C GLY A 118 -2.449 8.427 6.509 1.00 14.71 C ATOM 1782 O GLY A 118 -3.170 8.814 5.588 1.00 14.71 O ATOM 0 H GLY A 118 -1.306 6.390 8.429 1.00 15.62 H new ATOM 0 HA2 GLY A 118 -2.906 6.364 6.809 1.00 15.41 H new ATOM 0 HA3 GLY A 118 -3.911 7.465 7.731 1.00 15.41 H new ATOM 1786 N GLY A 119 -1.260 8.951 6.762 1.00 14.19 N ATOM 1787 CA GLY A 119 -0.809 10.116 6.046 1.00 13.68 C ATOM 1788 C GLY A 119 0.599 9.965 5.528 1.00 12.53 C ATOM 1789 O GLY A 119 1.362 9.121 6.003 1.00 12.20 O ATOM 0 H GLY A 119 -0.602 8.587 7.451 1.00 14.19 H new ATOM 0 HA2 GLY A 119 -1.482 10.308 5.210 1.00 13.68 H new ATOM 0 HA3 GLY A 119 -0.860 10.985 6.702 1.00 13.68 H new ATOM 1793 N PHE A 120 0.940 10.785 4.555 1.00 12.03 N ATOM 1794 CA PHE A 120 2.246 10.748 3.929 1.00 10.94 C ATOM 1795 C PHE A 120 3.018 12.014 4.271 1.00 11.32 C ATOM 1796 O PHE A 120 2.524 13.125 4.065 1.00 11.97 O ATOM 1797 CB PHE A 120 2.087 10.631 2.416 1.00 10.11 C ATOM 1798 CG PHE A 120 1.331 9.412 1.980 1.00 9.82 C ATOM 1799 CD1 PHE A 120 1.979 8.199 1.835 1.00 9.56 C ATOM 1800 CD2 PHE A 120 -0.029 9.477 1.719 1.00 9.99 C ATOM 1801 CE1 PHE A 120 1.289 7.073 1.438 1.00 9.49 C ATOM 1802 CE2 PHE A 120 -0.725 8.353 1.322 1.00 9.89 C ATOM 1803 CZ PHE A 120 -0.066 7.148 1.180 1.00 9.66 C ATOM 0 H PHE A 120 0.317 11.498 4.175 1.00 12.03 H new ATOM 0 HA PHE A 120 2.798 9.884 4.299 1.00 10.94 H new ATOM 0 HB2 PHE A 120 1.574 11.518 2.044 1.00 10.11 H new ATOM 0 HB3 PHE A 120 3.075 10.618 1.956 1.00 10.11 H new ATOM 0 HD1 PHE A 120 3.038 8.133 2.035 1.00 9.56 H new ATOM 0 HD2 PHE A 120 -0.549 10.417 1.827 1.00 9.99 H new ATOM 0 HE1 PHE A 120 1.808 6.132 1.329 1.00 9.49 H new ATOM 0 HE2 PHE A 120 -1.785 8.416 1.123 1.00 9.89 H new ATOM 0 HZ PHE A 120 -0.608 6.267 0.868 1.00 9.66 H new ATOM 1813 N ASP A 121 4.225 11.856 4.795 1.00 11.05 N ATOM 1814 CA ASP A 121 5.015 13.004 5.216 1.00 11.56 C ATOM 1815 C ASP A 121 6.414 12.958 4.636 1.00 10.58 C ATOM 1816 O ASP A 121 6.946 11.883 4.389 1.00 9.55 O ATOM 1817 CB ASP A 121 5.096 13.089 6.741 1.00 12.35 C ATOM 1818 CG ASP A 121 3.866 13.706 7.367 1.00 13.39 C ATOM 1819 OD1 ASP A 121 3.732 14.944 7.329 1.00 13.79 O ATOM 1820 OD2 ASP A 121 3.019 12.951 7.893 1.00 13.91 O1- ATOM 0 H ASP A 121 4.676 10.952 4.938 1.00 11.05 H new ATOM 0 HA ASP A 121 4.510 13.893 4.838 1.00 11.56 H new ATOM 0 HB2 ASP A 121 5.240 12.088 7.148 1.00 12.35 H new ATOM 0 HB3 ASP A 121 5.971 13.675 7.020 1.00 12.35 H new ATOM 1825 N PRO A 122 7.031 14.118 4.411 1.00 10.99 N ATOM 1826 CA PRO A 122 8.403 14.193 3.939 1.00 10.31 C ATOM 1827 C PRO A 122 9.408 14.165 5.086 1.00 10.40 C ATOM 1828 O PRO A 122 9.356 14.976 6.013 1.00 11.44 O ATOM 1829 CB PRO A 122 8.430 15.531 3.213 1.00 11.13 C ATOM 1830 CG PRO A 122 7.445 16.384 3.938 1.00 12.35 C ATOM 1831 CD PRO A 122 6.438 15.457 4.580 1.00 12.29 C ATOM 0 HA PRO A 122 8.683 13.347 3.311 1.00 10.31 H new ATOM 0 HB2 PRO A 122 9.426 15.972 3.236 1.00 11.13 H new ATOM 0 HB3 PRO A 122 8.156 15.416 2.164 1.00 11.13 H new ATOM 0 HG2 PRO A 122 7.944 16.992 4.693 1.00 12.35 H new ATOM 0 HG3 PRO A 122 6.952 17.071 3.251 1.00 12.35 H new ATOM 0 HD2 PRO A 122 6.288 15.698 5.632 1.00 12.29 H new ATOM 0 HD3 PRO A 122 5.464 15.527 4.095 1.00 12.29 H new ATOM 1839 N VAL A 123 10.309 13.209 5.022 1.00 9.36 N ATOM 1840 CA VAL A 123 11.329 13.046 6.040 1.00 9.43 C ATOM 1841 C VAL A 123 12.694 13.444 5.481 1.00 9.05 C ATOM 1842 O VAL A 123 13.031 13.102 4.347 1.00 8.18 O ATOM 1843 CB VAL A 123 11.381 11.581 6.551 1.00 8.79 C ATOM 1844 CG1 VAL A 123 12.039 10.669 5.540 1.00 7.90 C ATOM 1845 CG2 VAL A 123 12.080 11.493 7.897 1.00 9.39 C ATOM 0 H VAL A 123 10.357 12.525 4.267 1.00 9.36 H new ATOM 0 HA VAL A 123 11.075 13.694 6.879 1.00 9.43 H new ATOM 0 HB VAL A 123 10.353 11.244 6.684 1.00 8.79 H new ATOM 0 HG11 VAL A 123 12.060 9.651 5.928 1.00 7.90 H new ATOM 0 HG12 VAL A 123 11.474 10.691 4.608 1.00 7.90 H new ATOM 0 HG13 VAL A 123 13.058 11.007 5.354 1.00 7.90 H new ATOM 0 HG21 VAL A 123 12.101 10.455 8.229 1.00 9.39 H new ATOM 0 HG22 VAL A 123 13.100 11.864 7.802 1.00 9.39 H new ATOM 0 HG23 VAL A 123 11.541 12.097 8.627 1.00 9.39 H new ATOM 1855 N GLU A 124 13.450 14.212 6.249 1.00 9.85 N ATOM 1856 CA GLU A 124 14.829 14.497 5.890 1.00 9.72 C ATOM 1857 C GLU A 124 15.690 13.266 6.149 1.00 8.90 C ATOM 1858 O GLU A 124 15.766 12.768 7.276 1.00 9.21 O ATOM 1859 CB GLU A 124 15.374 15.695 6.669 1.00 10.96 C ATOM 1860 CG GLU A 124 16.741 16.145 6.180 1.00 11.07 C ATOM 1861 CD GLU A 124 17.308 17.296 6.977 1.00 12.34 C ATOM 1862 OE1 GLU A 124 16.853 18.441 6.776 1.00 12.83 O ATOM 1863 OE2 GLU A 124 18.203 17.062 7.812 1.00 12.93 O1- ATOM 0 H GLU A 124 13.136 14.646 7.117 1.00 9.85 H new ATOM 0 HA GLU A 124 14.861 14.749 4.830 1.00 9.72 H new ATOM 0 HB2 GLU A 124 14.673 16.525 6.587 1.00 10.96 H new ATOM 0 HB3 GLU A 124 15.439 15.436 7.726 1.00 10.96 H new ATOM 0 HG2 GLU A 124 17.432 15.303 6.227 1.00 11.07 H new ATOM 0 HG3 GLU A 124 16.667 16.438 5.133 1.00 11.07 H new ATOM 1870 N VAL A 125 16.319 12.775 5.097 1.00 8.03 N ATOM 1871 CA VAL A 125 17.095 11.547 5.160 1.00 7.30 C ATOM 1872 C VAL A 125 18.497 11.738 4.594 1.00 7.38 C ATOM 1873 O VAL A 125 18.752 12.643 3.800 1.00 7.84 O ATOM 1874 CB VAL A 125 16.361 10.390 4.418 1.00 6.19 C ATOM 1875 CG1 VAL A 125 15.291 10.923 3.497 1.00 6.15 C ATOM 1876 CG2 VAL A 125 17.298 9.522 3.617 1.00 5.62 C ATOM 0 H VAL A 125 16.307 13.214 4.176 1.00 8.03 H new ATOM 0 HA VAL A 125 17.195 11.279 6.212 1.00 7.30 H new ATOM 0 HB VAL A 125 15.910 9.779 5.200 1.00 6.19 H new ATOM 0 HG11 VAL A 125 14.797 10.092 2.994 1.00 6.15 H new ATOM 0 HG12 VAL A 125 14.558 11.484 4.077 1.00 6.15 H new ATOM 0 HG13 VAL A 125 15.744 11.579 2.754 1.00 6.15 H new ATOM 0 HG21 VAL A 125 16.730 8.734 3.123 1.00 5.62 H new ATOM 0 HG22 VAL A 125 17.805 10.129 2.867 1.00 5.62 H new ATOM 0 HG23 VAL A 125 18.037 9.075 4.282 1.00 5.62 H new ATOM 1886 N LYS A 126 19.397 10.878 5.035 1.00 7.21 N ATOM 1887 CA LYS A 126 20.729 10.809 4.488 1.00 7.44 C ATOM 1888 C LYS A 126 20.824 9.631 3.535 1.00 6.77 C ATOM 1889 O LYS A 126 20.508 8.503 3.904 1.00 6.29 O ATOM 1890 CB LYS A 126 21.772 10.668 5.581 1.00 8.03 C ATOM 1891 CG LYS A 126 23.180 10.534 5.026 1.00 8.46 C ATOM 1892 CD LYS A 126 24.205 10.272 6.108 1.00 9.06 C ATOM 1893 CE LYS A 126 24.315 11.427 7.093 1.00 9.72 C ATOM 1894 NZ LYS A 126 24.873 12.651 6.464 1.00 10.39 N1+ ATOM 0 H LYS A 126 19.219 10.209 5.784 1.00 7.21 H new ATOM 0 HA LYS A 126 20.926 11.738 3.954 1.00 7.44 H new ATOM 0 HB2 LYS A 126 21.725 11.536 6.238 1.00 8.03 H new ATOM 0 HB3 LYS A 126 21.540 9.794 6.190 1.00 8.03 H new ATOM 0 HG2 LYS A 126 23.206 9.721 4.301 1.00 8.46 H new ATOM 0 HG3 LYS A 126 23.445 11.446 4.492 1.00 8.46 H new ATOM 0 HD2 LYS A 126 23.937 9.363 6.646 1.00 9.06 H new ATOM 0 HD3 LYS A 126 25.178 10.096 5.649 1.00 9.06 H new ATOM 0 HE2 LYS A 126 23.329 11.648 7.502 1.00 9.72 H new ATOM 0 HE3 LYS A 126 24.948 11.130 7.929 1.00 9.72 H new ATOM 0 HZ1 LYS A 126 25.056 13.365 7.197 1.00 10.39 H new ATOM 0 HZ2 LYS A 126 25.763 12.417 5.979 1.00 10.39 H new ATOM 0 HZ3 LYS A 126 24.192 13.029 5.775 1.00 10.39 H new ATOM 1908 N ALA A 127 21.269 9.892 2.327 1.00 7.04 N ATOM 1909 CA ALA A 127 21.324 8.867 1.303 1.00 6.78 C ATOM 1910 C ALA A 127 22.559 9.010 0.435 1.00 7.69 C ATOM 1911 O ALA A 127 22.644 9.945 -0.358 1.00 8.30 O ATOM 1912 CB ALA A 127 20.082 8.942 0.436 1.00 6.34 C ATOM 0 H ALA A 127 21.600 10.809 2.026 1.00 7.04 H new ATOM 0 HA ALA A 127 21.372 7.899 1.801 1.00 6.78 H new ATOM 0 HB1 ALA A 127 20.127 8.170 -0.332 1.00 6.34 H new ATOM 0 HB2 ALA A 127 19.197 8.788 1.054 1.00 6.34 H new ATOM 0 HB3 ALA A 127 20.027 9.922 -0.037 1.00 6.34 H new ATOM 1918 N GLY A 128 23.533 8.127 0.575 1.00 8.00 N ATOM 1919 CA GLY A 128 24.593 8.136 -0.406 1.00 8.94 C ATOM 1920 C GLY A 128 25.274 6.801 -0.607 1.00 9.46 C ATOM 1921 O GLY A 128 26.424 6.614 -0.200 1.00 10.10 O ATOM 0 H GLY A 128 23.610 7.432 1.317 1.00 8.00 H new ATOM 0 HA2 GLY A 128 24.185 8.468 -1.360 1.00 8.94 H new ATOM 0 HA3 GLY A 128 25.341 8.870 -0.107 1.00 8.94 H new ATOM 1925 N ALA A 129 24.561 5.872 -1.223 1.00 9.37 N ATOM 1926 CA ALA A 129 25.152 4.783 -1.974 1.00 10.27 C ATOM 1927 C ALA A 129 24.201 4.400 -3.098 1.00 10.12 C ATOM 1928 O ALA A 129 23.026 4.764 -3.050 1.00 9.18 O ATOM 1929 CB ALA A 129 25.487 3.605 -1.091 1.00 10.61 C ATOM 0 H ALA A 129 23.541 5.855 -1.214 1.00 9.37 H new ATOM 0 HA ALA A 129 26.100 5.111 -2.400 1.00 10.27 H new ATOM 0 HB1 ALA A 129 25.928 2.812 -1.695 1.00 10.61 H new ATOM 0 HB2 ALA A 129 26.197 3.915 -0.325 1.00 10.61 H new ATOM 0 HB3 ALA A 129 24.578 3.237 -0.615 1.00 10.61 H new ATOM 1935 N THR A 130 24.675 3.680 -4.094 1.00 11.12 N ATOM 1936 CA THR A 130 23.795 3.159 -5.131 1.00 11.19 C ATOM 1937 C THR A 130 24.177 1.728 -5.472 1.00 12.15 C ATOM 1938 O THR A 130 25.344 1.436 -5.743 1.00 13.17 O ATOM 1939 CB THR A 130 23.858 4.015 -6.404 1.00 11.72 C ATOM 1940 OG1 THR A 130 23.846 5.406 -6.061 1.00 11.18 O ATOM 1941 CG2 THR A 130 22.694 3.711 -7.337 1.00 11.68 C ATOM 0 H THR A 130 25.660 3.441 -4.211 1.00 11.12 H new ATOM 0 HA THR A 130 22.777 3.189 -4.743 1.00 11.19 H new ATOM 0 HB THR A 130 24.785 3.772 -6.923 1.00 11.72 H new ATOM 0 HG1 THR A 130 23.888 5.945 -6.878 1.00 11.18 H new ATOM 0 HG21 THR A 130 22.769 4.334 -8.228 1.00 11.68 H new ATOM 0 HG22 THR A 130 22.724 2.660 -7.626 1.00 11.68 H new ATOM 0 HG23 THR A 130 21.754 3.920 -6.826 1.00 11.68 H new ATOM 1949 N ALA A 131 23.199 0.838 -5.447 1.00 11.92 N ATOM 1950 CA ALA A 131 23.451 -0.567 -5.703 1.00 12.91 C ATOM 1951 C ALA A 131 22.226 -1.255 -6.297 1.00 12.98 C ATOM 1952 O ALA A 131 21.128 -1.170 -5.745 1.00 12.19 O ATOM 1953 CB ALA A 131 23.878 -1.267 -4.424 1.00 12.87 C ATOM 0 H ALA A 131 22.224 1.065 -5.252 1.00 11.92 H new ATOM 0 HA ALA A 131 24.258 -0.633 -6.433 1.00 12.91 H new ATOM 0 HB1 ALA A 131 24.064 -2.321 -4.631 1.00 12.87 H new ATOM 0 HB2 ALA A 131 24.789 -0.806 -4.044 1.00 12.87 H new ATOM 0 HB3 ALA A 131 23.088 -1.177 -3.679 1.00 12.87 H new ATOM 1959 N GLY A 132 22.419 -1.920 -7.429 1.00 14.01 N ATOM 1960 CA GLY A 132 21.344 -2.661 -8.065 1.00 14.34 C ATOM 1961 C GLY A 132 20.258 -1.755 -8.609 1.00 13.47 C ATOM 1962 O GLY A 132 19.110 -2.172 -8.767 1.00 13.23 O ATOM 0 H GLY A 132 23.310 -1.960 -7.923 1.00 14.01 H new ATOM 0 HA2 GLY A 132 21.752 -3.262 -8.878 1.00 14.34 H new ATOM 0 HA3 GLY A 132 20.908 -3.353 -7.345 1.00 14.34 H new ATOM 1966 N GLY A 133 20.621 -0.516 -8.900 1.00 13.12 N ATOM 1967 CA GLY A 133 19.642 0.454 -9.345 1.00 12.40 C ATOM 1968 C GLY A 133 18.857 1.021 -8.180 1.00 10.98 C ATOM 1969 O GLY A 133 17.808 1.643 -8.363 1.00 10.30 O ATOM 0 H GLY A 133 21.576 -0.164 -8.836 1.00 13.12 H new ATOM 0 HA2 GLY A 133 20.144 1.263 -9.875 1.00 12.40 H new ATOM 0 HA3 GLY A 133 18.958 -0.015 -10.053 1.00 12.40 H new ATOM 1973 N GLN A 134 19.364 0.792 -6.979 1.00 10.62 N ATOM 1974 CA GLN A 134 18.738 1.297 -5.769 1.00 9.33 C ATOM 1975 C GLN A 134 19.695 2.220 -5.053 1.00 8.96 C ATOM 1976 O GLN A 134 20.867 2.296 -5.402 1.00 9.81 O ATOM 1977 CB GLN A 134 18.341 0.164 -4.821 1.00 9.38 C ATOM 1978 CG GLN A 134 17.278 -0.766 -5.366 1.00 9.89 C ATOM 1979 CD GLN A 134 16.732 -1.689 -4.297 1.00 10.08 C ATOM 1980 OE1 GLN A 134 15.767 -1.352 -3.614 1.00 10.39 O ATOM 1981 NE2 GLN A 134 17.350 -2.849 -4.135 1.00 10.17 N ATOM 0 H GLN A 134 20.215 0.254 -6.817 1.00 10.62 H new ATOM 0 HA GLN A 134 17.835 1.832 -6.062 1.00 9.33 H new ATOM 0 HB2 GLN A 134 19.229 -0.421 -4.581 1.00 9.38 H new ATOM 0 HB3 GLN A 134 17.983 0.597 -3.887 1.00 9.38 H new ATOM 0 HG2 GLN A 134 16.463 -0.178 -5.788 1.00 9.89 H new ATOM 0 HG3 GLN A 134 17.697 -1.360 -6.178 1.00 9.89 H new ATOM 0 HE21 GLN A 134 18.147 -3.089 -4.724 1.00 10.17 H new ATOM 0 HE22 GLN A 134 17.029 -3.503 -3.421 1.00 10.17 H new ATOM 1990 N SER A 135 19.207 2.894 -4.040 1.00 7.82 N ATOM 1991 CA SER A 135 20.033 3.783 -3.271 1.00 7.56 C ATOM 1992 C SER A 135 20.087 3.328 -1.821 1.00 7.12 C ATOM 1993 O SER A 135 19.171 2.655 -1.341 1.00 6.78 O ATOM 1994 CB SER A 135 19.528 5.220 -3.384 1.00 6.91 C ATOM 1995 OG SER A 135 18.117 5.266 -3.253 1.00 6.85 O ATOM 0 H SER A 135 18.237 2.841 -3.730 1.00 7.82 H new ATOM 0 HA SER A 135 21.046 3.756 -3.672 1.00 7.56 H new ATOM 0 HB2 SER A 135 19.990 5.835 -2.612 1.00 6.91 H new ATOM 0 HB3 SER A 135 19.823 5.640 -4.346 1.00 6.91 H new ATOM 0 HG SER A 135 17.763 4.353 -3.204 1.00 6.85 H new ATOM 2001 N GLU A 136 21.151 3.677 -1.134 1.00 7.39 N ATOM 2002 CA GLU A 136 21.284 3.320 0.272 1.00 7.25 C ATOM 2003 C GLU A 136 20.948 4.495 1.177 1.00 6.42 C ATOM 2004 O GLU A 136 21.500 5.589 1.042 1.00 6.54 O ATOM 2005 CB GLU A 136 22.698 2.832 0.558 1.00 8.31 C ATOM 2006 CG GLU A 136 22.991 1.473 -0.063 1.00 9.31 C ATOM 2007 CD GLU A 136 24.342 0.906 0.336 1.00 10.29 C ATOM 2008 OE1 GLU A 136 24.730 1.057 1.513 1.00 10.69 O ATOM 2009 OE2 GLU A 136 25.018 0.293 -0.513 1.00 10.79 O1- ATOM 0 H GLU A 136 21.936 4.204 -1.517 1.00 7.39 H new ATOM 0 HA GLU A 136 20.576 2.518 0.482 1.00 7.25 H new ATOM 0 HB2 GLU A 136 23.413 3.562 0.178 1.00 8.31 H new ATOM 0 HB3 GLU A 136 22.846 2.773 1.636 1.00 8.31 H new ATOM 0 HG2 GLU A 136 22.210 0.772 0.231 1.00 9.31 H new ATOM 0 HG3 GLU A 136 22.949 1.561 -1.149 1.00 9.31 H new ATOM 2016 N ILE A 137 20.003 4.262 2.076 1.00 5.86 N ATOM 2017 CA ILE A 137 19.638 5.237 3.084 1.00 5.49 C ATOM 2018 C ILE A 137 20.504 5.054 4.318 1.00 6.25 C ATOM 2019 O ILE A 137 20.413 4.043 5.020 1.00 6.73 O ATOM 2020 CB ILE A 137 18.148 5.136 3.472 1.00 4.93 C ATOM 2021 CG1 ILE A 137 17.264 5.539 2.299 1.00 4.16 C ATOM 2022 CG2 ILE A 137 17.834 5.990 4.693 1.00 5.24 C ATOM 2023 CD1 ILE A 137 17.656 6.860 1.688 1.00 4.21 C ATOM 0 H ILE A 137 19.471 3.393 2.124 1.00 5.86 H new ATOM 0 HA ILE A 137 19.803 6.227 2.659 1.00 5.49 H new ATOM 0 HB ILE A 137 17.939 4.097 3.728 1.00 4.93 H new ATOM 0 HG12 ILE A 137 17.310 4.764 1.534 1.00 4.16 H new ATOM 0 HG13 ILE A 137 16.228 5.594 2.635 1.00 4.16 H new ATOM 0 HG21 ILE A 137 16.776 5.897 4.940 1.00 5.24 H new ATOM 0 HG22 ILE A 137 18.435 5.653 5.537 1.00 5.24 H new ATOM 0 HG23 ILE A 137 18.065 7.033 4.477 1.00 5.24 H new ATOM 0 HD11 ILE A 137 16.988 7.090 0.858 1.00 4.21 H new ATOM 0 HD12 ILE A 137 17.583 7.645 2.441 1.00 4.21 H new ATOM 0 HD13 ILE A 137 18.681 6.802 1.323 1.00 4.21 H new ATOM 2035 N LEU A 138 21.346 6.040 4.548 1.00 6.60 N ATOM 2036 CA LEU A 138 22.283 6.038 5.655 1.00 7.40 C ATOM 2037 C LEU A 138 21.559 6.428 6.941 1.00 7.59 C ATOM 2038 O LEU A 138 21.730 5.793 7.982 1.00 8.21 O ATOM 2039 CB LEU A 138 23.427 7.015 5.349 1.00 7.87 C ATOM 2040 CG LEU A 138 24.508 6.543 4.349 1.00 8.31 C ATOM 2041 CD1 LEU A 138 23.925 5.729 3.203 1.00 7.93 C ATOM 2042 CD2 LEU A 138 25.253 7.740 3.781 1.00 8.79 C ATOM 0 H LEU A 138 21.401 6.876 3.965 1.00 6.60 H new ATOM 0 HA LEU A 138 22.702 5.041 5.789 1.00 7.40 H new ATOM 0 HB2 LEU A 138 22.991 7.937 4.965 1.00 7.87 H new ATOM 0 HB3 LEU A 138 23.921 7.263 6.289 1.00 7.87 H new ATOM 0 HG LEU A 138 25.191 5.899 4.903 1.00 8.31 H new ATOM 0 HD11 LEU A 138 24.726 5.422 2.530 1.00 7.93 H new ATOM 0 HD12 LEU A 138 23.427 4.845 3.601 1.00 7.93 H new ATOM 0 HD13 LEU A 138 23.204 6.336 2.656 1.00 7.93 H new ATOM 0 HD21 LEU A 138 26.012 7.396 3.078 1.00 8.79 H new ATOM 0 HD22 LEU A 138 24.550 8.395 3.265 1.00 8.79 H new ATOM 0 HD23 LEU A 138 25.732 8.289 4.592 1.00 8.79 H new ATOM 2054 N GLU A 139 20.738 7.467 6.850 1.00 7.31 N ATOM 2055 CA GLU A 139 19.937 7.934 7.971 1.00 7.84 C ATOM 2056 C GLU A 139 18.619 8.464 7.457 1.00 7.45 C ATOM 2057 O GLU A 139 18.474 8.689 6.265 1.00 6.77 O ATOM 2058 CB GLU A 139 20.650 9.046 8.738 1.00 8.66 C ATOM 2059 CG GLU A 139 21.766 8.559 9.638 1.00 9.21 C ATOM 2060 CD GLU A 139 22.330 9.660 10.509 1.00 9.98 C ATOM 2061 OE1 GLU A 139 23.156 10.454 10.015 1.00 10.28 O1- ATOM 2062 OE2 GLU A 139 21.936 9.746 11.692 1.00 10.44 O ATOM 0 H GLU A 139 20.610 8.009 5.995 1.00 7.31 H new ATOM 0 HA GLU A 139 19.776 7.093 8.646 1.00 7.84 H new ATOM 0 HB2 GLU A 139 21.059 9.760 8.024 1.00 8.66 H new ATOM 0 HB3 GLU A 139 19.919 9.583 9.342 1.00 8.66 H new ATOM 0 HG2 GLU A 139 21.393 7.754 10.271 1.00 9.21 H new ATOM 0 HG3 GLU A 139 22.564 8.139 9.026 1.00 9.21 H new ATOM 2069 N GLY A 140 17.668 8.678 8.342 1.00 8.06 N ATOM 2070 CA GLY A 140 16.414 9.261 7.922 1.00 8.05 C ATOM 2071 C GLY A 140 15.216 8.381 8.200 1.00 8.05 C ATOM 2072 O GLY A 140 14.404 8.681 9.074 1.00 8.87 O ATOM 0 H GLY A 140 17.737 8.462 9.336 1.00 8.06 H new ATOM 0 HA2 GLY A 140 16.279 10.216 8.429 1.00 8.05 H new ATOM 0 HA3 GLY A 140 16.460 9.471 6.853 1.00 8.05 H new ATOM 2076 N LEU A 141 15.105 7.289 7.460 1.00 7.34 N ATOM 2077 CA LEU A 141 13.934 6.426 7.552 1.00 7.46 C ATOM 2078 C LEU A 141 14.168 5.231 8.462 1.00 8.16 C ATOM 2079 O LEU A 141 15.246 5.062 9.035 1.00 8.50 O ATOM 2080 CB LEU A 141 13.503 5.930 6.170 1.00 6.40 C ATOM 2081 CG LEU A 141 12.721 6.927 5.319 1.00 6.03 C ATOM 2082 CD1 LEU A 141 12.483 6.356 3.931 1.00 5.58 C ATOM 2083 CD2 LEU A 141 11.392 7.269 5.982 1.00 6.58 C ATOM 0 H LEU A 141 15.809 6.978 6.790 1.00 7.34 H new ATOM 0 HA LEU A 141 13.140 7.035 7.984 1.00 7.46 H new ATOM 0 HB2 LEU A 141 14.394 5.631 5.618 1.00 6.40 H new ATOM 0 HB3 LEU A 141 12.893 5.036 6.300 1.00 6.40 H new ATOM 0 HG LEU A 141 13.308 7.841 5.229 1.00 6.03 H new ATOM 0 HD11 LEU A 141 11.924 7.076 3.332 1.00 5.58 H new ATOM 0 HD12 LEU A 141 13.441 6.152 3.452 1.00 5.58 H new ATOM 0 HD13 LEU A 141 11.913 5.430 4.011 1.00 5.58 H new ATOM 0 HD21 LEU A 141 10.848 7.981 5.361 1.00 6.58 H new ATOM 0 HD22 LEU A 141 10.799 6.362 6.098 1.00 6.58 H new ATOM 0 HD23 LEU A 141 11.577 7.709 6.962 1.00 6.58 H new ATOM 2095 N LYS A 142 13.143 4.403 8.570 1.00 8.54 N ATOM 2096 CA LYS A 142 13.196 3.187 9.359 1.00 9.51 C ATOM 2097 C LYS A 142 12.533 2.059 8.603 1.00 9.48 C ATOM 2098 O LYS A 142 11.634 2.274 7.790 1.00 8.97 O ATOM 2099 CB LYS A 142 12.472 3.387 10.688 1.00 10.71 C ATOM 2100 CG LYS A 142 12.454 2.148 11.567 1.00 11.83 C ATOM 2101 CD LYS A 142 11.613 2.352 12.813 1.00 12.89 C ATOM 2102 CE LYS A 142 11.392 1.043 13.555 1.00 13.50 C ATOM 2103 NZ LYS A 142 10.598 0.072 12.750 1.00 14.15 N1+ ATOM 0 H LYS A 142 12.246 4.558 8.110 1.00 8.54 H new ATOM 0 HA LYS A 142 14.241 2.942 9.550 1.00 9.51 H new ATOM 0 HB2 LYS A 142 12.950 4.201 11.233 1.00 10.71 H new ATOM 0 HB3 LYS A 142 11.446 3.696 10.489 1.00 10.71 H new ATOM 0 HG2 LYS A 142 12.062 1.305 10.998 1.00 11.83 H new ATOM 0 HG3 LYS A 142 13.474 1.892 11.855 1.00 11.83 H new ATOM 0 HD2 LYS A 142 12.105 3.067 13.472 1.00 12.89 H new ATOM 0 HD3 LYS A 142 10.650 2.783 12.537 1.00 12.89 H new ATOM 0 HE2 LYS A 142 12.356 0.602 13.807 1.00 13.50 H new ATOM 0 HE3 LYS A 142 10.877 1.242 14.495 1.00 13.50 H new ATOM 0 HZ1 LYS A 142 10.311 -0.726 13.352 1.00 14.15 H new ATOM 0 HZ2 LYS A 142 9.751 0.544 12.374 1.00 14.15 H new ATOM 0 HZ3 LYS A 142 11.177 -0.280 11.961 1.00 14.15 H new ATOM 2117 N ALA A 143 12.993 0.856 8.887 1.00 10.19 N ATOM 2118 CA ALA A 143 12.500 -0.340 8.235 1.00 10.49 C ATOM 2119 C ALA A 143 11.077 -0.631 8.660 1.00 11.20 C ATOM 2120 O ALA A 143 10.745 -0.550 9.844 1.00 12.12 O ATOM 2121 CB ALA A 143 13.389 -1.515 8.555 1.00 11.37 C ATOM 0 H ALA A 143 13.722 0.681 9.579 1.00 10.19 H new ATOM 0 HA ALA A 143 12.512 -0.173 7.158 1.00 10.49 H new ATOM 0 HB1 ALA A 143 13.006 -2.407 8.058 1.00 11.37 H new ATOM 0 HB2 ALA A 143 14.401 -1.311 8.206 1.00 11.37 H new ATOM 0 HB3 ALA A 143 13.403 -1.678 9.633 1.00 11.37 H new ATOM 2127 N GLY A 144 10.246 -0.972 7.693 1.00 10.88 N ATOM 2128 CA GLY A 144 8.849 -1.203 7.966 1.00 11.54 C ATOM 2129 C GLY A 144 8.004 -0.033 7.529 1.00 10.82 C ATOM 2130 O GLY A 144 6.774 -0.076 7.598 1.00 11.32 O ATOM 0 H GLY A 144 10.517 -1.094 6.717 1.00 10.88 H new ATOM 0 HA2 GLY A 144 8.520 -2.105 7.450 1.00 11.54 H new ATOM 0 HA3 GLY A 144 8.709 -1.377 9.033 1.00 11.54 H new ATOM 2134 N GLN A 145 8.667 1.021 7.079 1.00 9.74 N ATOM 2135 CA GLN A 145 7.985 2.194 6.599 1.00 9.10 C ATOM 2136 C GLN A 145 8.023 2.219 5.088 1.00 8.05 C ATOM 2137 O GLN A 145 8.890 1.609 4.486 1.00 7.35 O ATOM 2138 CB GLN A 145 8.617 3.447 7.187 1.00 8.76 C ATOM 2139 CG GLN A 145 8.615 3.429 8.701 1.00 9.88 C ATOM 2140 CD GLN A 145 7.249 3.750 9.275 1.00 10.75 C ATOM 2141 OE1 GLN A 145 6.422 2.860 9.476 1.00 11.13 O ATOM 2142 NE2 GLN A 145 7.003 5.021 9.545 1.00 11.24 N ATOM 0 H GLN A 145 9.685 1.079 7.040 1.00 9.74 H new ATOM 0 HA GLN A 145 6.943 2.165 6.918 1.00 9.10 H new ATOM 0 HB2 GLN A 145 9.642 3.539 6.827 1.00 8.76 H new ATOM 0 HB3 GLN A 145 8.076 4.325 6.835 1.00 8.76 H new ATOM 0 HG2 GLN A 145 8.933 2.447 9.052 1.00 9.88 H new ATOM 0 HG3 GLN A 145 9.342 4.151 9.072 1.00 9.88 H new ATOM 0 HE21 GLN A 145 7.715 5.728 9.364 1.00 11.24 H new ATOM 0 HE22 GLN A 145 6.101 5.294 9.935 1.00 11.24 H new ATOM 2151 N GLN A 146 7.103 2.913 4.479 1.00 8.12 N ATOM 2152 CA GLN A 146 7.030 2.945 3.029 1.00 7.34 C ATOM 2153 C GLN A 146 7.406 4.324 2.501 1.00 6.41 C ATOM 2154 O GLN A 146 7.160 5.340 3.147 1.00 6.79 O ATOM 2155 CB GLN A 146 5.607 2.609 2.601 1.00 8.14 C ATOM 2156 CG GLN A 146 5.130 1.274 3.122 1.00 9.01 C ATOM 2157 CD GLN A 146 3.625 1.113 3.038 1.00 9.89 C ATOM 2158 OE1 GLN A 146 2.899 1.476 3.962 1.00 10.17 O ATOM 2159 NE2 GLN A 146 3.145 0.553 1.942 1.00 10.49 N ATOM 0 H GLN A 146 6.390 3.466 4.955 1.00 8.12 H new ATOM 0 HA GLN A 146 7.731 2.216 2.621 1.00 7.34 H new ATOM 0 HB2 GLN A 146 4.934 3.391 2.953 1.00 8.14 H new ATOM 0 HB3 GLN A 146 5.552 2.608 1.512 1.00 8.14 H new ATOM 0 HG2 GLN A 146 5.608 0.476 2.554 1.00 9.01 H new ATOM 0 HG3 GLN A 146 5.445 1.160 4.159 1.00 9.01 H new ATOM 0 HE21 GLN A 146 3.779 0.265 1.197 1.00 10.49 H new ATOM 0 HE22 GLN A 146 2.140 0.409 1.841 1.00 10.49 H new ATOM 2168 N VAL A 147 8.032 4.335 1.342 1.00 5.45 N ATOM 2169 CA VAL A 147 8.327 5.571 0.617 1.00 4.76 C ATOM 2170 C VAL A 147 7.927 5.398 -0.841 1.00 4.67 C ATOM 2171 O VAL A 147 8.156 4.337 -1.425 1.00 4.76 O ATOM 2172 CB VAL A 147 9.824 5.970 0.706 1.00 3.89 C ATOM 2173 CG1 VAL A 147 10.722 4.761 0.482 1.00 4.21 C ATOM 2174 CG2 VAL A 147 10.149 7.076 -0.290 1.00 3.49 C ATOM 0 H VAL A 147 8.354 3.491 0.869 1.00 5.45 H new ATOM 0 HA VAL A 147 7.754 6.374 1.081 1.00 4.76 H new ATOM 0 HB VAL A 147 10.013 6.350 1.710 1.00 3.89 H new ATOM 0 HG11 VAL A 147 11.766 5.066 0.549 1.00 4.21 H new ATOM 0 HG12 VAL A 147 10.514 4.008 1.242 1.00 4.21 H new ATOM 0 HG13 VAL A 147 10.529 4.343 -0.506 1.00 4.21 H new ATOM 0 HG21 VAL A 147 11.204 7.340 -0.210 1.00 3.49 H new ATOM 0 HG22 VAL A 147 9.938 6.729 -1.301 1.00 3.49 H new ATOM 0 HG23 VAL A 147 9.538 7.952 -0.073 1.00 3.49 H new ATOM 2184 N VAL A 148 7.306 6.424 -1.413 1.00 4.95 N ATOM 2185 CA VAL A 148 6.846 6.361 -2.793 1.00 5.28 C ATOM 2186 C VAL A 148 8.030 6.281 -3.753 1.00 4.93 C ATOM 2187 O VAL A 148 8.930 7.117 -3.729 1.00 4.74 O ATOM 2188 CB VAL A 148 5.940 7.562 -3.159 1.00 6.08 C ATOM 2189 CG1 VAL A 148 6.683 8.883 -3.016 1.00 6.56 C ATOM 2190 CG2 VAL A 148 5.380 7.411 -4.567 1.00 6.56 C ATOM 0 H VAL A 148 7.110 7.307 -0.942 1.00 4.95 H new ATOM 0 HA VAL A 148 6.248 5.455 -2.890 1.00 5.28 H new ATOM 0 HB VAL A 148 5.106 7.570 -2.457 1.00 6.08 H new ATOM 0 HG11 VAL A 148 6.018 9.705 -3.281 1.00 6.56 H new ATOM 0 HG12 VAL A 148 7.016 9.003 -1.985 1.00 6.56 H new ATOM 0 HG13 VAL A 148 7.548 8.888 -3.680 1.00 6.56 H new ATOM 0 HG21 VAL A 148 4.747 8.267 -4.801 1.00 6.56 H new ATOM 0 HG22 VAL A 148 6.201 7.361 -5.282 1.00 6.56 H new ATOM 0 HG23 VAL A 148 4.790 6.496 -4.628 1.00 6.56 H new ATOM 2200 N VAL A 149 8.029 5.250 -4.578 1.00 5.25 N ATOM 2201 CA VAL A 149 9.120 5.009 -5.505 1.00 5.51 C ATOM 2202 C VAL A 149 8.635 5.214 -6.933 1.00 6.47 C ATOM 2203 O VAL A 149 9.367 4.974 -7.898 1.00 6.99 O ATOM 2204 CB VAL A 149 9.680 3.578 -5.324 1.00 5.65 C ATOM 2205 CG1 VAL A 149 9.730 3.233 -3.852 1.00 5.29 C ATOM 2206 CG2 VAL A 149 8.855 2.535 -6.064 1.00 6.22 C ATOM 0 H VAL A 149 7.278 4.561 -4.625 1.00 5.25 H new ATOM 0 HA VAL A 149 9.923 5.717 -5.298 1.00 5.51 H new ATOM 0 HB VAL A 149 10.683 3.565 -5.750 1.00 5.65 H new ATOM 0 HG11 VAL A 149 10.125 2.225 -3.728 1.00 5.29 H new ATOM 0 HG12 VAL A 149 10.376 3.942 -3.334 1.00 5.29 H new ATOM 0 HG13 VAL A 149 8.725 3.284 -3.432 1.00 5.29 H new ATOM 0 HG21 VAL A 149 9.289 1.548 -5.905 1.00 6.22 H new ATOM 0 HG22 VAL A 149 7.832 2.546 -5.688 1.00 6.22 H new ATOM 0 HG23 VAL A 149 8.852 2.763 -7.130 1.00 6.22 H new ATOM 2216 N SER A 150 7.384 5.671 -7.032 1.00 6.89 N ATOM 2217 CA SER A 150 6.688 5.874 -8.300 1.00 7.82 C ATOM 2218 C SER A 150 6.318 4.535 -8.938 1.00 8.09 C ATOM 2219 O SER A 150 5.154 4.289 -9.254 1.00 8.72 O ATOM 2220 CB SER A 150 7.520 6.730 -9.262 1.00 8.62 C ATOM 2221 OG SER A 150 6.810 7.012 -10.455 1.00 9.06 O ATOM 0 H SER A 150 6.819 5.914 -6.218 1.00 6.89 H new ATOM 0 HA SER A 150 5.766 6.416 -8.090 1.00 7.82 H new ATOM 0 HB2 SER A 150 7.796 7.664 -8.773 1.00 8.62 H new ATOM 0 HB3 SER A 150 8.447 6.210 -9.504 1.00 8.62 H new ATOM 0 HG SER A 150 7.367 7.561 -11.046 1.00 9.06 H new ATOM 2227 N GLY A 151 7.306 3.671 -9.100 1.00 7.84 N ATOM 2228 CA GLY A 151 7.068 2.364 -9.668 1.00 8.31 C ATOM 2229 C GLY A 151 7.582 2.270 -11.082 1.00 8.50 C ATOM 2230 O GLY A 151 8.530 2.969 -11.448 1.00 8.43 O ATOM 0 H GLY A 151 8.277 3.855 -8.846 1.00 7.84 H new ATOM 0 HA2 GLY A 151 7.553 1.606 -9.053 1.00 8.31 H new ATOM 0 HA3 GLY A 151 5.999 2.150 -9.654 1.00 8.31 H new ATOM 2234 N GLN A 152 6.970 1.413 -11.873 1.00 8.97 N ATOM 2235 CA GLN A 152 7.346 1.259 -13.264 1.00 9.41 C ATOM 2236 C GLN A 152 6.104 1.331 -14.135 1.00 9.73 C ATOM 2237 O GLN A 152 4.983 1.248 -13.634 1.00 9.97 O ATOM 2238 CB GLN A 152 8.064 -0.074 -13.482 1.00 10.01 C ATOM 2239 CG GLN A 152 7.185 -1.295 -13.260 1.00 10.63 C ATOM 2240 CD GLN A 152 7.871 -2.576 -13.677 1.00 11.38 C ATOM 2241 OE1 GLN A 152 7.771 -2.999 -14.829 1.00 11.71 O ATOM 2242 NE2 GLN A 152 8.579 -3.199 -12.752 1.00 11.84 N ATOM 0 H GLN A 152 6.205 0.808 -11.574 1.00 8.97 H new ATOM 0 HA GLN A 152 8.028 2.064 -13.538 1.00 9.41 H new ATOM 0 HB2 GLN A 152 8.456 -0.102 -14.499 1.00 10.01 H new ATOM 0 HB3 GLN A 152 8.920 -0.128 -12.809 1.00 10.01 H new ATOM 0 HG2 GLN A 152 6.912 -1.357 -12.207 1.00 10.63 H new ATOM 0 HG3 GLN A 152 6.259 -1.181 -13.823 1.00 10.63 H new ATOM 0 HE21 GLN A 152 8.636 -2.815 -11.809 1.00 11.84 H new ATOM 0 HE22 GLN A 152 9.068 -4.064 -12.981 1.00 11.84 H new ATOM 2251 N PHE A 153 6.298 1.491 -15.433 1.00 9.95 N ATOM 2252 CA PHE A 153 5.181 1.575 -16.355 1.00 10.47 C ATOM 2253 C PHE A 153 4.718 0.183 -16.754 1.00 10.93 C ATOM 2254 O PHE A 153 5.168 -0.363 -17.763 1.00 11.34 O ATOM 2255 CB PHE A 153 5.549 2.404 -17.588 1.00 10.62 C ATOM 2256 CG PHE A 153 5.753 3.859 -17.281 1.00 11.04 C ATOM 2257 CD1 PHE A 153 4.674 4.728 -17.236 1.00 11.41 C ATOM 2258 CD2 PHE A 153 7.021 4.359 -17.034 1.00 11.27 C ATOM 2259 CE1 PHE A 153 4.856 6.067 -16.949 1.00 12.02 C ATOM 2260 CE2 PHE A 153 7.209 5.697 -16.749 1.00 11.87 C ATOM 2261 CZ PHE A 153 6.126 6.553 -16.706 1.00 12.24 C ATOM 0 H PHE A 153 7.217 1.565 -15.870 1.00 9.95 H new ATOM 0 HA PHE A 153 4.357 2.079 -15.850 1.00 10.47 H new ATOM 0 HB2 PHE A 153 6.460 2.001 -18.030 1.00 10.62 H new ATOM 0 HB3 PHE A 153 4.761 2.303 -18.334 1.00 10.62 H new ATOM 0 HD1 PHE A 153 3.679 4.354 -17.428 1.00 11.41 H new ATOM 0 HD2 PHE A 153 7.872 3.695 -17.065 1.00 11.27 H new ATOM 0 HE1 PHE A 153 4.006 6.733 -16.915 1.00 12.02 H new ATOM 0 HE2 PHE A 153 8.203 6.074 -16.560 1.00 11.87 H new ATOM 0 HZ PHE A 153 6.272 7.600 -16.483 1.00 12.24 H new ATOM 2271 N LEU A 154 3.846 -0.375 -15.910 1.00 11.05 N ATOM 2272 CA LEU A 154 3.397 -1.770 -15.986 1.00 11.63 C ATOM 2273 C LEU A 154 3.157 -2.227 -17.422 1.00 11.39 C ATOM 2274 O LEU A 154 4.045 -2.803 -18.058 1.00 11.57 O ATOM 2275 CB LEU A 154 2.099 -1.952 -15.178 1.00 12.16 C ATOM 2276 CG LEU A 154 2.212 -1.804 -13.653 1.00 12.68 C ATOM 2277 CD1 LEU A 154 2.249 -0.341 -13.236 1.00 13.16 C ATOM 2278 CD2 LEU A 154 1.061 -2.519 -12.966 1.00 13.04 C ATOM 0 H LEU A 154 3.423 0.140 -15.138 1.00 11.05 H new ATOM 0 HA LEU A 154 4.195 -2.383 -15.567 1.00 11.63 H new ATOM 0 HB2 LEU A 154 1.369 -1.227 -15.538 1.00 12.16 H new ATOM 0 HB3 LEU A 154 1.698 -2.942 -15.396 1.00 12.16 H new ATOM 0 HG LEU A 154 3.151 -2.263 -13.343 1.00 12.68 H new ATOM 0 HD11 LEU A 154 2.329 -0.274 -12.151 1.00 13.16 H new ATOM 0 HD12 LEU A 154 3.110 0.146 -13.694 1.00 13.16 H new ATOM 0 HD13 LEU A 154 1.335 0.154 -13.564 1.00 13.16 H new ATOM 0 HD21 LEU A 154 1.155 -2.405 -11.886 1.00 13.04 H new ATOM 0 HD22 LEU A 154 0.116 -2.087 -13.296 1.00 13.04 H new ATOM 0 HD23 LEU A 154 1.085 -3.578 -13.223 1.00 13.04 H new ATOM 2290 N ILE A 155 1.950 -1.976 -17.911 1.00 11.17 N ATOM 2291 CA ILE A 155 1.511 -2.454 -19.214 1.00 11.08 C ATOM 2292 C ILE A 155 0.515 -1.460 -19.795 1.00 10.31 C ATOM 2293 O ILE A 155 -0.542 -1.237 -19.215 1.00 9.93 O ATOM 2294 CB ILE A 155 0.823 -3.844 -19.105 1.00 11.39 C ATOM 2295 CG1 ILE A 155 1.780 -4.894 -18.529 1.00 11.61 C ATOM 2296 CG2 ILE A 155 0.313 -4.294 -20.464 1.00 11.66 C ATOM 2297 CD1 ILE A 155 1.140 -6.250 -18.312 1.00 11.95 C ATOM 0 H ILE A 155 1.245 -1.433 -17.412 1.00 11.17 H new ATOM 0 HA ILE A 155 2.386 -2.550 -19.856 1.00 11.08 H new ATOM 0 HB ILE A 155 -0.022 -3.743 -18.424 1.00 11.39 H new ATOM 0 HG12 ILE A 155 2.629 -5.007 -19.203 1.00 11.61 H new ATOM 0 HG13 ILE A 155 2.173 -4.532 -17.579 1.00 11.61 H new ATOM 0 HG21 ILE A 155 -0.165 -5.269 -20.369 1.00 11.66 H new ATOM 0 HG22 ILE A 155 -0.410 -3.570 -20.839 1.00 11.66 H new ATOM 0 HG23 ILE A 155 1.148 -4.367 -21.160 1.00 11.66 H new ATOM 0 HD11 ILE A 155 1.878 -6.940 -17.903 1.00 11.95 H new ATOM 0 HD12 ILE A 155 0.309 -6.152 -17.614 1.00 11.95 H new ATOM 0 HD13 ILE A 155 0.772 -6.635 -19.263 1.00 11.95 H new ATOM 2309 N ASP A 156 0.888 -0.807 -20.887 1.00 10.31 N ATOM 2310 CA ASP A 156 -0.006 0.135 -21.559 1.00 9.81 C ATOM 2311 C ASP A 156 -0.918 -0.549 -22.572 1.00 9.63 C ATOM 2312 O ASP A 156 -2.098 -0.769 -22.330 1.00 9.09 O ATOM 2313 CB ASP A 156 0.795 1.236 -22.232 1.00 10.26 C ATOM 2314 CG ASP A 156 -0.054 2.125 -23.123 1.00 10.68 C ATOM 2315 OD1 ASP A 156 -0.963 2.803 -22.595 1.00 10.64 O1- ATOM 2316 OD2 ASP A 156 0.181 2.146 -24.352 1.00 11.22 O ATOM 0 H ASP A 156 1.802 -0.910 -21.328 1.00 10.31 H new ATOM 0 HA ASP A 156 -0.646 0.571 -20.792 1.00 9.81 H new ATOM 0 HB2 ASP A 156 1.275 1.848 -21.468 1.00 10.26 H new ATOM 0 HB3 ASP A 156 1.591 0.788 -22.827 1.00 10.26 H new ATOM 2321 N SER A 157 -0.332 -0.866 -23.730 1.00 10.26 N ATOM 2322 CA SER A 157 -1.085 -1.183 -24.940 1.00 10.38 C ATOM 2323 C SER A 157 -1.916 -2.445 -24.797 1.00 9.63 C ATOM 2324 O SER A 157 -3.068 -2.489 -25.229 1.00 9.37 O ATOM 2325 CB SER A 157 -0.123 -1.289 -26.121 1.00 11.42 C ATOM 2326 OG SER A 157 1.104 -1.880 -25.729 1.00 11.90 O ATOM 0 H SER A 157 0.680 -0.909 -23.852 1.00 10.26 H new ATOM 0 HA SER A 157 -1.793 -0.374 -25.117 1.00 10.38 H new ATOM 0 HB2 SER A 157 -0.579 -1.883 -26.913 1.00 11.42 H new ATOM 0 HB3 SER A 157 0.063 -0.297 -26.533 1.00 11.42 H new ATOM 0 HG SER A 157 1.701 -1.938 -26.504 1.00 11.90 H new ATOM 2332 N GLU A 158 -1.322 -3.463 -24.184 1.00 9.47 N ATOM 2333 CA GLU A 158 -2.019 -4.711 -23.909 1.00 9.00 C ATOM 2334 C GLU A 158 -3.090 -4.486 -22.857 1.00 8.03 C ATOM 2335 O GLU A 158 -4.101 -5.172 -22.827 1.00 7.69 O ATOM 2336 CB GLU A 158 -1.032 -5.778 -23.433 1.00 9.38 C ATOM 2337 CG GLU A 158 -0.126 -6.304 -24.532 1.00 10.19 C ATOM 2338 CD GLU A 158 -0.887 -7.074 -25.592 1.00 10.79 C ATOM 2339 OE1 GLU A 158 -1.430 -6.446 -26.523 1.00 11.06 O ATOM 2340 OE2 GLU A 158 -0.949 -8.317 -25.500 1.00 11.17 O1- ATOM 0 H GLU A 158 -0.353 -3.446 -23.867 1.00 9.47 H new ATOM 0 HA GLU A 158 -2.491 -5.058 -24.828 1.00 9.00 H new ATOM 0 HB2 GLU A 158 -0.417 -5.362 -22.635 1.00 9.38 H new ATOM 0 HB3 GLU A 158 -1.589 -6.611 -23.004 1.00 9.38 H new ATOM 0 HG2 GLU A 158 0.396 -5.469 -24.999 1.00 10.19 H new ATOM 0 HG3 GLU A 158 0.634 -6.950 -24.093 1.00 10.19 H new ATOM 2347 N ALA A 159 -2.849 -3.503 -22.000 1.00 7.82 N ATOM 2348 CA ALA A 159 -3.779 -3.150 -20.940 1.00 7.20 C ATOM 2349 C ALA A 159 -4.932 -2.330 -21.493 1.00 7.12 C ATOM 2350 O ALA A 159 -5.975 -2.198 -20.857 1.00 6.81 O ATOM 2351 CB ALA A 159 -3.054 -2.369 -19.863 1.00 7.44 C ATOM 0 H ALA A 159 -2.005 -2.930 -22.021 1.00 7.82 H new ATOM 0 HA ALA A 159 -4.184 -4.066 -20.509 1.00 7.20 H new ATOM 0 HB1 ALA A 159 -3.754 -2.106 -19.070 1.00 7.44 H new ATOM 0 HB2 ALA A 159 -2.250 -2.979 -19.450 1.00 7.44 H new ATOM 0 HB3 ALA A 159 -2.635 -1.459 -20.293 1.00 7.44 H new ATOM 2357 N SER A 160 -4.723 -1.760 -22.667 1.00 7.72 N ATOM 2358 CA SER A 160 -5.760 -1.014 -23.349 1.00 8.04 C ATOM 2359 C SER A 160 -6.687 -1.978 -24.077 1.00 7.99 C ATOM 2360 O SER A 160 -7.907 -1.825 -24.055 1.00 8.08 O ATOM 2361 CB SER A 160 -5.132 -0.029 -24.340 1.00 8.99 C ATOM 2362 OG SER A 160 -6.073 0.936 -24.776 1.00 9.64 O ATOM 0 H SER A 160 -3.836 -1.802 -23.169 1.00 7.72 H new ATOM 0 HA SER A 160 -6.338 -0.449 -22.618 1.00 8.04 H new ATOM 0 HB2 SER A 160 -4.286 0.472 -23.870 1.00 8.99 H new ATOM 0 HB3 SER A 160 -4.743 -0.574 -25.200 1.00 8.99 H new ATOM 0 HG SER A 160 -5.643 1.551 -25.406 1.00 9.64 H new ATOM 2368 N LEU A 161 -6.092 -2.986 -24.705 1.00 8.10 N ATOM 2369 CA LEU A 161 -6.847 -3.973 -25.458 1.00 8.40 C ATOM 2370 C LEU A 161 -7.531 -4.964 -24.524 1.00 7.89 C ATOM 2371 O LEU A 161 -8.636 -5.430 -24.801 1.00 8.18 O ATOM 2372 CB LEU A 161 -5.919 -4.716 -26.417 1.00 9.04 C ATOM 2373 CG LEU A 161 -5.115 -3.828 -27.370 1.00 9.80 C ATOM 2374 CD1 LEU A 161 -4.215 -4.678 -28.245 1.00 10.57 C ATOM 2375 CD2 LEU A 161 -6.042 -2.974 -28.224 1.00 10.37 C ATOM 0 H LEU A 161 -5.084 -3.139 -24.705 1.00 8.10 H new ATOM 0 HA LEU A 161 -7.617 -3.454 -26.029 1.00 8.40 H new ATOM 0 HB2 LEU A 161 -5.222 -5.315 -25.831 1.00 9.04 H new ATOM 0 HB3 LEU A 161 -6.516 -5.409 -27.010 1.00 9.04 H new ATOM 0 HG LEU A 161 -4.492 -3.160 -26.776 1.00 9.80 H new ATOM 0 HD11 LEU A 161 -3.649 -4.034 -28.918 1.00 10.57 H new ATOM 0 HD12 LEU A 161 -3.526 -5.243 -27.618 1.00 10.57 H new ATOM 0 HD13 LEU A 161 -4.823 -5.369 -28.829 1.00 10.57 H new ATOM 0 HD21 LEU A 161 -5.449 -2.351 -28.894 1.00 10.37 H new ATOM 0 HD22 LEU A 161 -6.694 -3.620 -28.812 1.00 10.37 H new ATOM 0 HD23 LEU A 161 -6.648 -2.338 -27.579 1.00 10.37 H new ATOM 2387 N ARG A 162 -6.865 -5.291 -23.430 1.00 7.38 N ATOM 2388 CA ARG A 162 -7.416 -6.197 -22.433 1.00 7.17 C ATOM 2389 C ARG A 162 -8.013 -5.385 -21.286 1.00 6.87 C ATOM 2390 O ARG A 162 -8.304 -4.198 -21.442 1.00 6.95 O ATOM 2391 CB ARG A 162 -6.308 -7.114 -21.903 1.00 7.15 C ATOM 2392 CG ARG A 162 -5.522 -7.826 -22.996 1.00 7.34 C ATOM 2393 CD ARG A 162 -4.382 -8.640 -22.409 1.00 7.40 C ATOM 2394 NE ARG A 162 -3.402 -9.046 -23.419 1.00 7.84 N ATOM 2395 CZ ARG A 162 -2.934 -10.288 -23.553 1.00 8.24 C ATOM 2396 NH1 ARG A 162 -3.449 -11.280 -22.838 1.00 8.25 N1+ ATOM 2397 NH2 ARG A 162 -1.966 -10.539 -24.421 1.00 8.90 N ATOM 0 H ARG A 162 -5.934 -4.940 -23.207 1.00 7.38 H new ATOM 0 HA ARG A 162 -8.197 -6.808 -22.886 1.00 7.17 H new ATOM 0 HB2 ARG A 162 -5.619 -6.524 -21.299 1.00 7.15 H new ATOM 0 HB3 ARG A 162 -6.751 -7.860 -21.243 1.00 7.15 H new ATOM 0 HG2 ARG A 162 -6.188 -8.480 -23.559 1.00 7.34 H new ATOM 0 HG3 ARG A 162 -5.125 -7.093 -23.699 1.00 7.34 H new ATOM 0 HD2 ARG A 162 -3.882 -8.054 -21.637 1.00 7.40 H new ATOM 0 HD3 ARG A 162 -4.787 -9.528 -21.923 1.00 7.40 H new ATOM 0 HE ARG A 162 -3.055 -8.333 -24.061 1.00 7.84 H new ATOM 0 HH11 ARG A 162 -4.207 -11.095 -22.181 1.00 8.25 H new ATOM 0 HH12 ARG A 162 -3.087 -12.227 -22.945 1.00 8.25 H new ATOM 0 HH21 ARG A 162 -1.579 -9.783 -24.986 1.00 8.90 H new ATOM 0 HH22 ARG A 162 -1.607 -11.488 -24.524 1.00 8.90 H new ATOM 2411 N GLY A 163 -8.209 -6.028 -20.144 1.00 6.89 N ATOM 2412 CA GLY A 163 -8.762 -5.346 -18.991 1.00 7.01 C ATOM 2413 C GLY A 163 -8.946 -6.281 -17.818 1.00 6.68 C ATOM 2414 O GLY A 163 -8.425 -6.038 -16.732 1.00 7.15 O ATOM 0 H GLY A 163 -7.994 -7.014 -19.995 1.00 6.89 H new ATOM 0 HA2 GLY A 163 -8.103 -4.527 -18.703 1.00 7.01 H new ATOM 0 HA3 GLY A 163 -9.722 -4.904 -19.257 1.00 7.01 H new ATOM 2418 N THR A 164 -9.694 -7.348 -18.034 1.00 6.17 N ATOM 2419 CA THR A 164 -9.859 -8.385 -17.029 1.00 6.16 C ATOM 2420 C THR A 164 -8.992 -9.589 -17.374 1.00 6.65 C ATOM 2421 O THR A 164 -8.559 -10.339 -16.503 1.00 7.09 O ATOM 2422 CB THR A 164 -11.333 -8.824 -16.918 1.00 6.38 C ATOM 2423 OG1 THR A 164 -11.871 -9.056 -18.229 1.00 6.86 O ATOM 2424 CG2 THR A 164 -12.160 -7.770 -16.199 1.00 6.23 C ATOM 0 H THR A 164 -10.200 -7.520 -18.902 1.00 6.17 H new ATOM 0 HA THR A 164 -9.549 -7.974 -16.068 1.00 6.16 H new ATOM 0 HB THR A 164 -11.375 -9.747 -16.339 1.00 6.38 H new ATOM 0 HG1 THR A 164 -12.807 -9.336 -18.154 1.00 6.86 H new ATOM 0 HG21 THR A 164 -13.196 -8.103 -16.133 1.00 6.23 H new ATOM 0 HG22 THR A 164 -11.763 -7.618 -15.195 1.00 6.23 H new ATOM 0 HG23 THR A 164 -12.115 -6.832 -16.752 1.00 6.23 H new ATOM 2432 N VAL A 165 -8.716 -9.744 -18.657 1.00 6.89 N ATOM 2433 CA VAL A 165 -7.921 -10.857 -19.148 1.00 7.69 C ATOM 2434 C VAL A 165 -6.438 -10.500 -19.111 1.00 7.93 C ATOM 2435 O VAL A 165 -5.834 -10.179 -20.133 1.00 8.39 O ATOM 2436 CB VAL A 165 -8.331 -11.246 -20.587 1.00 8.39 C ATOM 2437 CG1 VAL A 165 -7.561 -12.466 -21.068 1.00 9.20 C ATOM 2438 CG2 VAL A 165 -9.827 -11.504 -20.662 1.00 8.56 C ATOM 0 H VAL A 165 -9.035 -9.105 -19.385 1.00 6.89 H new ATOM 0 HA VAL A 165 -8.104 -11.713 -18.498 1.00 7.69 H new ATOM 0 HB VAL A 165 -8.084 -10.411 -21.242 1.00 8.39 H new ATOM 0 HG11 VAL A 165 -7.871 -12.715 -22.083 1.00 9.20 H new ATOM 0 HG12 VAL A 165 -6.493 -12.249 -21.058 1.00 9.20 H new ATOM 0 HG13 VAL A 165 -7.766 -13.309 -20.409 1.00 9.20 H new ATOM 0 HG21 VAL A 165 -10.099 -11.777 -21.682 1.00 8.56 H new ATOM 0 HG22 VAL A 165 -10.090 -12.318 -19.987 1.00 8.56 H new ATOM 0 HG23 VAL A 165 -10.367 -10.603 -20.371 1.00 8.56 H new ATOM 2448 N ALA A 166 -5.861 -10.533 -17.921 1.00 7.88 N ATOM 2449 CA ALA A 166 -4.455 -10.203 -17.751 1.00 8.33 C ATOM 2450 C ALA A 166 -3.862 -10.947 -16.562 1.00 8.94 C ATOM 2451 O ALA A 166 -4.010 -10.525 -15.420 1.00 9.11 O ATOM 2452 CB ALA A 166 -4.284 -8.700 -17.577 1.00 8.31 C ATOM 0 H ALA A 166 -6.344 -10.785 -17.059 1.00 7.88 H new ATOM 0 HA ALA A 166 -3.919 -10.516 -18.647 1.00 8.33 H new ATOM 0 HB1 ALA A 166 -3.227 -8.466 -17.451 1.00 8.31 H new ATOM 0 HB2 ALA A 166 -4.666 -8.186 -18.459 1.00 8.31 H new ATOM 0 HB3 ALA A 166 -4.836 -8.370 -16.697 1.00 8.31 H new ATOM 2458 N ARG A 167 -3.191 -12.059 -16.835 1.00 9.50 N ATOM 2459 CA ARG A 167 -2.554 -12.837 -15.780 1.00 10.31 C ATOM 2460 C ARG A 167 -1.112 -13.062 -16.165 1.00 10.80 C ATOM 2461 O ARG A 167 -0.213 -12.342 -15.735 1.00 11.13 O ATOM 2462 CB ARG A 167 -3.212 -14.212 -15.516 1.00 10.89 C ATOM 2463 CG ARG A 167 -4.705 -14.287 -15.747 1.00 11.67 C ATOM 2464 CD ARG A 167 -5.021 -14.191 -17.215 1.00 12.28 C ATOM 2465 NE ARG A 167 -4.495 -15.328 -17.973 1.00 13.07 N ATOM 2466 CZ ARG A 167 -4.695 -15.514 -19.278 1.00 13.78 C ATOM 2467 NH1 ARG A 167 -5.495 -14.698 -19.951 1.00 13.81 N1+ ATOM 2468 NH2 ARG A 167 -4.119 -16.533 -19.903 1.00 14.58 N ATOM 0 H ARG A 167 -3.074 -12.441 -17.773 1.00 9.50 H new ATOM 0 HA ARG A 167 -2.660 -12.263 -14.859 1.00 10.31 H new ATOM 0 HB2 ARG A 167 -2.728 -14.953 -16.153 1.00 10.89 H new ATOM 0 HB3 ARG A 167 -3.009 -14.498 -14.484 1.00 10.89 H new ATOM 0 HG2 ARG A 167 -5.093 -15.223 -15.347 1.00 11.67 H new ATOM 0 HG3 ARG A 167 -5.202 -13.480 -15.209 1.00 11.67 H new ATOM 0 HD2 ARG A 167 -6.101 -14.137 -17.349 1.00 12.28 H new ATOM 0 HD3 ARG A 167 -4.604 -13.267 -17.614 1.00 12.28 H new ATOM 0 HE ARG A 167 -3.941 -16.022 -17.471 1.00 13.07 H new ATOM 0 HH11 ARG A 167 -5.958 -13.927 -19.470 1.00 13.81 H new ATOM 0 HH12 ARG A 167 -5.647 -14.842 -20.949 1.00 13.81 H new ATOM 0 HH21 ARG A 167 -3.521 -17.177 -19.385 1.00 14.58 H new ATOM 0 HH22 ARG A 167 -4.274 -16.672 -20.901 1.00 14.58 H new ATOM 2482 N MET A 168 -0.943 -14.052 -17.026 1.00 11.01 N ATOM 2483 CA MET A 168 0.330 -14.375 -17.661 1.00 11.55 C ATOM 2484 C MET A 168 1.468 -14.475 -16.653 1.00 11.86 C ATOM 2485 O MET A 168 2.244 -13.531 -16.484 1.00 11.94 O ATOM 2486 CB MET A 168 0.647 -13.337 -18.735 1.00 11.57 C ATOM 2487 CG MET A 168 -0.504 -13.122 -19.709 1.00 11.64 C ATOM 2488 SD MET A 168 -0.465 -11.495 -20.484 1.00 11.27 S ATOM 2489 CE MET A 168 -0.671 -10.452 -19.040 1.00 10.38 C ATOM 0 H MET A 168 -1.703 -14.669 -17.311 1.00 11.01 H new ATOM 0 HA MET A 168 0.234 -15.357 -18.124 1.00 11.55 H new ATOM 0 HB2 MET A 168 0.893 -12.389 -18.256 1.00 11.57 H new ATOM 0 HB3 MET A 168 1.531 -13.653 -19.289 1.00 11.57 H new ATOM 0 HG2 MET A 168 -0.468 -13.889 -20.482 1.00 11.64 H new ATOM 0 HG3 MET A 168 -1.449 -13.246 -19.181 1.00 11.64 H new ATOM 0 HE1 MET A 168 -1.335 -9.622 -19.282 1.00 10.38 H new ATOM 0 HE2 MET A 168 -1.103 -11.037 -18.227 1.00 10.38 H new ATOM 0 HE3 MET A 168 0.299 -10.062 -18.731 1.00 10.38 H new ATOM 2499 N GLN A 169 1.568 -15.614 -15.987 1.00 12.22 N ATOM 2500 CA GLN A 169 2.656 -15.849 -15.052 1.00 12.70 C ATOM 2501 C GLN A 169 3.980 -15.982 -15.807 1.00 12.99 C ATOM 2502 O GLN A 169 4.159 -16.874 -16.638 1.00 13.33 O ATOM 2503 CB GLN A 169 2.378 -17.098 -14.203 1.00 13.10 C ATOM 2504 CG GLN A 169 2.146 -18.364 -15.015 1.00 13.81 C ATOM 2505 CD GLN A 169 1.732 -19.551 -14.165 1.00 14.46 C ATOM 2506 OE1 GLN A 169 2.163 -19.578 -12.914 1.00 14.64 O flip ATOM 2507 NE2 GLN A 169 1.018 -20.438 -14.631 1.00 14.99 N flip ATOM 0 H GLN A 169 0.910 -16.389 -16.076 1.00 12.22 H new ATOM 0 HA GLN A 169 2.730 -14.996 -14.378 1.00 12.70 H new ATOM 0 HB2 GLN A 169 3.219 -17.261 -13.529 1.00 13.10 H new ATOM 0 HB3 GLN A 169 1.503 -16.913 -13.581 1.00 13.10 H new ATOM 0 HG2 GLN A 169 1.375 -18.173 -15.761 1.00 13.81 H new ATOM 0 HG3 GLN A 169 3.059 -18.613 -15.556 1.00 13.81 H new ATOM 0 HE21 GLN A 169 0.705 -20.384 -15.600 1.00 14.99 H new ATOM 0 HE22 GLN A 169 0.739 -21.227 -14.048 1.00 14.99 H new ATOM 2516 N GLU A 170 4.897 -15.070 -15.543 1.00 13.03 N ATOM 2517 CA GLU A 170 6.191 -15.095 -16.193 1.00 13.47 C ATOM 2518 C GLU A 170 7.244 -15.602 -15.226 1.00 13.57 C ATOM 2519 O GLU A 170 7.785 -14.845 -14.420 1.00 13.95 O ATOM 2520 CB GLU A 170 6.569 -13.714 -16.726 1.00 14.04 C ATOM 2521 CG GLU A 170 5.601 -13.185 -17.771 1.00 14.40 C ATOM 2522 CD GLU A 170 6.074 -11.894 -18.398 1.00 14.65 C ATOM 2523 OE1 GLU A 170 6.864 -11.946 -19.361 1.00 15.01 O1- ATOM 2524 OE2 GLU A 170 5.653 -10.815 -17.932 1.00 14.64 O ATOM 0 H GLU A 170 4.768 -14.303 -14.883 1.00 13.03 H new ATOM 0 HA GLU A 170 6.135 -15.773 -17.045 1.00 13.47 H new ATOM 0 HB2 GLU A 170 6.614 -13.011 -15.894 1.00 14.04 H new ATOM 0 HB3 GLU A 170 7.569 -13.760 -17.158 1.00 14.04 H new ATOM 0 HG2 GLU A 170 5.467 -13.936 -18.550 1.00 14.40 H new ATOM 0 HG3 GLU A 170 4.626 -13.026 -17.311 1.00 14.40 H new ATOM 2531 N THR A 171 7.504 -16.893 -15.297 1.00 13.39 N ATOM 2532 CA THR A 171 8.475 -17.530 -14.427 1.00 13.67 C ATOM 2533 C THR A 171 9.904 -17.177 -14.845 1.00 13.64 C ATOM 2534 O THR A 171 10.552 -17.911 -15.598 1.00 13.80 O ATOM 2535 CB THR A 171 8.277 -19.055 -14.419 1.00 13.90 C ATOM 2536 OG1 THR A 171 8.303 -19.564 -15.756 1.00 13.68 O ATOM 2537 CG2 THR A 171 6.951 -19.421 -13.772 1.00 14.25 C ATOM 0 H THR A 171 7.051 -17.527 -15.955 1.00 13.39 H new ATOM 0 HA THR A 171 8.317 -17.155 -13.416 1.00 13.67 H new ATOM 0 HB THR A 171 9.090 -19.498 -13.843 1.00 13.90 H new ATOM 0 HG1 THR A 171 9.088 -19.212 -16.225 1.00 13.68 H new ATOM 0 HG21 THR A 171 6.831 -20.504 -13.777 1.00 14.25 H new ATOM 0 HG22 THR A 171 6.935 -19.059 -12.744 1.00 14.25 H new ATOM 0 HG23 THR A 171 6.135 -18.963 -14.331 1.00 14.25 H new ATOM 2545 N THR A 172 10.378 -16.035 -14.376 1.00 13.61 N ATOM 2546 CA THR A 172 11.719 -15.589 -14.668 1.00 13.78 C ATOM 2547 C THR A 172 12.667 -15.991 -13.540 1.00 14.39 C ATOM 2548 O THR A 172 13.461 -16.927 -13.685 1.00 14.89 O ATOM 2549 CB THR A 172 11.753 -14.063 -14.856 1.00 13.53 C ATOM 2550 OG1 THR A 172 10.710 -13.659 -15.756 1.00 13.57 O ATOM 2551 CG2 THR A 172 13.096 -13.617 -15.397 1.00 13.88 C ATOM 0 H THR A 172 9.843 -15.398 -13.786 1.00 13.61 H new ATOM 0 HA THR A 172 12.043 -16.064 -15.594 1.00 13.78 H new ATOM 0 HB THR A 172 11.598 -13.594 -13.885 1.00 13.53 H new ATOM 0 HG1 THR A 172 10.735 -12.686 -15.871 1.00 13.57 H new ATOM 0 HG21 THR A 172 13.097 -12.534 -15.522 1.00 13.88 H new ATOM 0 HG22 THR A 172 13.883 -13.902 -14.698 1.00 13.88 H new ATOM 0 HG23 THR A 172 13.276 -14.093 -16.361 1.00 13.88 H new ATOM 2559 N SER A 173 12.567 -15.295 -12.415 1.00 14.50 N ATOM 2560 CA SER A 173 13.376 -15.590 -11.243 1.00 15.21 C ATOM 2561 C SER A 173 12.698 -15.043 -9.992 1.00 15.64 C ATOM 2562 O SER A 173 12.231 -13.902 -9.966 1.00 15.85 O ATOM 2563 CB SER A 173 14.783 -14.993 -11.375 1.00 15.46 C ATOM 2564 OG SER A 173 15.445 -15.487 -12.530 1.00 15.55 O ATOM 0 H SER A 173 11.924 -14.513 -12.291 1.00 14.50 H new ATOM 0 HA SER A 173 13.472 -16.673 -11.162 1.00 15.21 H new ATOM 0 HB2 SER A 173 14.716 -13.906 -11.428 1.00 15.46 H new ATOM 0 HB3 SER A 173 15.368 -15.233 -10.487 1.00 15.46 H new ATOM 0 HG SER A 173 16.339 -15.089 -12.590 1.00 15.55 H new ATOM 2570 N GLY A 174 12.654 -15.881 -8.959 1.00 15.94 N ATOM 2571 CA GLY A 174 12.188 -15.456 -7.654 1.00 16.51 C ATOM 2572 C GLY A 174 10.686 -15.308 -7.574 1.00 16.95 C ATOM 2573 O GLY A 174 10.183 -14.656 -6.657 1.00 17.54 O ATOM 0 H GLY A 174 12.938 -16.860 -9.007 1.00 15.94 H new ATOM 0 HA2 GLY A 174 12.515 -16.178 -6.906 1.00 16.51 H new ATOM 0 HA3 GLY A 174 12.654 -14.503 -7.402 1.00 16.51 H new ATOM 2577 N LEU A 175 9.976 -15.946 -8.507 1.00 16.81 N ATOM 2578 CA LEU A 175 8.529 -15.799 -8.639 1.00 17.34 C ATOM 2579 C LEU A 175 8.172 -14.353 -8.980 1.00 17.70 C ATOM 2580 O LEU A 175 9.014 -13.622 -9.507 1.00 17.85 O ATOM 2581 CB LEU A 175 7.813 -16.253 -7.361 1.00 17.29 C ATOM 2582 CG LEU A 175 7.608 -17.765 -7.202 1.00 17.29 C ATOM 2583 CD1 LEU A 175 8.933 -18.480 -6.981 1.00 17.42 C ATOM 2584 CD2 LEU A 175 6.651 -18.050 -6.058 1.00 17.14 C ATOM 0 H LEU A 175 10.390 -16.579 -9.191 1.00 16.81 H new ATOM 0 HA LEU A 175 8.191 -16.439 -9.454 1.00 17.34 H new ATOM 0 HB2 LEU A 175 8.380 -15.892 -6.503 1.00 17.29 H new ATOM 0 HB3 LEU A 175 6.837 -15.769 -7.324 1.00 17.29 H new ATOM 0 HG LEU A 175 7.173 -18.146 -8.126 1.00 17.29 H new ATOM 0 HD11 LEU A 175 8.755 -19.550 -6.872 1.00 17.42 H new ATOM 0 HD12 LEU A 175 9.587 -18.306 -7.835 1.00 17.42 H new ATOM 0 HD13 LEU A 175 9.407 -18.097 -6.077 1.00 17.42 H new ATOM 0 HD21 LEU A 175 6.515 -19.127 -5.957 1.00 17.14 H new ATOM 0 HD22 LEU A 175 7.061 -17.648 -5.132 1.00 17.14 H new ATOM 0 HD23 LEU A 175 5.689 -17.581 -6.263 1.00 17.14 H new ATOM 2596 N GLU A 176 6.939 -13.942 -8.721 1.00 17.97 N ATOM 2597 CA GLU A 176 6.567 -12.551 -8.938 1.00 18.46 C ATOM 2598 C GLU A 176 7.348 -11.661 -7.979 1.00 18.48 C ATOM 2599 O GLU A 176 7.232 -11.799 -6.761 1.00 18.35 O ATOM 2600 CB GLU A 176 5.064 -12.314 -8.755 1.00 18.91 C ATOM 2601 CG GLU A 176 4.172 -13.341 -9.443 1.00 19.00 C ATOM 2602 CD GLU A 176 3.977 -14.592 -8.610 1.00 19.35 C ATOM 2603 OE1 GLU A 176 3.095 -14.600 -7.727 1.00 19.67 O ATOM 2604 OE2 GLU A 176 4.701 -15.580 -8.846 1.00 19.40 O1- ATOM 0 H GLU A 176 6.191 -14.539 -8.367 1.00 17.97 H new ATOM 0 HA GLU A 176 6.812 -12.302 -9.971 1.00 18.46 H new ATOM 0 HB2 GLU A 176 4.837 -12.311 -7.689 1.00 18.91 H new ATOM 0 HB3 GLU A 176 4.816 -11.323 -9.136 1.00 18.91 H new ATOM 0 HG2 GLU A 176 3.201 -12.892 -9.651 1.00 19.00 H new ATOM 0 HG3 GLU A 176 4.610 -13.613 -10.403 1.00 19.00 H new ATOM 2611 N VAL A 177 8.140 -10.753 -8.518 1.00 18.75 N ATOM 2612 CA VAL A 177 8.985 -9.912 -7.690 1.00 18.92 C ATOM 2613 C VAL A 177 8.943 -8.460 -8.161 1.00 19.38 C ATOM 2614 O VAL A 177 8.808 -8.177 -9.354 1.00 19.52 O ATOM 2615 CB VAL A 177 10.446 -10.429 -7.696 1.00 18.88 C ATOM 2616 CG1 VAL A 177 11.059 -10.336 -9.087 1.00 19.38 C ATOM 2617 CG2 VAL A 177 11.297 -9.681 -6.678 1.00 18.51 C ATOM 0 H VAL A 177 8.216 -10.579 -9.520 1.00 18.75 H new ATOM 0 HA VAL A 177 8.601 -9.956 -6.671 1.00 18.92 H new ATOM 0 HB VAL A 177 10.424 -11.481 -7.410 1.00 18.88 H new ATOM 0 HG11 VAL A 177 12.084 -10.706 -9.058 1.00 19.38 H new ATOM 0 HG12 VAL A 177 10.475 -10.938 -9.783 1.00 19.38 H new ATOM 0 HG13 VAL A 177 11.057 -9.297 -9.417 1.00 19.38 H new ATOM 0 HG21 VAL A 177 12.317 -10.065 -6.704 1.00 18.51 H new ATOM 0 HG22 VAL A 177 11.303 -8.618 -6.919 1.00 18.51 H new ATOM 0 HG23 VAL A 177 10.881 -9.824 -5.681 1.00 18.51 H new ATOM 2627 N LEU A 178 9.005 -7.544 -7.209 1.00 19.73 N ATOM 2628 CA LEU A 178 9.164 -6.133 -7.512 1.00 20.29 C ATOM 2629 C LEU A 178 10.649 -5.823 -7.594 1.00 20.67 C ATOM 2630 O LEU A 178 11.216 -5.708 -8.683 1.00 20.64 O ATOM 2631 CB LEU A 178 8.504 -5.275 -6.428 1.00 20.68 C ATOM 2632 CG LEU A 178 7.003 -5.495 -6.241 1.00 20.91 C ATOM 2633 CD1 LEU A 178 6.515 -4.773 -4.997 1.00 20.95 C ATOM 2634 CD2 LEU A 178 6.236 -5.018 -7.466 1.00 21.15 C ATOM 0 H LEU A 178 8.947 -7.755 -6.213 1.00 19.73 H new ATOM 0 HA LEU A 178 8.682 -5.904 -8.463 1.00 20.29 H new ATOM 0 HB2 LEU A 178 9.004 -5.471 -5.479 1.00 20.68 H new ATOM 0 HB3 LEU A 178 8.673 -4.225 -6.667 1.00 20.68 H new ATOM 0 HG LEU A 178 6.824 -6.563 -6.117 1.00 20.91 H new ATOM 0 HD11 LEU A 178 5.444 -4.939 -4.877 1.00 20.95 H new ATOM 0 HD12 LEU A 178 7.042 -5.157 -4.123 1.00 20.95 H new ATOM 0 HD13 LEU A 178 6.708 -3.705 -5.097 1.00 20.95 H new ATOM 0 HD21 LEU A 178 5.169 -5.183 -7.314 1.00 21.15 H new ATOM 0 HD22 LEU A 178 6.421 -3.955 -7.620 1.00 21.15 H new ATOM 0 HD23 LEU A 178 6.568 -5.574 -8.343 1.00 21.15 H new ATOM 2646 N PHE A 179 11.270 -5.736 -6.426 1.00 21.16 N ATOM 2647 CA PHE A 179 12.704 -5.550 -6.298 1.00 21.69 C ATOM 2648 C PHE A 179 13.041 -5.488 -4.815 1.00 22.01 C ATOM 2649 O PHE A 179 12.351 -4.808 -4.053 1.00 22.11 O ATOM 2650 CB PHE A 179 13.169 -4.268 -7.001 1.00 22.17 C ATOM 2651 CG PHE A 179 14.566 -4.368 -7.539 1.00 22.45 C ATOM 2652 CD1 PHE A 179 15.657 -4.036 -6.754 1.00 22.88 C ATOM 2653 CD2 PHE A 179 14.786 -4.808 -8.834 1.00 22.38 C ATOM 2654 CE1 PHE A 179 16.942 -4.143 -7.250 1.00 23.25 C ATOM 2655 CE2 PHE A 179 16.066 -4.914 -9.336 1.00 22.75 C ATOM 2656 CZ PHE A 179 17.147 -4.582 -8.544 1.00 23.19 C ATOM 0 H PHE A 179 10.784 -5.794 -5.531 1.00 21.16 H new ATOM 0 HA PHE A 179 13.220 -6.383 -6.775 1.00 21.69 H new ATOM 0 HB2 PHE A 179 12.486 -4.041 -7.819 1.00 22.17 H new ATOM 0 HB3 PHE A 179 13.114 -3.435 -6.300 1.00 22.17 H new ATOM 0 HD1 PHE A 179 15.502 -3.690 -5.743 1.00 22.88 H new ATOM 0 HD2 PHE A 179 13.945 -5.071 -9.458 1.00 22.38 H new ATOM 0 HE1 PHE A 179 17.785 -3.884 -6.627 1.00 23.25 H new ATOM 0 HE2 PHE A 179 16.223 -5.257 -10.348 1.00 22.75 H new ATOM 0 HZ PHE A 179 18.150 -4.665 -8.935 1.00 23.19 H new ATOM 2666 N GLN A 180 14.065 -6.215 -4.397 1.00 22.29 N ATOM 2667 CA GLN A 180 14.401 -6.284 -2.982 1.00 22.74 C ATOM 2668 C GLN A 180 15.208 -5.062 -2.548 1.00 22.89 C ATOM 2669 O GLN A 180 16.455 -5.094 -2.620 1.00 22.88 O ATOM 2670 CB GLN A 180 15.136 -7.592 -2.650 1.00 23.08 C ATOM 2671 CG GLN A 180 16.304 -7.911 -3.569 1.00 23.17 C ATOM 2672 CD GLN A 180 17.021 -9.185 -3.166 1.00 23.36 C ATOM 2673 OE1 GLN A 180 16.681 -10.278 -3.627 1.00 23.45 O ATOM 2674 NE2 GLN A 180 18.008 -9.055 -2.298 1.00 23.52 N ATOM 2675 OXT GLN A 180 14.582 -4.067 -2.131 1.00 23.12 O ATOM 0 H GLN A 180 14.672 -6.760 -5.009 1.00 22.29 H new ATOM 0 HA GLN A 180 13.470 -6.280 -2.416 1.00 22.74 H new ATOM 0 HB2 GLN A 180 15.502 -7.538 -1.625 1.00 23.08 H new ATOM 0 HB3 GLN A 180 14.423 -8.415 -2.691 1.00 23.08 H new ATOM 0 HG2 GLN A 180 15.942 -8.008 -4.593 1.00 23.17 H new ATOM 0 HG3 GLN A 180 17.010 -7.080 -3.558 1.00 23.17 H new ATOM 0 HE21 GLN A 180 18.256 -8.132 -1.942 1.00 23.52 H new ATOM 0 HE22 GLN A 180 18.522 -9.878 -1.983 1.00 23.52 H new TER 2684 GLN A 180 HETATM 2685 AG AG A 200 -21.823 -6.523 10.966 1.00 9.75 AG