USER MOD reduce.3.24.130724 H: found=0, std=0, add=778, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 776 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 61 ASN : amide:sc= -0.258 K(o=0.28,f=-0.24) USER MOD Set 1.2: A 63 SER OG : rot 35:sc= 0.534 USER MOD Set 2.1: A 37 GLN :FLIP amide:sc= -2.44! C(o=-6.4!,f=-5.2!) USER MOD Set 2.2: A 49 GLN : amide:sc= -2.52 K(o=-5.2,f=-9!) USER MOD Set 2.3: A 53 CYS SG : rot 180:sc= -0.28 USER MOD Single : A 1 GLY N :NH3+ -93:sc= 0.0223 (180deg=0) USER MOD Single : A 2 SER OG : rot 30:sc= 0.016 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= -0.054 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 ASN : amide:sc= -0.568 X(o=-0.57,f=-0.57) USER MOD Single : A 17 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 TYR OH : rot -169:sc= 1.26 USER MOD Single : A 27 GLN :FLIP amide:sc= 0 F(o=-0.69,f=0) USER MOD Single : A 28 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 30 MET CE :methyl -106:sc= -1.49 (180deg=-4.14!) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 LYS NZ :NH3+ -119:sc= -1.04 (180deg=-2.11!) USER MOD Single : A 36 SER OG : rot 180:sc= -0.0398 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 ASN : amide:sc= -0.203 K(o=-0.2,f=-1.8!) USER MOD Single : A 47 LYS NZ :NH3+ 149:sc= 0.0624 (180deg=0) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 59 LYS NZ :NH3+ 171:sc= 0.806 (180deg=0.75) USER MOD Single : A 66 ASN : amide:sc= -2.96! C(o=-3!,f=-5.1!) USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 ASN :FLIP amide:sc= -1.07 F(o=-1.6,f=-1.1) USER MOD Single : A 74 CYS SG : rot 180:sc= 0 USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 ASN : amide:sc= -0.514 X(o=-0.51,f=-0.69) USER MOD Single : A 84 GLN : amide:sc= -2.82 K(o=-2.8,f=-7.4!) USER MOD Single : A 85 HIS : no HD1:sc= -4.63! C(o=-4.6!,f=-5.4!) USER MOD Single : A 91 TYR OH : rot 89:sc= 1.15 USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot 17:sc= 0.162 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -6.468 12.902 -4.401 1.00 0.00 N ATOM 2 CA GLY A 1 -7.711 13.301 -5.035 1.00 0.00 C ATOM 3 C GLY A 1 -8.814 13.569 -4.031 1.00 0.00 C ATOM 4 O GLY A 1 -8.846 12.967 -2.958 1.00 0.00 O ATOM 0 H1 GLY A 1 -5.874 13.741 -4.244 1.00 0.00 H new ATOM 0 H2 GLY A 1 -6.674 12.448 -3.488 1.00 0.00 H new ATOM 0 H3 GLY A 1 -5.964 12.231 -5.016 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -7.540 14.198 -5.630 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -8.032 12.519 -5.723 1.00 0.00 H new ATOM 8 N SER A 2 -9.720 14.478 -4.378 1.00 0.00 N ATOM 9 CA SER A 2 -10.827 14.829 -3.496 1.00 0.00 C ATOM 10 C SER A 2 -12.163 14.702 -4.223 1.00 0.00 C ATOM 11 O SER A 2 -12.315 15.169 -5.352 1.00 0.00 O ATOM 12 CB SER A 2 -10.654 16.255 -2.970 1.00 0.00 C ATOM 13 OG SER A 2 -10.607 17.190 -4.034 1.00 0.00 O ATOM 0 H SER A 2 -9.709 14.984 -5.263 1.00 0.00 H new ATOM 0 HA SER A 2 -10.823 14.135 -2.655 1.00 0.00 H new ATOM 0 HB2 SER A 2 -11.479 16.502 -2.301 1.00 0.00 H new ATOM 0 HB3 SER A 2 -9.738 16.321 -2.383 1.00 0.00 H new ATOM 0 HG SER A 2 -11.142 16.858 -4.785 1.00 0.00 H new ATOM 19 N SER A 3 -13.128 14.065 -3.568 1.00 0.00 N ATOM 20 CA SER A 3 -14.450 13.872 -4.152 1.00 0.00 C ATOM 21 C SER A 3 -15.260 15.164 -4.102 1.00 0.00 C ATOM 22 O SER A 3 -15.065 15.999 -3.220 1.00 0.00 O ATOM 23 CB SER A 3 -15.198 12.759 -3.415 1.00 0.00 C ATOM 24 OG SER A 3 -14.915 11.492 -3.983 1.00 0.00 O ATOM 0 H SER A 3 -13.019 13.674 -2.632 1.00 0.00 H new ATOM 0 HA SER A 3 -14.321 13.585 -5.196 1.00 0.00 H new ATOM 0 HB2 SER A 3 -14.914 12.761 -2.363 1.00 0.00 H new ATOM 0 HB3 SER A 3 -16.271 12.948 -3.456 1.00 0.00 H new ATOM 0 HG SER A 3 -15.403 10.798 -3.493 1.00 0.00 H new ATOM 30 N GLY A 4 -16.170 15.321 -5.059 1.00 0.00 N ATOM 31 CA GLY A 4 -16.996 16.513 -5.107 1.00 0.00 C ATOM 32 C GLY A 4 -16.654 17.409 -6.281 1.00 0.00 C ATOM 33 O GLY A 4 -17.465 17.592 -7.189 1.00 0.00 O ATOM 0 H GLY A 4 -16.350 14.645 -5.801 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -18.045 16.222 -5.169 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -16.875 17.073 -4.180 1.00 0.00 H new ATOM 37 N SER A 5 -15.449 17.970 -6.263 1.00 0.00 N ATOM 38 CA SER A 5 -15.002 18.856 -7.332 1.00 0.00 C ATOM 39 C SER A 5 -13.721 18.331 -7.973 1.00 0.00 C ATOM 40 O SER A 5 -13.131 17.359 -7.502 1.00 0.00 O ATOM 41 CB SER A 5 -14.774 20.268 -6.790 1.00 0.00 C ATOM 42 OG SER A 5 -14.602 21.198 -7.846 1.00 0.00 O ATOM 0 H SER A 5 -14.765 17.827 -5.520 1.00 0.00 H new ATOM 0 HA SER A 5 -15.781 18.888 -8.094 1.00 0.00 H new ATOM 0 HB2 SER A 5 -15.622 20.566 -6.174 1.00 0.00 H new ATOM 0 HB3 SER A 5 -13.894 20.276 -6.147 1.00 0.00 H new ATOM 0 HG SER A 5 -14.460 22.093 -7.474 1.00 0.00 H new ATOM 48 N SER A 6 -13.297 18.983 -9.051 1.00 0.00 N ATOM 49 CA SER A 6 -12.088 18.581 -9.761 1.00 0.00 C ATOM 50 C SER A 6 -11.284 19.801 -10.199 1.00 0.00 C ATOM 51 O SER A 6 -11.833 20.887 -10.382 1.00 0.00 O ATOM 52 CB SER A 6 -12.445 17.727 -10.979 1.00 0.00 C ATOM 53 OG SER A 6 -13.428 18.364 -11.777 1.00 0.00 O ATOM 0 H SER A 6 -13.772 19.792 -9.452 1.00 0.00 H new ATOM 0 HA SER A 6 -11.476 17.990 -9.079 1.00 0.00 H new ATOM 0 HB2 SER A 6 -11.550 17.545 -11.575 1.00 0.00 H new ATOM 0 HB3 SER A 6 -12.812 16.755 -10.651 1.00 0.00 H new ATOM 0 HG SER A 6 -13.638 17.799 -12.550 1.00 0.00 H new ATOM 59 N GLY A 7 -9.978 19.614 -10.365 1.00 0.00 N ATOM 60 CA GLY A 7 -9.119 20.707 -10.780 1.00 0.00 C ATOM 61 C GLY A 7 -8.265 20.350 -11.981 1.00 0.00 C ATOM 62 O GLY A 7 -8.591 19.450 -12.756 1.00 0.00 O ATOM 0 H GLY A 7 -9.500 18.725 -10.219 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -9.732 21.576 -11.019 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -8.472 20.992 -9.950 1.00 0.00 H new ATOM 66 N PRO A 8 -7.145 21.067 -12.150 1.00 0.00 N ATOM 67 CA PRO A 8 -6.220 20.839 -13.264 1.00 0.00 C ATOM 68 C PRO A 8 -5.471 19.517 -13.135 1.00 0.00 C ATOM 69 O PRO A 8 -4.722 19.308 -12.181 1.00 0.00 O ATOM 70 CB PRO A 8 -5.246 22.017 -13.163 1.00 0.00 C ATOM 71 CG PRO A 8 -5.289 22.421 -11.730 1.00 0.00 C ATOM 72 CD PRO A 8 -6.694 22.154 -11.266 1.00 0.00 C ATOM 0 HA PRO A 8 -6.741 20.779 -14.220 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -4.239 21.725 -13.462 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -5.547 22.837 -13.815 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -4.569 21.851 -11.142 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -5.033 23.474 -11.614 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -6.721 21.857 -10.218 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -7.324 23.038 -11.363 1.00 0.00 H new ATOM 80 N ILE A 9 -5.678 18.629 -14.102 1.00 0.00 N ATOM 81 CA ILE A 9 -5.021 17.328 -14.096 1.00 0.00 C ATOM 82 C ILE A 9 -3.516 17.473 -13.899 1.00 0.00 C ATOM 83 O ILE A 9 -2.817 18.022 -14.751 1.00 0.00 O ATOM 84 CB ILE A 9 -5.285 16.558 -15.404 1.00 0.00 C ATOM 85 CG1 ILE A 9 -6.788 16.373 -15.618 1.00 0.00 C ATOM 86 CG2 ILE A 9 -4.578 15.211 -15.378 1.00 0.00 C ATOM 87 CD1 ILE A 9 -7.464 15.592 -14.514 1.00 0.00 C ATOM 0 H ILE A 9 -6.295 18.787 -14.899 1.00 0.00 H new ATOM 0 HA ILE A 9 -5.441 16.766 -13.262 1.00 0.00 H new ATOM 0 HB ILE A 9 -4.888 17.139 -16.236 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -7.258 17.353 -15.699 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -6.951 15.861 -16.566 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -4.774 14.679 -16.309 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -3.505 15.366 -15.268 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -4.948 14.622 -14.539 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -8.528 15.500 -14.732 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -7.020 14.599 -14.447 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -7.332 16.113 -13.566 1.00 0.00 H new ATOM 99 N LYS A 10 -3.022 16.975 -12.771 1.00 0.00 N ATOM 100 CA LYS A 10 -1.599 17.045 -12.461 1.00 0.00 C ATOM 101 C LYS A 10 -0.774 16.340 -13.533 1.00 0.00 C ATOM 102 O LYS A 10 -1.118 15.244 -13.975 1.00 0.00 O ATOM 103 CB LYS A 10 -1.322 16.417 -11.093 1.00 0.00 C ATOM 104 CG LYS A 10 -1.405 17.405 -9.942 1.00 0.00 C ATOM 105 CD LYS A 10 -2.845 17.778 -9.632 1.00 0.00 C ATOM 106 CE LYS A 10 -3.557 16.669 -8.873 1.00 0.00 C ATOM 107 NZ LYS A 10 -5.028 16.895 -8.811 1.00 0.00 N ATOM 0 H LYS A 10 -3.587 16.518 -12.055 1.00 0.00 H new ATOM 0 HA LYS A 10 -1.309 18.095 -12.436 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -2.036 15.611 -10.921 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -0.329 15.967 -11.104 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -0.941 16.973 -9.056 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -0.841 18.304 -10.191 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -2.866 18.695 -9.043 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -3.377 17.984 -10.561 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -3.357 15.712 -9.355 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -3.156 16.606 -7.861 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -5.477 16.118 -8.286 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -5.221 17.796 -8.328 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -5.415 16.930 -9.776 1.00 0.00 H new ATOM 121 N VAL A 11 0.319 16.975 -13.945 1.00 0.00 N ATOM 122 CA VAL A 11 1.195 16.407 -14.963 1.00 0.00 C ATOM 123 C VAL A 11 1.626 14.993 -14.590 1.00 0.00 C ATOM 124 O VAL A 11 1.941 14.714 -13.433 1.00 0.00 O ATOM 125 CB VAL A 11 2.449 17.277 -15.172 1.00 0.00 C ATOM 126 CG1 VAL A 11 3.363 16.652 -16.216 1.00 0.00 C ATOM 127 CG2 VAL A 11 2.056 18.690 -15.573 1.00 0.00 C ATOM 0 H VAL A 11 0.619 17.883 -13.589 1.00 0.00 H new ATOM 0 HA VAL A 11 0.625 16.376 -15.891 1.00 0.00 H new ATOM 0 HB VAL A 11 2.995 17.330 -14.230 1.00 0.00 H new ATOM 0 HG11 VAL A 11 4.244 17.280 -16.351 1.00 0.00 H new ATOM 0 HG12 VAL A 11 3.671 15.661 -15.883 1.00 0.00 H new ATOM 0 HG13 VAL A 11 2.829 16.567 -17.163 1.00 0.00 H new ATOM 0 HG21 VAL A 11 2.954 19.291 -15.716 1.00 0.00 H new ATOM 0 HG22 VAL A 11 1.488 18.660 -16.503 1.00 0.00 H new ATOM 0 HG23 VAL A 11 1.444 19.134 -14.788 1.00 0.00 H new ATOM 137 N ASP A 12 1.638 14.105 -15.578 1.00 0.00 N ATOM 138 CA ASP A 12 2.033 12.719 -15.355 1.00 0.00 C ATOM 139 C ASP A 12 2.580 12.097 -16.636 1.00 0.00 C ATOM 140 O ASP A 12 1.968 12.200 -17.698 1.00 0.00 O ATOM 141 CB ASP A 12 0.843 11.904 -14.844 1.00 0.00 C ATOM 142 CG ASP A 12 0.642 12.049 -13.349 1.00 0.00 C ATOM 143 OD1 ASP A 12 1.426 11.450 -12.583 1.00 0.00 O ATOM 144 OD2 ASP A 12 -0.300 12.762 -12.944 1.00 0.00 O ATOM 0 H ASP A 12 1.379 14.320 -16.541 1.00 0.00 H new ATOM 0 HA ASP A 12 2.821 12.708 -14.602 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -0.061 12.223 -15.362 1.00 0.00 H new ATOM 0 HB3 ASP A 12 0.995 10.852 -15.087 1.00 0.00 H new ATOM 149 N GLY A 13 3.736 11.450 -16.527 1.00 0.00 N ATOM 150 CA GLY A 13 4.347 10.822 -17.684 1.00 0.00 C ATOM 151 C GLY A 13 3.878 9.394 -17.882 1.00 0.00 C ATOM 152 O GLY A 13 2.742 9.055 -17.553 1.00 0.00 O ATOM 0 H GLY A 13 4.261 11.349 -15.658 1.00 0.00 H new ATOM 0 HA2 GLY A 13 4.114 11.405 -18.575 1.00 0.00 H new ATOM 0 HA3 GLY A 13 5.431 10.833 -17.570 1.00 0.00 H new ATOM 156 N ALA A 14 4.756 8.555 -18.424 1.00 0.00 N ATOM 157 CA ALA A 14 4.426 7.156 -18.666 1.00 0.00 C ATOM 158 C ALA A 14 5.032 6.256 -17.594 1.00 0.00 C ATOM 159 O ALA A 14 5.537 5.174 -17.892 1.00 0.00 O ATOM 160 CB ALA A 14 4.904 6.732 -20.047 1.00 0.00 C ATOM 0 H ALA A 14 5.700 8.820 -18.703 1.00 0.00 H new ATOM 0 HA ALA A 14 3.342 7.051 -18.621 1.00 0.00 H new ATOM 0 HB1 ALA A 14 4.651 5.685 -20.214 1.00 0.00 H new ATOM 0 HB2 ALA A 14 4.419 7.348 -20.805 1.00 0.00 H new ATOM 0 HB3 ALA A 14 5.985 6.859 -20.113 1.00 0.00 H new ATOM 166 N ASN A 15 4.978 6.710 -16.347 1.00 0.00 N ATOM 167 CA ASN A 15 5.523 5.946 -15.231 1.00 0.00 C ATOM 168 C ASN A 15 4.705 6.175 -13.963 1.00 0.00 C ATOM 169 O ASN A 15 3.793 7.002 -13.942 1.00 0.00 O ATOM 170 CB ASN A 15 6.983 6.332 -14.986 1.00 0.00 C ATOM 171 CG ASN A 15 7.853 6.106 -16.207 1.00 0.00 C ATOM 172 OD1 ASN A 15 8.252 4.978 -16.499 1.00 0.00 O ATOM 173 ND2 ASN A 15 8.153 7.181 -16.926 1.00 0.00 N ATOM 0 H ASN A 15 4.562 7.603 -16.083 1.00 0.00 H new ATOM 0 HA ASN A 15 5.472 4.888 -15.489 1.00 0.00 H new ATOM 0 HB2 ASN A 15 7.035 7.381 -14.695 1.00 0.00 H new ATOM 0 HB3 ASN A 15 7.375 5.750 -14.151 1.00 0.00 H new ATOM 0 HD21 ASN A 15 8.736 7.092 -17.758 1.00 0.00 H new ATOM 0 HD22 ASN A 15 7.800 8.096 -16.646 1.00 0.00 H new ATOM 180 N ILE A 16 5.039 5.438 -12.909 1.00 0.00 N ATOM 181 CA ILE A 16 4.337 5.562 -11.638 1.00 0.00 C ATOM 182 C ILE A 16 4.856 6.752 -10.837 1.00 0.00 C ATOM 183 O ILE A 16 6.044 7.068 -10.876 1.00 0.00 O ATOM 184 CB ILE A 16 4.479 4.285 -10.789 1.00 0.00 C ATOM 185 CG1 ILE A 16 3.901 3.082 -11.537 1.00 0.00 C ATOM 186 CG2 ILE A 16 3.788 4.462 -9.445 1.00 0.00 C ATOM 187 CD1 ILE A 16 4.225 1.755 -10.889 1.00 0.00 C ATOM 0 H ILE A 16 5.791 4.749 -12.910 1.00 0.00 H new ATOM 0 HA ILE A 16 3.284 5.717 -11.873 1.00 0.00 H new ATOM 0 HB ILE A 16 5.538 4.102 -10.609 1.00 0.00 H new ATOM 0 HG12 ILE A 16 2.818 3.191 -11.602 1.00 0.00 H new ATOM 0 HG13 ILE A 16 4.283 3.081 -12.558 1.00 0.00 H new ATOM 0 HG21 ILE A 16 3.897 3.551 -8.857 1.00 0.00 H new ATOM 0 HG22 ILE A 16 4.242 5.296 -8.910 1.00 0.00 H new ATOM 0 HG23 ILE A 16 2.729 4.666 -9.604 1.00 0.00 H new ATOM 0 HD11 ILE A 16 3.784 0.947 -11.473 1.00 0.00 H new ATOM 0 HD12 ILE A 16 5.306 1.624 -10.848 1.00 0.00 H new ATOM 0 HD13 ILE A 16 3.819 1.735 -9.878 1.00 0.00 H new ATOM 199 N ASN A 17 3.956 7.406 -10.110 1.00 0.00 N ATOM 200 CA ASN A 17 4.323 8.561 -9.298 1.00 0.00 C ATOM 201 C ASN A 17 4.045 8.298 -7.821 1.00 0.00 C ATOM 202 O ASN A 17 2.894 8.300 -7.386 1.00 0.00 O ATOM 203 CB ASN A 17 3.555 9.801 -9.760 1.00 0.00 C ATOM 204 CG ASN A 17 4.313 10.594 -10.808 1.00 0.00 C ATOM 205 OD1 ASN A 17 4.404 10.185 -11.965 1.00 0.00 O ATOM 206 ND2 ASN A 17 4.861 11.734 -10.404 1.00 0.00 N ATOM 0 H ASN A 17 2.968 7.156 -10.066 1.00 0.00 H new ATOM 0 HA ASN A 17 5.392 8.736 -9.423 1.00 0.00 H new ATOM 0 HB2 ASN A 17 2.590 9.497 -10.166 1.00 0.00 H new ATOM 0 HB3 ASN A 17 3.352 10.440 -8.901 1.00 0.00 H new ATOM 0 HD21 ASN A 17 5.384 12.311 -11.063 1.00 0.00 H new ATOM 0 HD22 ASN A 17 4.759 12.033 -9.434 1.00 0.00 H new ATOM 213 N ILE A 18 5.108 8.073 -7.056 1.00 0.00 N ATOM 214 CA ILE A 18 4.979 7.810 -5.628 1.00 0.00 C ATOM 215 C ILE A 18 4.975 9.109 -4.828 1.00 0.00 C ATOM 216 O ILE A 18 5.878 9.936 -4.962 1.00 0.00 O ATOM 217 CB ILE A 18 6.117 6.908 -5.116 1.00 0.00 C ATOM 218 CG1 ILE A 18 6.313 5.715 -6.054 1.00 0.00 C ATOM 219 CG2 ILE A 18 5.822 6.434 -3.701 1.00 0.00 C ATOM 220 CD1 ILE A 18 5.119 4.789 -6.111 1.00 0.00 C ATOM 0 H ILE A 18 6.068 8.068 -7.401 1.00 0.00 H new ATOM 0 HA ILE A 18 4.028 7.296 -5.487 1.00 0.00 H new ATOM 0 HB ILE A 18 7.040 7.488 -5.098 1.00 0.00 H new ATOM 0 HG12 ILE A 18 6.525 6.083 -7.058 1.00 0.00 H new ATOM 0 HG13 ILE A 18 7.187 5.149 -5.731 1.00 0.00 H new ATOM 0 HG21 ILE A 18 6.636 5.797 -3.353 1.00 0.00 H new ATOM 0 HG22 ILE A 18 5.728 7.296 -3.041 1.00 0.00 H new ATOM 0 HG23 ILE A 18 4.890 5.868 -3.694 1.00 0.00 H new ATOM 0 HD11 ILE A 18 5.329 3.967 -6.795 1.00 0.00 H new ATOM 0 HD12 ILE A 18 4.919 4.392 -5.116 1.00 0.00 H new ATOM 0 HD13 ILE A 18 4.247 5.341 -6.463 1.00 0.00 H new ATOM 232 N THR A 19 3.954 9.281 -3.995 1.00 0.00 N ATOM 233 CA THR A 19 3.832 10.478 -3.172 1.00 0.00 C ATOM 234 C THR A 19 3.658 10.119 -1.701 1.00 0.00 C ATOM 235 O THR A 19 3.248 9.008 -1.368 1.00 0.00 O ATOM 236 CB THR A 19 2.644 11.349 -3.620 1.00 0.00 C ATOM 237 OG1 THR A 19 1.439 10.575 -3.616 1.00 0.00 O ATOM 238 CG2 THR A 19 2.883 11.916 -5.012 1.00 0.00 C ATOM 0 H THR A 19 3.199 8.606 -3.872 1.00 0.00 H new ATOM 0 HA THR A 19 4.755 11.043 -3.298 1.00 0.00 H new ATOM 0 HB THR A 19 2.545 12.178 -2.919 1.00 0.00 H new ATOM 0 HG1 THR A 19 0.688 11.137 -3.900 1.00 0.00 H new ATOM 0 HG21 THR A 19 2.030 12.528 -5.307 1.00 0.00 H new ATOM 0 HG22 THR A 19 3.784 12.529 -5.005 1.00 0.00 H new ATOM 0 HG23 THR A 19 3.006 11.098 -5.722 1.00 0.00 H new ATOM 246 N ALA A 20 3.973 11.067 -0.824 1.00 0.00 N ATOM 247 CA ALA A 20 3.848 10.850 0.612 1.00 0.00 C ATOM 248 C ALA A 20 2.509 10.208 0.956 1.00 0.00 C ATOM 249 O ALA A 20 2.423 9.376 1.859 1.00 0.00 O ATOM 250 CB ALA A 20 4.012 12.165 1.360 1.00 0.00 C ATOM 0 H ALA A 20 4.316 11.992 -1.083 1.00 0.00 H new ATOM 0 HA ALA A 20 4.639 10.167 0.921 1.00 0.00 H new ATOM 0 HB1 ALA A 20 3.916 11.989 2.431 1.00 0.00 H new ATOM 0 HB2 ALA A 20 4.996 12.584 1.148 1.00 0.00 H new ATOM 0 HB3 ALA A 20 3.242 12.866 1.038 1.00 0.00 H new ATOM 256 N ALA A 21 1.466 10.599 0.231 1.00 0.00 N ATOM 257 CA ALA A 21 0.131 10.060 0.460 1.00 0.00 C ATOM 258 C ALA A 21 0.166 8.540 0.577 1.00 0.00 C ATOM 259 O ALA A 21 -0.597 7.950 1.342 1.00 0.00 O ATOM 260 CB ALA A 21 -0.808 10.483 -0.660 1.00 0.00 C ATOM 0 H ALA A 21 1.520 11.287 -0.520 1.00 0.00 H new ATOM 0 HA ALA A 21 -0.240 10.463 1.402 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -1.801 10.074 -0.476 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -0.865 11.571 -0.696 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -0.431 10.108 -1.612 1.00 0.00 H new ATOM 266 N ILE A 22 1.055 7.912 -0.186 1.00 0.00 N ATOM 267 CA ILE A 22 1.189 6.461 -0.166 1.00 0.00 C ATOM 268 C ILE A 22 1.085 5.919 1.256 1.00 0.00 C ATOM 269 O ILE A 22 0.498 4.861 1.487 1.00 0.00 O ATOM 270 CB ILE A 22 2.528 6.011 -0.779 1.00 0.00 C ATOM 271 CG1 ILE A 22 2.520 4.500 -1.022 1.00 0.00 C ATOM 272 CG2 ILE A 22 3.684 6.400 0.130 1.00 0.00 C ATOM 273 CD1 ILE A 22 3.437 4.064 -2.143 1.00 0.00 C ATOM 0 H ILE A 22 1.693 8.386 -0.826 1.00 0.00 H new ATOM 0 HA ILE A 22 0.372 6.060 -0.766 1.00 0.00 H new ATOM 0 HB ILE A 22 2.659 6.514 -1.737 1.00 0.00 H new ATOM 0 HG12 ILE A 22 2.814 3.991 -0.104 1.00 0.00 H new ATOM 0 HG13 ILE A 22 1.503 4.182 -1.251 1.00 0.00 H new ATOM 0 HG21 ILE A 22 4.624 6.075 -0.317 1.00 0.00 H new ATOM 0 HG22 ILE A 22 3.698 7.482 0.258 1.00 0.00 H new ATOM 0 HG23 ILE A 22 3.560 5.922 1.101 1.00 0.00 H new ATOM 0 HD11 ILE A 22 3.381 2.982 -2.259 1.00 0.00 H new ATOM 0 HD12 ILE A 22 3.130 4.545 -3.072 1.00 0.00 H new ATOM 0 HD13 ILE A 22 4.462 4.351 -1.907 1.00 0.00 H new ATOM 285 N TYR A 23 1.657 6.650 2.205 1.00 0.00 N ATOM 286 CA TYR A 23 1.630 6.243 3.605 1.00 0.00 C ATOM 287 C TYR A 23 0.207 6.273 4.153 1.00 0.00 C ATOM 288 O TYR A 23 -0.251 5.314 4.774 1.00 0.00 O ATOM 289 CB TYR A 23 2.530 7.155 4.441 1.00 0.00 C ATOM 290 CG TYR A 23 3.989 7.089 4.049 1.00 0.00 C ATOM 291 CD1 TYR A 23 4.694 5.894 4.116 1.00 0.00 C ATOM 292 CD2 TYR A 23 4.662 8.224 3.612 1.00 0.00 C ATOM 293 CE1 TYR A 23 6.027 5.830 3.760 1.00 0.00 C ATOM 294 CE2 TYR A 23 5.995 8.169 3.252 1.00 0.00 C ATOM 295 CZ TYR A 23 6.673 6.970 3.328 1.00 0.00 C ATOM 296 OH TYR A 23 8.001 6.911 2.971 1.00 0.00 O ATOM 0 H TYR A 23 2.146 7.528 2.031 1.00 0.00 H new ATOM 0 HA TYR A 23 2.003 5.221 3.667 1.00 0.00 H new ATOM 0 HB2 TYR A 23 2.182 8.183 4.343 1.00 0.00 H new ATOM 0 HB3 TYR A 23 2.432 6.884 5.492 1.00 0.00 H new ATOM 0 HD1 TYR A 23 4.191 4.999 4.452 1.00 0.00 H new ATOM 0 HD2 TYR A 23 4.134 9.164 3.553 1.00 0.00 H new ATOM 0 HE1 TYR A 23 6.561 4.893 3.819 1.00 0.00 H new ATOM 0 HE2 TYR A 23 6.503 9.060 2.913 1.00 0.00 H new ATOM 0 HH TYR A 23 8.350 7.820 2.859 1.00 0.00 H new ATOM 306 N ASP A 24 -0.487 7.381 3.919 1.00 0.00 N ATOM 307 CA ASP A 24 -1.860 7.537 4.387 1.00 0.00 C ATOM 308 C ASP A 24 -2.759 6.451 3.806 1.00 0.00 C ATOM 309 O ASP A 24 -3.589 5.877 4.510 1.00 0.00 O ATOM 310 CB ASP A 24 -2.397 8.918 4.007 1.00 0.00 C ATOM 311 CG ASP A 24 -2.109 9.962 5.068 1.00 0.00 C ATOM 312 OD1 ASP A 24 -0.925 10.311 5.251 1.00 0.00 O ATOM 313 OD2 ASP A 24 -3.069 10.430 5.716 1.00 0.00 O ATOM 0 H ASP A 24 -0.122 8.185 3.408 1.00 0.00 H new ATOM 0 HA ASP A 24 -1.861 7.441 5.473 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -1.951 9.231 3.063 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -3.473 8.855 3.846 1.00 0.00 H new ATOM 318 N GLU A 25 -2.588 6.175 2.516 1.00 0.00 N ATOM 319 CA GLU A 25 -3.387 5.159 1.841 1.00 0.00 C ATOM 320 C GLU A 25 -3.219 3.799 2.514 1.00 0.00 C ATOM 321 O GLU A 25 -4.180 3.042 2.655 1.00 0.00 O ATOM 322 CB GLU A 25 -2.989 5.063 0.366 1.00 0.00 C ATOM 323 CG GLU A 25 -3.071 6.387 -0.373 1.00 0.00 C ATOM 324 CD GLU A 25 -3.388 6.214 -1.846 1.00 0.00 C ATOM 325 OE1 GLU A 25 -2.479 5.824 -2.608 1.00 0.00 O ATOM 326 OE2 GLU A 25 -4.547 6.470 -2.237 1.00 0.00 O ATOM 0 H GLU A 25 -1.904 6.640 1.919 1.00 0.00 H new ATOM 0 HA GLU A 25 -4.435 5.452 1.909 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -1.971 4.681 0.297 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -3.636 4.339 -0.130 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -3.837 7.010 0.089 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -2.124 6.916 -0.269 1.00 0.00 H new ATOM 333 N ILE A 26 -1.993 3.497 2.926 1.00 0.00 N ATOM 334 CA ILE A 26 -1.700 2.230 3.584 1.00 0.00 C ATOM 335 C ILE A 26 -2.484 2.091 4.884 1.00 0.00 C ATOM 336 O ILE A 26 -3.016 1.024 5.188 1.00 0.00 O ATOM 337 CB ILE A 26 -0.196 2.088 3.887 1.00 0.00 C ATOM 338 CG1 ILE A 26 0.606 2.037 2.586 1.00 0.00 C ATOM 339 CG2 ILE A 26 0.060 0.844 4.724 1.00 0.00 C ATOM 340 CD1 ILE A 26 2.029 2.529 2.733 1.00 0.00 C ATOM 0 H ILE A 26 -1.187 4.112 2.816 1.00 0.00 H new ATOM 0 HA ILE A 26 -2.000 1.440 2.896 1.00 0.00 H new ATOM 0 HB ILE A 26 0.129 2.958 4.457 1.00 0.00 H new ATOM 0 HG12 ILE A 26 0.621 1.011 2.218 1.00 0.00 H new ATOM 0 HG13 ILE A 26 0.098 2.639 1.832 1.00 0.00 H new ATOM 0 HG21 ILE A 26 1.127 0.757 4.930 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -0.486 0.919 5.664 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -0.277 -0.037 4.178 1.00 0.00 H new ATOM 0 HD11 ILE A 26 2.538 2.464 1.771 1.00 0.00 H new ATOM 0 HD12 ILE A 26 2.023 3.565 3.071 1.00 0.00 H new ATOM 0 HD13 ILE A 26 2.554 1.913 3.463 1.00 0.00 H new ATOM 352 N GLN A 27 -2.552 3.178 5.647 1.00 0.00 N ATOM 353 CA GLN A 27 -3.273 3.177 6.914 1.00 0.00 C ATOM 354 C GLN A 27 -4.747 2.845 6.702 1.00 0.00 C ATOM 355 O GLN A 27 -5.275 1.910 7.304 1.00 0.00 O ATOM 356 CB GLN A 27 -3.139 4.536 7.603 1.00 0.00 C ATOM 357 CG GLN A 27 -1.697 4.957 7.842 1.00 0.00 C ATOM 358 CD GLN A 27 -1.579 6.098 8.833 1.00 0.00 C ATOM 359 OE1 GLN A 27 -1.704 7.325 8.341 1.00 0.00 O flip ATOM 360 NE2 GLN A 27 -1.378 5.879 10.028 1.00 0.00 N flip ATOM 0 H GLN A 27 -2.117 4.069 5.410 1.00 0.00 H new ATOM 0 HA GLN A 27 -2.834 2.409 7.551 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -3.634 5.293 6.995 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -3.662 4.503 8.559 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -1.129 4.102 8.209 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -1.248 5.256 6.895 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -1.288 4.920 10.363 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -1.301 6.657 10.683 1.00 0.00 H new ATOM 369 N GLN A 28 -5.405 3.618 5.844 1.00 0.00 N ATOM 370 CA GLN A 28 -6.818 3.406 5.553 1.00 0.00 C ATOM 371 C GLN A 28 -7.041 2.046 4.901 1.00 0.00 C ATOM 372 O GLN A 28 -7.884 1.266 5.344 1.00 0.00 O ATOM 373 CB GLN A 28 -7.345 4.515 4.642 1.00 0.00 C ATOM 374 CG GLN A 28 -7.123 5.914 5.194 1.00 0.00 C ATOM 375 CD GLN A 28 -7.687 6.994 4.292 1.00 0.00 C ATOM 376 OE1 GLN A 28 -8.884 7.015 4.003 1.00 0.00 O ATOM 377 NE2 GLN A 28 -6.826 7.899 3.842 1.00 0.00 N ATOM 0 H GLN A 28 -4.982 4.397 5.338 1.00 0.00 H new ATOM 0 HA GLN A 28 -7.365 3.430 6.496 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -6.859 4.436 3.669 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -8.412 4.363 4.479 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -7.586 5.990 6.178 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -6.055 6.081 5.330 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -5.843 7.843 4.107 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -7.148 8.650 3.231 1.00 0.00 H new ATOM 386 N GLU A 29 -6.281 1.768 3.846 1.00 0.00 N ATOM 387 CA GLU A 29 -6.398 0.502 3.132 1.00 0.00 C ATOM 388 C GLU A 29 -6.478 -0.668 4.109 1.00 0.00 C ATOM 389 O GLU A 29 -7.170 -1.653 3.858 1.00 0.00 O ATOM 390 CB GLU A 29 -5.210 0.312 2.188 1.00 0.00 C ATOM 391 CG GLU A 29 -5.438 -0.755 1.130 1.00 0.00 C ATOM 392 CD GLU A 29 -6.524 -0.376 0.143 1.00 0.00 C ATOM 393 OE1 GLU A 29 -7.715 -0.471 0.508 1.00 0.00 O ATOM 394 OE2 GLU A 29 -6.185 0.016 -0.993 1.00 0.00 O ATOM 0 H GLU A 29 -5.578 2.402 3.467 1.00 0.00 H new ATOM 0 HA GLU A 29 -7.317 0.528 2.547 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -4.993 1.260 1.695 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -4.330 0.048 2.774 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -4.507 -0.931 0.590 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -5.706 -1.693 1.617 1.00 0.00 H new ATOM 401 N MET A 30 -5.763 -0.550 5.224 1.00 0.00 N ATOM 402 CA MET A 30 -5.753 -1.597 6.239 1.00 0.00 C ATOM 403 C MET A 30 -7.103 -1.682 6.945 1.00 0.00 C ATOM 404 O MET A 30 -7.737 -2.737 6.970 1.00 0.00 O ATOM 405 CB MET A 30 -4.645 -1.336 7.260 1.00 0.00 C ATOM 406 CG MET A 30 -3.313 -1.967 6.887 1.00 0.00 C ATOM 407 SD MET A 30 -2.083 -1.817 8.196 1.00 0.00 S ATOM 408 CE MET A 30 -1.436 -0.179 7.867 1.00 0.00 C ATOM 0 H MET A 30 -5.184 0.259 5.447 1.00 0.00 H new ATOM 0 HA MET A 30 -5.562 -2.549 5.743 1.00 0.00 H new ATOM 0 HB2 MET A 30 -4.510 -0.260 7.370 1.00 0.00 H new ATOM 0 HB3 MET A 30 -4.960 -1.719 8.231 1.00 0.00 H new ATOM 0 HG2 MET A 30 -3.467 -3.021 6.657 1.00 0.00 H new ATOM 0 HG3 MET A 30 -2.933 -1.495 5.981 1.00 0.00 H new ATOM 0 HE1 MET A 30 -0.444 -0.262 7.422 1.00 0.00 H new ATOM 0 HE2 MET A 30 -2.100 0.343 7.178 1.00 0.00 H new ATOM 0 HE3 MET A 30 -1.369 0.380 8.800 1.00 0.00 H new ATOM 418 N LYS A 31 -7.536 -0.565 7.519 1.00 0.00 N ATOM 419 CA LYS A 31 -8.810 -0.512 8.226 1.00 0.00 C ATOM 420 C LYS A 31 -9.963 -0.879 7.297 1.00 0.00 C ATOM 421 O LYS A 31 -10.991 -1.391 7.741 1.00 0.00 O ATOM 422 CB LYS A 31 -9.036 0.885 8.809 1.00 0.00 C ATOM 423 CG LYS A 31 -9.757 1.830 7.863 1.00 0.00 C ATOM 424 CD LYS A 31 -11.264 1.757 8.043 1.00 0.00 C ATOM 425 CE LYS A 31 -11.751 2.760 9.077 1.00 0.00 C ATOM 426 NZ LYS A 31 -12.054 4.083 8.466 1.00 0.00 N ATOM 0 H LYS A 31 -7.023 0.317 7.508 1.00 0.00 H new ATOM 0 HA LYS A 31 -8.776 -1.237 9.039 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -9.613 0.796 9.730 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -8.072 1.318 9.077 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -9.418 2.851 8.039 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -9.500 1.581 6.833 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -11.755 1.949 7.089 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -11.546 0.750 8.350 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -12.645 2.373 9.566 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -10.992 2.882 9.850 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -12.383 4.739 9.203 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -11.195 4.465 8.021 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -12.796 3.971 7.746 1.00 0.00 H new ATOM 440 N ARG A 32 -9.785 -0.614 6.007 1.00 0.00 N ATOM 441 CA ARG A 32 -10.810 -0.917 5.016 1.00 0.00 C ATOM 442 C ARG A 32 -10.807 -2.403 4.667 1.00 0.00 C ATOM 443 O ARG A 32 -11.862 -3.006 4.469 1.00 0.00 O ATOM 444 CB ARG A 32 -10.590 -0.085 3.752 1.00 0.00 C ATOM 445 CG ARG A 32 -11.875 0.260 3.017 1.00 0.00 C ATOM 446 CD ARG A 32 -12.474 1.562 3.524 1.00 0.00 C ATOM 447 NE ARG A 32 -13.681 1.931 2.790 1.00 0.00 N ATOM 448 CZ ARG A 32 -14.170 3.166 2.752 1.00 0.00 C ATOM 449 NH1 ARG A 32 -13.556 4.146 3.402 1.00 0.00 N ATOM 450 NH2 ARG A 32 -15.273 3.424 2.061 1.00 0.00 N ATOM 0 H ARG A 32 -8.940 -0.190 5.624 1.00 0.00 H new ATOM 0 HA ARG A 32 -11.780 -0.664 5.445 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -10.076 0.838 4.020 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -9.932 -0.632 3.077 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -11.674 0.342 1.949 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -12.596 -0.547 3.144 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -12.710 1.464 4.584 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -11.737 2.360 3.434 1.00 0.00 H new ATOM 0 HE ARG A 32 -14.176 1.201 2.278 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -12.707 3.952 3.932 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -13.933 5.093 3.371 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -15.747 2.674 1.558 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -15.647 4.373 2.033 1.00 0.00 H new ATOM 464 N ALA A 33 -9.615 -2.985 4.593 1.00 0.00 N ATOM 465 CA ALA A 33 -9.475 -4.400 4.269 1.00 0.00 C ATOM 466 C ALA A 33 -9.472 -5.254 5.532 1.00 0.00 C ATOM 467 O ALA A 33 -9.516 -6.483 5.464 1.00 0.00 O ATOM 468 CB ALA A 33 -8.203 -4.634 3.468 1.00 0.00 C ATOM 0 H ALA A 33 -8.732 -2.499 4.753 1.00 0.00 H new ATOM 0 HA ALA A 33 -10.332 -4.696 3.664 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -8.111 -5.694 3.233 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -8.245 -4.059 2.543 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -7.341 -4.316 4.054 1.00 0.00 H new ATOM 474 N LYS A 34 -9.419 -4.596 6.686 1.00 0.00 N ATOM 475 CA LYS A 34 -9.410 -5.295 7.966 1.00 0.00 C ATOM 476 C LYS A 34 -8.154 -6.148 8.111 1.00 0.00 C ATOM 477 O LYS A 34 -8.226 -7.317 8.490 1.00 0.00 O ATOM 478 CB LYS A 34 -10.655 -6.174 8.098 1.00 0.00 C ATOM 479 CG LYS A 34 -11.874 -5.614 7.386 1.00 0.00 C ATOM 480 CD LYS A 34 -12.729 -4.774 8.320 1.00 0.00 C ATOM 481 CE LYS A 34 -11.899 -3.719 9.036 1.00 0.00 C ATOM 482 NZ LYS A 34 -11.430 -4.192 10.368 1.00 0.00 N ATOM 0 H LYS A 34 -9.382 -3.579 6.761 1.00 0.00 H new ATOM 0 HA LYS A 34 -9.414 -4.548 8.760 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -10.434 -7.164 7.699 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -10.889 -6.302 9.155 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -11.555 -5.007 6.539 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -12.470 -6.433 6.984 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -13.523 -4.290 7.752 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -13.211 -5.420 9.054 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -11.039 -3.455 8.421 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -12.492 -2.813 9.161 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -11.813 -3.573 11.111 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -11.759 -5.166 10.526 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -10.391 -4.168 10.399 1.00 0.00 H new ATOM 496 N VAL A 35 -7.003 -5.556 7.809 1.00 0.00 N ATOM 497 CA VAL A 35 -5.731 -6.261 7.909 1.00 0.00 C ATOM 498 C VAL A 35 -4.793 -5.566 8.889 1.00 0.00 C ATOM 499 O VAL A 35 -5.162 -4.576 9.522 1.00 0.00 O ATOM 500 CB VAL A 35 -5.038 -6.365 6.538 1.00 0.00 C ATOM 501 CG1 VAL A 35 -5.929 -7.092 5.542 1.00 0.00 C ATOM 502 CG2 VAL A 35 -4.667 -4.982 6.023 1.00 0.00 C ATOM 0 H VAL A 35 -6.925 -4.589 7.493 1.00 0.00 H new ATOM 0 HA VAL A 35 -5.953 -7.264 8.273 1.00 0.00 H new ATOM 0 HB VAL A 35 -4.121 -6.942 6.657 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -5.422 -7.156 4.579 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -6.140 -8.097 5.908 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -6.865 -6.545 5.424 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -4.178 -5.074 5.053 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -5.569 -4.378 5.919 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -3.988 -4.502 6.727 1.00 0.00 H new ATOM 512 N SER A 36 -3.578 -6.090 9.010 1.00 0.00 N ATOM 513 CA SER A 36 -2.586 -5.522 9.916 1.00 0.00 C ATOM 514 C SER A 36 -1.349 -5.064 9.150 1.00 0.00 C ATOM 515 O SER A 36 -1.041 -5.586 8.079 1.00 0.00 O ATOM 516 CB SER A 36 -2.190 -6.547 10.980 1.00 0.00 C ATOM 517 OG SER A 36 -0.986 -6.172 11.626 1.00 0.00 O ATOM 0 H SER A 36 -3.256 -6.908 8.492 1.00 0.00 H new ATOM 0 HA SER A 36 -3.031 -4.655 10.404 1.00 0.00 H new ATOM 0 HB2 SER A 36 -2.988 -6.638 11.716 1.00 0.00 H new ATOM 0 HB3 SER A 36 -2.069 -7.527 10.518 1.00 0.00 H new ATOM 0 HG SER A 36 -0.755 -6.842 12.303 1.00 0.00 H new ATOM 523 N GLN A 37 -0.645 -4.084 9.707 1.00 0.00 N ATOM 524 CA GLN A 37 0.558 -3.554 9.076 1.00 0.00 C ATOM 525 C GLN A 37 1.453 -4.683 8.577 1.00 0.00 C ATOM 526 O GLN A 37 2.112 -4.557 7.545 1.00 0.00 O ATOM 527 CB GLN A 37 1.329 -2.672 10.059 1.00 0.00 C ATOM 528 CG GLN A 37 0.443 -1.990 11.089 1.00 0.00 C ATOM 529 CD GLN A 37 1.019 -0.674 11.574 1.00 0.00 C ATOM 530 OE1 GLN A 37 1.423 0.177 10.638 1.00 0.00 O flip ATOM 531 NE2 GLN A 37 1.100 -0.425 12.777 1.00 0.00 N flip ATOM 0 H GLN A 37 -0.887 -3.641 10.593 1.00 0.00 H new ATOM 0 HA GLN A 37 0.254 -2.951 8.220 1.00 0.00 H new ATOM 0 HB2 GLN A 37 2.070 -3.281 10.576 1.00 0.00 H new ATOM 0 HB3 GLN A 37 1.875 -1.911 9.501 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -0.542 -1.814 10.656 1.00 0.00 H new ATOM 0 HG3 GLN A 37 0.302 -2.656 11.940 1.00 0.00 H new ATOM 0 HE21 GLN A 37 0.777 -1.108 13.462 1.00 0.00 H new ATOM 0 HE22 GLN A 37 1.490 0.465 13.089 1.00 0.00 H new ATOM 540 N ALA A 38 1.472 -5.787 9.316 1.00 0.00 N ATOM 541 CA ALA A 38 2.286 -6.940 8.948 1.00 0.00 C ATOM 542 C ALA A 38 1.759 -7.600 7.678 1.00 0.00 C ATOM 543 O ALA A 38 2.530 -7.963 6.789 1.00 0.00 O ATOM 544 CB ALA A 38 2.325 -7.944 10.090 1.00 0.00 C ATOM 0 H ALA A 38 0.933 -5.908 10.173 1.00 0.00 H new ATOM 0 HA ALA A 38 3.300 -6.591 8.751 1.00 0.00 H new ATOM 0 HB1 ALA A 38 2.936 -8.799 9.802 1.00 0.00 H new ATOM 0 HB2 ALA A 38 2.754 -7.473 10.974 1.00 0.00 H new ATOM 0 HB3 ALA A 38 1.313 -8.280 10.314 1.00 0.00 H new ATOM 550 N LEU A 39 0.442 -7.753 7.600 1.00 0.00 N ATOM 551 CA LEU A 39 -0.189 -8.371 6.438 1.00 0.00 C ATOM 552 C LEU A 39 -0.053 -7.481 5.207 1.00 0.00 C ATOM 553 O LEU A 39 0.591 -7.854 4.226 1.00 0.00 O ATOM 554 CB LEU A 39 -1.666 -8.647 6.722 1.00 0.00 C ATOM 555 CG LEU A 39 -2.452 -9.319 5.595 1.00 0.00 C ATOM 556 CD1 LEU A 39 -1.724 -10.561 5.105 1.00 0.00 C ATOM 557 CD2 LEU A 39 -3.857 -9.671 6.061 1.00 0.00 C ATOM 0 H LEU A 39 -0.210 -7.458 8.327 1.00 0.00 H new ATOM 0 HA LEU A 39 0.318 -9.315 6.239 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -1.733 -9.276 7.610 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -2.152 -7.702 6.963 1.00 0.00 H new ATOM 0 HG LEU A 39 -2.532 -8.618 4.764 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -2.297 -11.026 4.303 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -0.739 -10.282 4.732 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -1.613 -11.266 5.929 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -4.402 -10.148 5.246 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -3.799 -10.355 6.908 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -4.378 -8.763 6.363 1.00 0.00 H new ATOM 569 N PHE A 40 -0.661 -6.301 5.267 1.00 0.00 N ATOM 570 CA PHE A 40 -0.607 -5.356 4.157 1.00 0.00 C ATOM 571 C PHE A 40 0.807 -5.262 3.592 1.00 0.00 C ATOM 572 O PHE A 40 0.996 -5.142 2.381 1.00 0.00 O ATOM 573 CB PHE A 40 -1.080 -3.974 4.612 1.00 0.00 C ATOM 574 CG PHE A 40 -0.911 -2.908 3.568 1.00 0.00 C ATOM 575 CD1 PHE A 40 0.351 -2.450 3.225 1.00 0.00 C ATOM 576 CD2 PHE A 40 -2.014 -2.366 2.928 1.00 0.00 C ATOM 577 CE1 PHE A 40 0.509 -1.468 2.265 1.00 0.00 C ATOM 578 CE2 PHE A 40 -1.862 -1.385 1.967 1.00 0.00 C ATOM 579 CZ PHE A 40 -0.599 -0.936 1.634 1.00 0.00 C ATOM 0 H PHE A 40 -1.197 -5.976 6.072 1.00 0.00 H new ATOM 0 HA PHE A 40 -1.270 -5.718 3.371 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -2.132 -4.033 4.892 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -0.527 -3.686 5.506 1.00 0.00 H new ATOM 0 HD1 PHE A 40 1.221 -2.865 3.713 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -3.004 -2.714 3.183 1.00 0.00 H new ATOM 0 HE1 PHE A 40 1.498 -1.117 2.008 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -2.730 -0.970 1.477 1.00 0.00 H new ATOM 0 HZ PHE A 40 -0.478 -0.171 0.882 1.00 0.00 H new ATOM 589 N ALA A 41 1.797 -5.316 4.477 1.00 0.00 N ATOM 590 CA ALA A 41 3.193 -5.238 4.067 1.00 0.00 C ATOM 591 C ALA A 41 3.687 -6.581 3.543 1.00 0.00 C ATOM 592 O ALA A 41 4.625 -6.643 2.747 1.00 0.00 O ATOM 593 CB ALA A 41 4.059 -4.771 5.229 1.00 0.00 C ATOM 0 H ALA A 41 1.658 -5.413 5.483 1.00 0.00 H new ATOM 0 HA ALA A 41 3.268 -4.512 3.257 1.00 0.00 H new ATOM 0 HB1 ALA A 41 5.099 -4.717 4.909 1.00 0.00 H new ATOM 0 HB2 ALA A 41 3.729 -3.785 5.556 1.00 0.00 H new ATOM 0 HB3 ALA A 41 3.970 -5.476 6.056 1.00 0.00 H new ATOM 599 N LYS A 42 3.052 -7.657 3.994 1.00 0.00 N ATOM 600 CA LYS A 42 3.426 -9.002 3.571 1.00 0.00 C ATOM 601 C LYS A 42 2.770 -9.355 2.240 1.00 0.00 C ATOM 602 O LYS A 42 3.280 -10.184 1.486 1.00 0.00 O ATOM 603 CB LYS A 42 3.024 -10.024 4.636 1.00 0.00 C ATOM 604 CG LYS A 42 3.470 -11.441 4.317 1.00 0.00 C ATOM 605 CD LYS A 42 2.432 -12.178 3.488 1.00 0.00 C ATOM 606 CE LYS A 42 3.077 -13.218 2.584 1.00 0.00 C ATOM 607 NZ LYS A 42 3.609 -14.373 3.359 1.00 0.00 N ATOM 0 H LYS A 42 2.275 -7.624 4.654 1.00 0.00 H new ATOM 0 HA LYS A 42 4.508 -9.028 3.442 1.00 0.00 H new ATOM 0 HB2 LYS A 42 3.450 -9.725 5.594 1.00 0.00 H new ATOM 0 HB3 LYS A 42 1.940 -10.010 4.750 1.00 0.00 H new ATOM 0 HG2 LYS A 42 4.416 -11.413 3.776 1.00 0.00 H new ATOM 0 HG3 LYS A 42 3.649 -11.985 5.245 1.00 0.00 H new ATOM 0 HD2 LYS A 42 1.715 -12.664 4.149 1.00 0.00 H new ATOM 0 HD3 LYS A 42 1.874 -11.464 2.882 1.00 0.00 H new ATOM 0 HE2 LYS A 42 2.345 -13.573 1.859 1.00 0.00 H new ATOM 0 HE3 LYS A 42 3.887 -12.756 2.019 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 4.040 -15.059 2.707 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 4.326 -14.038 4.033 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 2.832 -14.830 3.878 1.00 0.00 H new ATOM 621 N VAL A 43 1.638 -8.719 1.955 1.00 0.00 N ATOM 622 CA VAL A 43 0.915 -8.964 0.713 1.00 0.00 C ATOM 623 C VAL A 43 1.156 -7.844 -0.293 1.00 0.00 C ATOM 624 O VAL A 43 0.833 -7.977 -1.473 1.00 0.00 O ATOM 625 CB VAL A 43 -0.599 -9.098 0.963 1.00 0.00 C ATOM 626 CG1 VAL A 43 -0.903 -10.375 1.732 1.00 0.00 C ATOM 627 CG2 VAL A 43 -1.126 -7.880 1.706 1.00 0.00 C ATOM 0 H VAL A 43 1.202 -8.030 2.568 1.00 0.00 H new ATOM 0 HA VAL A 43 1.293 -9.902 0.306 1.00 0.00 H new ATOM 0 HB VAL A 43 -1.105 -9.154 -0.001 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -1.977 -10.452 1.899 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -0.563 -11.236 1.157 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -0.387 -10.353 2.692 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -2.197 -7.992 1.874 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -0.616 -7.790 2.665 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -0.943 -6.984 1.112 1.00 0.00 H new ATOM 637 N ALA A 44 1.725 -6.741 0.182 1.00 0.00 N ATOM 638 CA ALA A 44 2.011 -5.599 -0.677 1.00 0.00 C ATOM 639 C ALA A 44 3.483 -5.567 -1.075 1.00 0.00 C ATOM 640 O ALA A 44 3.819 -5.652 -2.256 1.00 0.00 O ATOM 641 CB ALA A 44 1.622 -4.304 0.020 1.00 0.00 C ATOM 0 H ALA A 44 1.997 -6.614 1.157 1.00 0.00 H new ATOM 0 HA ALA A 44 1.418 -5.701 -1.586 1.00 0.00 H new ATOM 0 HB1 ALA A 44 1.841 -3.459 -0.633 1.00 0.00 H new ATOM 0 HB2 ALA A 44 0.556 -4.319 0.248 1.00 0.00 H new ATOM 0 HB3 ALA A 44 2.190 -4.204 0.945 1.00 0.00 H new ATOM 647 N ALA A 45 4.357 -5.442 -0.081 1.00 0.00 N ATOM 648 CA ALA A 45 5.793 -5.400 -0.328 1.00 0.00 C ATOM 649 C ALA A 45 6.464 -6.697 0.111 1.00 0.00 C ATOM 650 O ALA A 45 7.670 -6.872 -0.059 1.00 0.00 O ATOM 651 CB ALA A 45 6.417 -4.212 0.389 1.00 0.00 C ATOM 0 H ALA A 45 4.096 -5.368 0.902 1.00 0.00 H new ATOM 0 HA ALA A 45 5.949 -5.286 -1.401 1.00 0.00 H new ATOM 0 HB1 ALA A 45 7.490 -4.193 0.196 1.00 0.00 H new ATOM 0 HB2 ALA A 45 5.966 -3.289 0.024 1.00 0.00 H new ATOM 0 HB3 ALA A 45 6.243 -4.302 1.461 1.00 0.00 H new ATOM 657 N ASN A 46 5.674 -7.604 0.677 1.00 0.00 N ATOM 658 CA ASN A 46 6.193 -8.886 1.142 1.00 0.00 C ATOM 659 C ASN A 46 7.270 -8.684 2.203 1.00 0.00 C ATOM 660 O ASN A 46 8.136 -9.538 2.396 1.00 0.00 O ATOM 661 CB ASN A 46 6.761 -9.686 -0.032 1.00 0.00 C ATOM 662 CG ASN A 46 6.899 -11.162 0.287 1.00 0.00 C ATOM 663 OD1 ASN A 46 6.417 -11.633 1.317 1.00 0.00 O ATOM 664 ND2 ASN A 46 7.560 -11.899 -0.598 1.00 0.00 N ATOM 0 H ASN A 46 4.673 -7.475 0.825 1.00 0.00 H new ATOM 0 HA ASN A 46 5.369 -9.443 1.588 1.00 0.00 H new ATOM 0 HB2 ASN A 46 6.112 -9.564 -0.899 1.00 0.00 H new ATOM 0 HB3 ASN A 46 7.737 -9.283 -0.304 1.00 0.00 H new ATOM 0 HD21 ASN A 46 7.685 -12.898 -0.437 1.00 0.00 H new ATOM 0 HD22 ASN A 46 7.943 -11.466 -1.438 1.00 0.00 H new ATOM 671 N LYS A 47 7.211 -7.548 2.890 1.00 0.00 N ATOM 672 CA LYS A 47 8.179 -7.233 3.934 1.00 0.00 C ATOM 673 C LYS A 47 7.608 -7.537 5.316 1.00 0.00 C ATOM 674 O LYS A 47 6.493 -8.043 5.439 1.00 0.00 O ATOM 675 CB LYS A 47 8.588 -5.761 3.852 1.00 0.00 C ATOM 676 CG LYS A 47 9.733 -5.500 2.889 1.00 0.00 C ATOM 677 CD LYS A 47 11.080 -5.593 3.587 1.00 0.00 C ATOM 678 CE LYS A 47 12.107 -4.676 2.939 1.00 0.00 C ATOM 679 NZ LYS A 47 13.376 -4.628 3.718 1.00 0.00 N ATOM 0 H LYS A 47 6.502 -6.830 2.742 1.00 0.00 H new ATOM 0 HA LYS A 47 9.059 -7.857 3.779 1.00 0.00 H new ATOM 0 HB2 LYS A 47 7.725 -5.169 3.546 1.00 0.00 H new ATOM 0 HB3 LYS A 47 8.874 -5.416 4.846 1.00 0.00 H new ATOM 0 HG2 LYS A 47 9.695 -6.221 2.072 1.00 0.00 H new ATOM 0 HG3 LYS A 47 9.619 -4.511 2.446 1.00 0.00 H new ATOM 0 HD2 LYS A 47 10.966 -5.328 4.638 1.00 0.00 H new ATOM 0 HD3 LYS A 47 11.438 -6.622 3.555 1.00 0.00 H new ATOM 0 HE2 LYS A 47 12.315 -5.022 1.926 1.00 0.00 H new ATOM 0 HE3 LYS A 47 11.694 -3.671 2.854 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 14.175 -4.471 3.071 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 13.331 -3.850 4.407 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 13.509 -5.529 4.221 1.00 0.00 H new ATOM 693 N SER A 48 8.379 -7.223 6.352 1.00 0.00 N ATOM 694 CA SER A 48 7.951 -7.464 7.724 1.00 0.00 C ATOM 695 C SER A 48 7.309 -6.215 8.321 1.00 0.00 C ATOM 696 O SER A 48 7.680 -5.092 7.981 1.00 0.00 O ATOM 697 CB SER A 48 9.139 -7.901 8.583 1.00 0.00 C ATOM 698 OG SER A 48 9.605 -9.182 8.196 1.00 0.00 O ATOM 0 H SER A 48 9.304 -6.801 6.267 1.00 0.00 H new ATOM 0 HA SER A 48 7.209 -8.262 7.711 1.00 0.00 H new ATOM 0 HB2 SER A 48 9.946 -7.174 8.490 1.00 0.00 H new ATOM 0 HB3 SER A 48 8.846 -7.919 9.633 1.00 0.00 H new ATOM 0 HG SER A 48 10.365 -9.437 8.759 1.00 0.00 H new ATOM 704 N GLN A 49 6.345 -6.421 9.212 1.00 0.00 N ATOM 705 CA GLN A 49 5.651 -5.311 9.856 1.00 0.00 C ATOM 706 C GLN A 49 6.624 -4.190 10.205 1.00 0.00 C ATOM 707 O GLN A 49 6.409 -3.033 9.844 1.00 0.00 O ATOM 708 CB GLN A 49 4.936 -5.794 11.119 1.00 0.00 C ATOM 709 CG GLN A 49 4.165 -4.698 11.838 1.00 0.00 C ATOM 710 CD GLN A 49 4.996 -3.997 12.894 1.00 0.00 C ATOM 711 OE1 GLN A 49 6.169 -4.314 13.090 1.00 0.00 O ATOM 712 NE2 GLN A 49 4.390 -3.037 13.583 1.00 0.00 N ATOM 0 H GLN A 49 6.027 -7.345 9.505 1.00 0.00 H new ATOM 0 HA GLN A 49 4.913 -4.921 9.156 1.00 0.00 H new ATOM 0 HB2 GLN A 49 4.248 -6.596 10.853 1.00 0.00 H new ATOM 0 HB3 GLN A 49 5.671 -6.218 11.803 1.00 0.00 H new ATOM 0 HG2 GLN A 49 3.817 -3.966 11.109 1.00 0.00 H new ATOM 0 HG3 GLN A 49 3.279 -5.129 12.305 1.00 0.00 H new ATOM 0 HE21 GLN A 49 3.416 -2.806 13.388 1.00 0.00 H new ATOM 0 HE22 GLN A 49 4.899 -2.530 14.307 1.00 0.00 H new ATOM 721 N GLY A 50 7.696 -4.540 10.910 1.00 0.00 N ATOM 722 CA GLY A 50 8.685 -3.552 11.296 1.00 0.00 C ATOM 723 C GLY A 50 9.049 -2.619 10.158 1.00 0.00 C ATOM 724 O GLY A 50 9.276 -1.428 10.371 1.00 0.00 O ATOM 0 H GLY A 50 7.896 -5.491 11.220 1.00 0.00 H new ATOM 0 HA2 GLY A 50 8.302 -2.967 12.133 1.00 0.00 H new ATOM 0 HA3 GLY A 50 9.583 -4.060 11.647 1.00 0.00 H new ATOM 728 N TRP A 51 9.105 -3.161 8.947 1.00 0.00 N ATOM 729 CA TRP A 51 9.445 -2.369 7.770 1.00 0.00 C ATOM 730 C TRP A 51 8.269 -1.499 7.341 1.00 0.00 C ATOM 731 O TRP A 51 8.453 -0.448 6.725 1.00 0.00 O ATOM 732 CB TRP A 51 9.866 -3.284 6.618 1.00 0.00 C ATOM 733 CG TRP A 51 10.155 -2.544 5.347 1.00 0.00 C ATOM 734 CD1 TRP A 51 11.381 -2.168 4.878 1.00 0.00 C ATOM 735 CD2 TRP A 51 9.198 -2.088 4.385 1.00 0.00 C ATOM 736 NE1 TRP A 51 11.244 -1.507 3.682 1.00 0.00 N ATOM 737 CE2 TRP A 51 9.915 -1.445 3.357 1.00 0.00 C ATOM 738 CE3 TRP A 51 7.806 -2.163 4.290 1.00 0.00 C ATOM 739 CZ2 TRP A 51 9.285 -0.881 2.251 1.00 0.00 C ATOM 740 CZ3 TRP A 51 7.182 -1.602 3.192 1.00 0.00 C ATOM 741 CH2 TRP A 51 7.921 -0.968 2.184 1.00 0.00 C ATOM 0 H TRP A 51 8.920 -4.145 8.754 1.00 0.00 H new ATOM 0 HA TRP A 51 10.279 -1.717 8.030 1.00 0.00 H new ATOM 0 HB2 TRP A 51 10.753 -3.844 6.914 1.00 0.00 H new ATOM 0 HB3 TRP A 51 9.076 -4.012 6.434 1.00 0.00 H new ATOM 0 HD1 TRP A 51 12.320 -2.362 5.375 1.00 0.00 H new ATOM 0 HE1 TRP A 51 12.008 -1.124 3.126 1.00 0.00 H new ATOM 0 HE3 TRP A 51 7.228 -2.651 5.061 1.00 0.00 H new ATOM 0 HZ2 TRP A 51 9.853 -0.392 1.473 1.00 0.00 H new ATOM 0 HZ3 TRP A 51 6.106 -1.653 3.109 1.00 0.00 H new ATOM 0 HH2 TRP A 51 7.404 -0.540 1.338 1.00 0.00 H new ATOM 752 N LEU A 52 7.060 -1.942 7.669 1.00 0.00 N ATOM 753 CA LEU A 52 5.853 -1.202 7.317 1.00 0.00 C ATOM 754 C LEU A 52 5.540 -0.140 8.366 1.00 0.00 C ATOM 755 O LEU A 52 5.470 1.050 8.057 1.00 0.00 O ATOM 756 CB LEU A 52 4.668 -2.159 7.175 1.00 0.00 C ATOM 757 CG LEU A 52 3.355 -1.536 6.701 1.00 0.00 C ATOM 758 CD1 LEU A 52 2.867 -0.497 7.699 1.00 0.00 C ATOM 759 CD2 LEU A 52 3.525 -0.915 5.322 1.00 0.00 C ATOM 0 H LEU A 52 6.890 -2.809 8.178 1.00 0.00 H new ATOM 0 HA LEU A 52 6.027 -0.704 6.363 1.00 0.00 H new ATOM 0 HB2 LEU A 52 4.946 -2.948 6.476 1.00 0.00 H new ATOM 0 HB3 LEU A 52 4.494 -2.635 8.140 1.00 0.00 H new ATOM 0 HG LEU A 52 2.606 -2.324 6.632 1.00 0.00 H new ATOM 0 HD11 LEU A 52 1.931 -0.064 7.345 1.00 0.00 H new ATOM 0 HD12 LEU A 52 2.704 -0.971 8.667 1.00 0.00 H new ATOM 0 HD13 LEU A 52 3.615 0.289 7.801 1.00 0.00 H new ATOM 0 HD21 LEU A 52 2.580 -0.477 5.001 1.00 0.00 H new ATOM 0 HD22 LEU A 52 4.289 -0.139 5.364 1.00 0.00 H new ATOM 0 HD23 LEU A 52 3.828 -1.684 4.611 1.00 0.00 H new ATOM 771 N CYS A 53 5.354 -0.578 9.606 1.00 0.00 N ATOM 772 CA CYS A 53 5.050 0.336 10.702 1.00 0.00 C ATOM 773 C CYS A 53 5.917 1.588 10.623 1.00 0.00 C ATOM 774 O CYS A 53 5.412 2.708 10.679 1.00 0.00 O ATOM 775 CB CYS A 53 5.261 -0.361 12.048 1.00 0.00 C ATOM 776 SG CYS A 53 4.176 0.237 13.365 1.00 0.00 S ATOM 0 H CYS A 53 5.408 -1.560 9.878 1.00 0.00 H new ATOM 0 HA CYS A 53 4.005 0.634 10.615 1.00 0.00 H new ATOM 0 HB2 CYS A 53 5.103 -1.432 11.920 1.00 0.00 H new ATOM 0 HB3 CYS A 53 6.298 -0.226 12.356 1.00 0.00 H new ATOM 0 HG CYS A 53 4.427 -0.413 14.463 1.00 0.00 H new ATOM 782 N GLU A 54 7.225 1.388 10.494 1.00 0.00 N ATOM 783 CA GLU A 54 8.162 2.502 10.409 1.00 0.00 C ATOM 784 C GLU A 54 7.737 3.491 9.328 1.00 0.00 C ATOM 785 O GLU A 54 7.574 4.684 9.589 1.00 0.00 O ATOM 786 CB GLU A 54 9.574 1.989 10.119 1.00 0.00 C ATOM 787 CG GLU A 54 10.145 1.119 11.226 1.00 0.00 C ATOM 788 CD GLU A 54 11.278 0.233 10.746 1.00 0.00 C ATOM 789 OE1 GLU A 54 11.311 -0.085 9.539 1.00 0.00 O ATOM 790 OE2 GLU A 54 12.132 -0.142 11.577 1.00 0.00 O ATOM 0 H GLU A 54 7.659 0.466 10.446 1.00 0.00 H new ATOM 0 HA GLU A 54 8.160 3.018 11.369 1.00 0.00 H new ATOM 0 HB2 GLU A 54 9.560 1.418 9.190 1.00 0.00 H new ATOM 0 HB3 GLU A 54 10.235 2.841 9.960 1.00 0.00 H new ATOM 0 HG2 GLU A 54 10.504 1.756 12.035 1.00 0.00 H new ATOM 0 HG3 GLU A 54 9.352 0.496 11.639 1.00 0.00 H new ATOM 797 N LEU A 55 7.558 2.987 8.111 1.00 0.00 N ATOM 798 CA LEU A 55 7.152 3.825 6.988 1.00 0.00 C ATOM 799 C LEU A 55 6.068 4.812 7.410 1.00 0.00 C ATOM 800 O LEU A 55 6.137 6.000 7.091 1.00 0.00 O ATOM 801 CB LEU A 55 6.646 2.956 5.835 1.00 0.00 C ATOM 802 CG LEU A 55 7.695 2.520 4.813 1.00 0.00 C ATOM 803 CD1 LEU A 55 9.046 2.325 5.484 1.00 0.00 C ATOM 804 CD2 LEU A 55 7.258 1.243 4.110 1.00 0.00 C ATOM 0 H LEU A 55 7.688 2.003 7.877 1.00 0.00 H new ATOM 0 HA LEU A 55 8.022 4.390 6.654 1.00 0.00 H new ATOM 0 HB2 LEU A 55 6.184 2.063 6.255 1.00 0.00 H new ATOM 0 HB3 LEU A 55 5.863 3.503 5.311 1.00 0.00 H new ATOM 0 HG LEU A 55 7.794 3.307 4.065 1.00 0.00 H new ATOM 0 HD11 LEU A 55 9.780 2.015 4.740 1.00 0.00 H new ATOM 0 HD12 LEU A 55 9.365 3.263 5.939 1.00 0.00 H new ATOM 0 HD13 LEU A 55 8.963 1.558 6.254 1.00 0.00 H new ATOM 0 HD21 LEU A 55 8.018 0.948 3.386 1.00 0.00 H new ATOM 0 HD22 LEU A 55 7.130 0.449 4.845 1.00 0.00 H new ATOM 0 HD23 LEU A 55 6.313 1.416 3.595 1.00 0.00 H new ATOM 816 N LEU A 56 5.069 4.314 8.129 1.00 0.00 N ATOM 817 CA LEU A 56 3.971 5.153 8.597 1.00 0.00 C ATOM 818 C LEU A 56 4.417 6.037 9.758 1.00 0.00 C ATOM 819 O LEU A 56 3.828 7.087 10.012 1.00 0.00 O ATOM 820 CB LEU A 56 2.787 4.284 9.028 1.00 0.00 C ATOM 821 CG LEU A 56 2.432 3.124 8.097 1.00 0.00 C ATOM 822 CD1 LEU A 56 1.221 2.370 8.623 1.00 0.00 C ATOM 823 CD2 LEU A 56 2.174 3.633 6.686 1.00 0.00 C ATOM 0 H LEU A 56 4.996 3.334 8.401 1.00 0.00 H new ATOM 0 HA LEU A 56 3.661 5.796 7.773 1.00 0.00 H new ATOM 0 HB2 LEU A 56 3.001 3.878 10.017 1.00 0.00 H new ATOM 0 HB3 LEU A 56 1.910 4.924 9.129 1.00 0.00 H new ATOM 0 HG LEU A 56 3.277 2.436 8.065 1.00 0.00 H new ATOM 0 HD11 LEU A 56 0.983 1.548 7.948 1.00 0.00 H new ATOM 0 HD12 LEU A 56 1.442 1.973 9.614 1.00 0.00 H new ATOM 0 HD13 LEU A 56 0.369 3.047 8.685 1.00 0.00 H new ATOM 0 HD21 LEU A 56 1.923 2.794 6.037 1.00 0.00 H new ATOM 0 HD22 LEU A 56 1.346 4.341 6.701 1.00 0.00 H new ATOM 0 HD23 LEU A 56 3.069 4.129 6.309 1.00 0.00 H new ATOM 835 N ARG A 57 5.461 5.604 10.457 1.00 0.00 N ATOM 836 CA ARG A 57 5.987 6.357 11.589 1.00 0.00 C ATOM 837 C ARG A 57 6.823 7.542 11.114 1.00 0.00 C ATOM 838 O ARG A 57 6.516 8.693 11.422 1.00 0.00 O ATOM 839 CB ARG A 57 6.832 5.449 12.484 1.00 0.00 C ATOM 840 CG ARG A 57 7.644 6.203 13.524 1.00 0.00 C ATOM 841 CD ARG A 57 8.510 5.261 14.346 1.00 0.00 C ATOM 842 NE ARG A 57 8.728 5.760 15.701 1.00 0.00 N ATOM 843 CZ ARG A 57 7.853 5.610 16.689 1.00 0.00 C ATOM 844 NH1 ARG A 57 6.707 4.978 16.475 1.00 0.00 N ATOM 845 NH2 ARG A 57 8.124 6.092 17.895 1.00 0.00 N ATOM 0 H ARG A 57 5.959 4.736 10.259 1.00 0.00 H new ATOM 0 HA ARG A 57 5.142 6.738 12.163 1.00 0.00 H new ATOM 0 HB2 ARG A 57 6.176 4.741 12.991 1.00 0.00 H new ATOM 0 HB3 ARG A 57 7.509 4.866 11.860 1.00 0.00 H new ATOM 0 HG2 ARG A 57 8.276 6.941 13.029 1.00 0.00 H new ATOM 0 HG3 ARG A 57 6.972 6.751 14.185 1.00 0.00 H new ATOM 0 HD2 ARG A 57 8.036 4.281 14.393 1.00 0.00 H new ATOM 0 HD3 ARG A 57 9.471 5.127 13.850 1.00 0.00 H new ATOM 0 HE ARG A 57 9.600 6.251 15.900 1.00 0.00 H new ATOM 0 HH11 ARG A 57 6.495 4.605 15.549 1.00 0.00 H new ATOM 0 HH12 ARG A 57 6.037 4.865 17.236 1.00 0.00 H new ATOM 0 HH21 ARG A 57 9.005 6.578 18.064 1.00 0.00 H new ATOM 0 HH22 ARG A 57 7.452 5.977 18.653 1.00 0.00 H new ATOM 859 N TRP A 58 7.879 7.250 10.364 1.00 0.00 N ATOM 860 CA TRP A 58 8.760 8.292 9.846 1.00 0.00 C ATOM 861 C TRP A 58 8.116 9.013 8.668 1.00 0.00 C ATOM 862 O TRP A 58 8.223 10.233 8.539 1.00 0.00 O ATOM 863 CB TRP A 58 10.100 7.690 9.422 1.00 0.00 C ATOM 864 CG TRP A 58 10.790 6.941 10.521 1.00 0.00 C ATOM 865 CD1 TRP A 58 10.691 5.606 10.791 1.00 0.00 C ATOM 866 CD2 TRP A 58 11.683 7.485 11.499 1.00 0.00 C ATOM 867 NE1 TRP A 58 11.469 5.287 11.878 1.00 0.00 N ATOM 868 CE2 TRP A 58 12.089 6.422 12.330 1.00 0.00 C ATOM 869 CE3 TRP A 58 12.182 8.765 11.752 1.00 0.00 C ATOM 870 CZ2 TRP A 58 12.967 6.603 13.395 1.00 0.00 C ATOM 871 CZ3 TRP A 58 13.054 8.943 12.810 1.00 0.00 C ATOM 872 CH2 TRP A 58 13.440 7.867 13.620 1.00 0.00 C ATOM 0 H TRP A 58 8.147 6.302 10.101 1.00 0.00 H new ATOM 0 HA TRP A 58 8.931 9.018 10.641 1.00 0.00 H new ATOM 0 HB2 TRP A 58 9.937 7.017 8.580 1.00 0.00 H new ATOM 0 HB3 TRP A 58 10.754 8.488 9.070 1.00 0.00 H new ATOM 0 HD1 TRP A 58 10.090 4.904 10.232 1.00 0.00 H new ATOM 0 HE1 TRP A 58 11.569 4.356 12.283 1.00 0.00 H new ATOM 0 HE3 TRP A 58 11.892 9.601 11.132 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 13.264 5.775 14.021 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 13.444 9.929 13.016 1.00 0.00 H new ATOM 0 HH2 TRP A 58 14.124 8.039 14.438 1.00 0.00 H new ATOM 883 N LYS A 59 7.446 8.252 7.808 1.00 0.00 N ATOM 884 CA LYS A 59 6.783 8.819 6.640 1.00 0.00 C ATOM 885 C LYS A 59 7.757 9.651 5.811 1.00 0.00 C ATOM 886 O LYS A 59 7.420 10.740 5.350 1.00 0.00 O ATOM 887 CB LYS A 59 5.596 9.683 7.070 1.00 0.00 C ATOM 888 CG LYS A 59 4.413 8.880 7.583 1.00 0.00 C ATOM 889 CD LYS A 59 3.126 9.687 7.527 1.00 0.00 C ATOM 890 CE LYS A 59 1.905 8.801 7.720 1.00 0.00 C ATOM 891 NZ LYS A 59 1.536 8.670 9.156 1.00 0.00 N ATOM 0 H LYS A 59 7.348 7.241 7.899 1.00 0.00 H new ATOM 0 HA LYS A 59 6.421 7.996 6.025 1.00 0.00 H new ATOM 0 HB2 LYS A 59 5.922 10.372 7.849 1.00 0.00 H new ATOM 0 HB3 LYS A 59 5.273 10.289 6.224 1.00 0.00 H new ATOM 0 HG2 LYS A 59 4.302 7.974 6.988 1.00 0.00 H new ATOM 0 HG3 LYS A 59 4.603 8.566 8.609 1.00 0.00 H new ATOM 0 HD2 LYS A 59 3.144 10.457 8.298 1.00 0.00 H new ATOM 0 HD3 LYS A 59 3.058 10.199 6.567 1.00 0.00 H new ATOM 0 HE2 LYS A 59 1.064 9.216 7.165 1.00 0.00 H new ATOM 0 HE3 LYS A 59 2.104 7.813 7.305 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 0.618 8.189 9.236 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 2.262 8.115 9.652 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 1.470 9.615 9.585 1.00 0.00 H new ATOM 905 N GLU A 60 8.966 9.128 5.626 1.00 0.00 N ATOM 906 CA GLU A 60 9.987 9.823 4.852 1.00 0.00 C ATOM 907 C GLU A 60 9.453 10.219 3.478 1.00 0.00 C ATOM 908 O GLU A 60 8.657 9.499 2.879 1.00 0.00 O ATOM 909 CB GLU A 60 11.228 8.942 4.694 1.00 0.00 C ATOM 910 CG GLU A 60 12.526 9.726 4.614 1.00 0.00 C ATOM 911 CD GLU A 60 12.836 10.200 3.207 1.00 0.00 C ATOM 912 OE1 GLU A 60 12.486 9.481 2.248 1.00 0.00 O ATOM 913 OE2 GLU A 60 13.430 11.289 3.066 1.00 0.00 O ATOM 0 H GLU A 60 9.261 8.227 6.001 1.00 0.00 H new ATOM 0 HA GLU A 60 10.260 10.730 5.392 1.00 0.00 H new ATOM 0 HB2 GLU A 60 11.282 8.251 5.536 1.00 0.00 H new ATOM 0 HB3 GLU A 60 11.122 8.338 3.793 1.00 0.00 H new ATOM 0 HG2 GLU A 60 12.467 10.588 5.279 1.00 0.00 H new ATOM 0 HG3 GLU A 60 13.345 9.103 4.972 1.00 0.00 H new ATOM 920 N ASN A 61 9.899 11.371 2.986 1.00 0.00 N ATOM 921 CA ASN A 61 9.466 11.865 1.684 1.00 0.00 C ATOM 922 C ASN A 61 9.943 10.942 0.566 1.00 0.00 C ATOM 923 O ASN A 61 11.140 10.789 0.322 1.00 0.00 O ATOM 924 CB ASN A 61 9.994 13.282 1.451 1.00 0.00 C ATOM 925 CG ASN A 61 9.880 13.710 0.001 1.00 0.00 C ATOM 926 OD1 ASN A 61 10.692 13.322 -0.839 1.00 0.00 O ATOM 927 ND2 ASN A 61 8.867 14.515 -0.300 1.00 0.00 N ATOM 0 H ASN A 61 10.560 11.979 3.469 1.00 0.00 H new ATOM 0 HA ASN A 61 8.376 11.885 1.675 1.00 0.00 H new ATOM 0 HB2 ASN A 61 9.440 13.981 2.078 1.00 0.00 H new ATOM 0 HB3 ASN A 61 11.038 13.334 1.761 1.00 0.00 H new ATOM 0 HD21 ASN A 61 8.739 14.836 -1.260 1.00 0.00 H new ATOM 0 HD22 ASN A 61 8.218 14.812 0.428 1.00 0.00 H new ATOM 934 N PRO A 62 8.985 10.312 -0.130 1.00 0.00 N ATOM 935 CA PRO A 62 9.282 9.395 -1.234 1.00 0.00 C ATOM 936 C PRO A 62 9.833 10.119 -2.458 1.00 0.00 C ATOM 937 O PRO A 62 9.401 11.226 -2.782 1.00 0.00 O ATOM 938 CB PRO A 62 7.922 8.768 -1.551 1.00 0.00 C ATOM 939 CG PRO A 62 6.925 9.775 -1.091 1.00 0.00 C ATOM 940 CD PRO A 62 7.538 10.448 0.106 1.00 0.00 C ATOM 0 HA PRO A 62 10.049 8.669 -0.965 1.00 0.00 H new ATOM 0 HB2 PRO A 62 7.818 8.566 -2.617 1.00 0.00 H new ATOM 0 HB3 PRO A 62 7.793 7.818 -1.032 1.00 0.00 H new ATOM 0 HG2 PRO A 62 6.710 10.498 -1.878 1.00 0.00 H new ATOM 0 HG3 PRO A 62 5.981 9.298 -0.829 1.00 0.00 H new ATOM 0 HD2 PRO A 62 7.239 11.494 0.176 1.00 0.00 H new ATOM 0 HD3 PRO A 62 7.236 9.967 1.036 1.00 0.00 H new ATOM 948 N SER A 63 10.788 9.488 -3.134 1.00 0.00 N ATOM 949 CA SER A 63 11.399 10.075 -4.321 1.00 0.00 C ATOM 950 C SER A 63 12.054 9.000 -5.182 1.00 0.00 C ATOM 951 O SER A 63 12.410 7.920 -4.709 1.00 0.00 O ATOM 952 CB SER A 63 12.437 11.125 -3.919 1.00 0.00 C ATOM 953 OG SER A 63 11.846 12.407 -3.801 1.00 0.00 O ATOM 0 H SER A 63 11.155 8.571 -2.880 1.00 0.00 H new ATOM 0 HA SER A 63 10.614 10.555 -4.905 1.00 0.00 H new ATOM 0 HB2 SER A 63 12.895 10.844 -2.971 1.00 0.00 H new ATOM 0 HB3 SER A 63 13.234 11.156 -4.662 1.00 0.00 H new ATOM 0 HG SER A 63 10.935 12.316 -3.452 1.00 0.00 H new ATOM 959 N PRO A 64 12.218 9.301 -6.479 1.00 0.00 N ATOM 960 CA PRO A 64 12.831 8.374 -7.435 1.00 0.00 C ATOM 961 C PRO A 64 14.325 8.190 -7.188 1.00 0.00 C ATOM 962 O PRO A 64 14.993 7.441 -7.900 1.00 0.00 O ATOM 963 CB PRO A 64 12.593 9.050 -8.787 1.00 0.00 C ATOM 964 CG PRO A 64 12.463 10.499 -8.469 1.00 0.00 C ATOM 965 CD PRO A 64 11.818 10.569 -7.112 1.00 0.00 C ATOM 0 HA PRO A 64 12.405 7.373 -7.362 1.00 0.00 H new ATOM 0 HB2 PRO A 64 13.421 8.868 -9.472 1.00 0.00 H new ATOM 0 HB3 PRO A 64 11.692 8.668 -9.267 1.00 0.00 H new ATOM 0 HG2 PRO A 64 13.438 10.986 -8.463 1.00 0.00 H new ATOM 0 HG3 PRO A 64 11.856 11.010 -9.216 1.00 0.00 H new ATOM 0 HD2 PRO A 64 12.169 11.430 -6.544 1.00 0.00 H new ATOM 0 HD3 PRO A 64 10.734 10.657 -7.186 1.00 0.00 H new ATOM 973 N GLU A 65 14.842 8.878 -6.175 1.00 0.00 N ATOM 974 CA GLU A 65 16.257 8.790 -5.835 1.00 0.00 C ATOM 975 C GLU A 65 16.515 7.630 -4.877 1.00 0.00 C ATOM 976 O GLU A 65 17.508 6.915 -5.006 1.00 0.00 O ATOM 977 CB GLU A 65 16.736 10.100 -5.207 1.00 0.00 C ATOM 978 CG GLU A 65 17.073 11.176 -6.227 1.00 0.00 C ATOM 979 CD GLU A 65 18.479 11.038 -6.777 1.00 0.00 C ATOM 980 OE1 GLU A 65 19.441 11.278 -6.017 1.00 0.00 O ATOM 981 OE2 GLU A 65 18.618 10.689 -7.968 1.00 0.00 O ATOM 0 H GLU A 65 14.302 9.502 -5.576 1.00 0.00 H new ATOM 0 HA GLU A 65 16.815 8.611 -6.754 1.00 0.00 H new ATOM 0 HB2 GLU A 65 15.963 10.476 -4.537 1.00 0.00 H new ATOM 0 HB3 GLU A 65 17.617 9.900 -4.597 1.00 0.00 H new ATOM 0 HG2 GLU A 65 16.359 11.128 -7.049 1.00 0.00 H new ATOM 0 HG3 GLU A 65 16.962 12.157 -5.765 1.00 0.00 H new ATOM 988 N ASN A 66 15.614 7.452 -3.917 1.00 0.00 N ATOM 989 CA ASN A 66 15.744 6.380 -2.936 1.00 0.00 C ATOM 990 C ASN A 66 15.280 5.049 -3.520 1.00 0.00 C ATOM 991 O ASN A 66 14.091 4.850 -3.769 1.00 0.00 O ATOM 992 CB ASN A 66 14.935 6.709 -1.680 1.00 0.00 C ATOM 993 CG ASN A 66 15.387 5.908 -0.475 1.00 0.00 C ATOM 994 OD1 ASN A 66 15.967 4.831 -0.613 1.00 0.00 O ATOM 995 ND2 ASN A 66 15.122 6.431 0.717 1.00 0.00 N ATOM 0 H ASN A 66 14.786 8.036 -3.797 1.00 0.00 H new ATOM 0 HA ASN A 66 16.797 6.292 -2.669 1.00 0.00 H new ATOM 0 HB2 ASN A 66 15.026 7.773 -1.461 1.00 0.00 H new ATOM 0 HB3 ASN A 66 13.880 6.512 -1.869 1.00 0.00 H new ATOM 0 HD21 ASN A 66 15.402 5.937 1.564 1.00 0.00 H new ATOM 0 HD22 ASN A 66 14.639 7.327 0.785 1.00 0.00 H new ATOM 1002 N ARG A 67 16.226 4.141 -3.735 1.00 0.00 N ATOM 1003 CA ARG A 67 15.914 2.829 -4.289 1.00 0.00 C ATOM 1004 C ARG A 67 15.173 1.970 -3.269 1.00 0.00 C ATOM 1005 O ARG A 67 13.990 1.671 -3.435 1.00 0.00 O ATOM 1006 CB ARG A 67 17.196 2.122 -4.733 1.00 0.00 C ATOM 1007 CG ARG A 67 17.701 2.573 -6.094 1.00 0.00 C ATOM 1008 CD ARG A 67 17.121 1.722 -7.213 1.00 0.00 C ATOM 1009 NE ARG A 67 17.959 0.564 -7.510 1.00 0.00 N ATOM 1010 CZ ARG A 67 19.006 0.604 -8.326 1.00 0.00 C ATOM 1011 NH1 ARG A 67 19.343 1.739 -8.922 1.00 0.00 N ATOM 1012 NH2 ARG A 67 19.720 -0.493 -8.546 1.00 0.00 N ATOM 0 H ARG A 67 17.215 4.290 -3.534 1.00 0.00 H new ATOM 0 HA ARG A 67 15.267 2.972 -5.155 1.00 0.00 H new ATOM 0 HB2 ARG A 67 17.974 2.298 -3.990 1.00 0.00 H new ATOM 0 HB3 ARG A 67 17.017 1.047 -4.759 1.00 0.00 H new ATOM 0 HG2 ARG A 67 17.435 3.618 -6.254 1.00 0.00 H new ATOM 0 HG3 ARG A 67 18.789 2.514 -6.117 1.00 0.00 H new ATOM 0 HD2 ARG A 67 16.123 1.385 -6.932 1.00 0.00 H new ATOM 0 HD3 ARG A 67 17.011 2.330 -8.111 1.00 0.00 H new ATOM 0 HE ARG A 67 17.728 -0.325 -7.066 1.00 0.00 H new ATOM 0 HH11 ARG A 67 18.798 2.585 -8.754 1.00 0.00 H new ATOM 0 HH12 ARG A 67 20.148 1.767 -9.548 1.00 0.00 H new ATOM 0 HH21 ARG A 67 19.465 -1.368 -8.088 1.00 0.00 H new ATOM 0 HH22 ARG A 67 20.524 -0.461 -9.173 1.00 0.00 H new ATOM 1026 N THR A 68 15.877 1.575 -2.213 1.00 0.00 N ATOM 1027 CA THR A 68 15.287 0.748 -1.167 1.00 0.00 C ATOM 1028 C THR A 68 13.890 1.236 -0.804 1.00 0.00 C ATOM 1029 O THR A 68 13.029 0.449 -0.409 1.00 0.00 O ATOM 1030 CB THR A 68 16.161 0.739 0.101 1.00 0.00 C ATOM 1031 OG1 THR A 68 17.503 0.364 -0.231 1.00 0.00 O ATOM 1032 CG2 THR A 68 15.602 -0.224 1.137 1.00 0.00 C ATOM 0 H THR A 68 16.857 1.814 -2.059 1.00 0.00 H new ATOM 0 HA THR A 68 15.223 -0.266 -1.563 1.00 0.00 H new ATOM 0 HB THR A 68 16.159 1.744 0.524 1.00 0.00 H new ATOM 0 HG1 THR A 68 18.052 0.362 0.580 1.00 0.00 H new ATOM 0 HG21 THR A 68 16.236 -0.213 2.024 1.00 0.00 H new ATOM 0 HG22 THR A 68 14.592 0.081 1.410 1.00 0.00 H new ATOM 0 HG23 THR A 68 15.577 -1.231 0.721 1.00 0.00 H new ATOM 1040 N LEU A 69 13.669 2.539 -0.939 1.00 0.00 N ATOM 1041 CA LEU A 69 12.374 3.133 -0.625 1.00 0.00 C ATOM 1042 C LEU A 69 11.465 3.134 -1.850 1.00 0.00 C ATOM 1043 O LEU A 69 10.453 2.434 -1.885 1.00 0.00 O ATOM 1044 CB LEU A 69 12.557 4.562 -0.111 1.00 0.00 C ATOM 1045 CG LEU A 69 11.513 5.052 0.893 1.00 0.00 C ATOM 1046 CD1 LEU A 69 11.395 4.081 2.058 1.00 0.00 C ATOM 1047 CD2 LEU A 69 11.866 6.446 1.392 1.00 0.00 C ATOM 0 H LEU A 69 14.370 3.205 -1.264 1.00 0.00 H new ATOM 0 HA LEU A 69 11.905 2.531 0.153 1.00 0.00 H new ATOM 0 HB2 LEU A 69 13.541 4.637 0.352 1.00 0.00 H new ATOM 0 HB3 LEU A 69 12.555 5.238 -0.966 1.00 0.00 H new ATOM 0 HG LEU A 69 10.548 5.102 0.389 1.00 0.00 H new ATOM 0 HD11 LEU A 69 10.647 4.447 2.762 1.00 0.00 H new ATOM 0 HD12 LEU A 69 11.095 3.101 1.686 1.00 0.00 H new ATOM 0 HD13 LEU A 69 12.358 3.998 2.562 1.00 0.00 H new ATOM 0 HD21 LEU A 69 11.112 6.779 2.106 1.00 0.00 H new ATOM 0 HD22 LEU A 69 12.841 6.422 1.879 1.00 0.00 H new ATOM 0 HD23 LEU A 69 11.898 7.137 0.549 1.00 0.00 H new ATOM 1059 N TRP A 70 11.833 3.923 -2.853 1.00 0.00 N ATOM 1060 CA TRP A 70 11.051 4.013 -4.081 1.00 0.00 C ATOM 1061 C TRP A 70 10.654 2.627 -4.576 1.00 0.00 C ATOM 1062 O TRP A 70 9.487 2.377 -4.875 1.00 0.00 O ATOM 1063 CB TRP A 70 11.846 4.747 -5.163 1.00 0.00 C ATOM 1064 CG TRP A 70 11.023 5.108 -6.362 1.00 0.00 C ATOM 1065 CD1 TRP A 70 10.932 4.411 -7.533 1.00 0.00 C ATOM 1066 CD2 TRP A 70 10.177 6.253 -6.508 1.00 0.00 C ATOM 1067 NE1 TRP A 70 10.080 5.055 -8.398 1.00 0.00 N ATOM 1068 CE2 TRP A 70 9.603 6.187 -7.793 1.00 0.00 C ATOM 1069 CE3 TRP A 70 9.846 7.328 -5.678 1.00 0.00 C ATOM 1070 CZ2 TRP A 70 8.720 7.155 -8.264 1.00 0.00 C ATOM 1071 CZ3 TRP A 70 8.970 8.287 -6.147 1.00 0.00 C ATOM 1072 CH2 TRP A 70 8.414 8.196 -7.430 1.00 0.00 C ATOM 0 H TRP A 70 12.667 4.509 -2.840 1.00 0.00 H new ATOM 0 HA TRP A 70 10.142 4.574 -3.864 1.00 0.00 H new ATOM 0 HB2 TRP A 70 12.273 5.655 -4.737 1.00 0.00 H new ATOM 0 HB3 TRP A 70 12.680 4.121 -5.479 1.00 0.00 H new ATOM 0 HD1 TRP A 70 11.453 3.490 -7.748 1.00 0.00 H new ATOM 0 HE1 TRP A 70 9.842 4.741 -9.339 1.00 0.00 H new ATOM 0 HE3 TRP A 70 10.268 7.407 -4.687 1.00 0.00 H new ATOM 0 HZ2 TRP A 70 8.292 7.087 -9.253 1.00 0.00 H new ATOM 0 HZ3 TRP A 70 8.709 9.122 -5.514 1.00 0.00 H new ATOM 0 HH2 TRP A 70 7.731 8.962 -7.767 1.00 0.00 H new ATOM 1083 N GLU A 71 11.632 1.731 -4.661 1.00 0.00 N ATOM 1084 CA GLU A 71 11.382 0.370 -5.122 1.00 0.00 C ATOM 1085 C GLU A 71 10.177 -0.234 -4.406 1.00 0.00 C ATOM 1086 O GLU A 71 9.147 -0.503 -5.022 1.00 0.00 O ATOM 1087 CB GLU A 71 12.617 -0.505 -4.892 1.00 0.00 C ATOM 1088 CG GLU A 71 13.787 -0.155 -5.796 1.00 0.00 C ATOM 1089 CD GLU A 71 14.657 -1.355 -6.114 1.00 0.00 C ATOM 1090 OE1 GLU A 71 14.277 -2.146 -7.002 1.00 0.00 O ATOM 1091 OE2 GLU A 71 15.720 -1.503 -5.474 1.00 0.00 O ATOM 0 H GLU A 71 12.604 1.922 -4.417 1.00 0.00 H new ATOM 0 HA GLU A 71 11.167 0.409 -6.190 1.00 0.00 H new ATOM 0 HB2 GLU A 71 12.931 -0.410 -3.852 1.00 0.00 H new ATOM 0 HB3 GLU A 71 12.347 -1.549 -5.049 1.00 0.00 H new ATOM 0 HG2 GLU A 71 13.409 0.271 -6.725 1.00 0.00 H new ATOM 0 HG3 GLU A 71 14.394 0.613 -5.317 1.00 0.00 H new ATOM 1098 N ASN A 72 10.316 -0.444 -3.101 1.00 0.00 N ATOM 1099 CA ASN A 72 9.240 -1.017 -2.301 1.00 0.00 C ATOM 1100 C ASN A 72 7.956 -0.206 -2.454 1.00 0.00 C ATOM 1101 O ASN A 72 6.894 -0.755 -2.751 1.00 0.00 O ATOM 1102 CB ASN A 72 9.647 -1.074 -0.827 1.00 0.00 C ATOM 1103 CG ASN A 72 10.808 -2.018 -0.584 1.00 0.00 C ATOM 1104 OD1 ASN A 72 11.703 -1.636 0.320 1.00 0.00 O flip ATOM 1105 ND2 ASN A 72 10.900 -3.079 -1.202 1.00 0.00 N flip ATOM 0 H ASN A 72 11.163 -0.226 -2.575 1.00 0.00 H new ATOM 0 HA ASN A 72 9.054 -2.029 -2.660 1.00 0.00 H new ATOM 0 HB2 ASN A 72 9.919 -0.074 -0.489 1.00 0.00 H new ATOM 0 HB3 ASN A 72 8.793 -1.392 -0.229 1.00 0.00 H new ATOM 0 HD21 ASN A 72 10.189 -3.333 -1.888 1.00 0.00 H new ATOM 0 HD22 ASN A 72 11.687 -3.704 -1.028 1.00 0.00 H new ATOM 1112 N LEU A 73 8.062 1.102 -2.251 1.00 0.00 N ATOM 1113 CA LEU A 73 6.910 1.990 -2.367 1.00 0.00 C ATOM 1114 C LEU A 73 6.281 1.886 -3.753 1.00 0.00 C ATOM 1115 O LEU A 73 5.134 2.286 -3.956 1.00 0.00 O ATOM 1116 CB LEU A 73 7.326 3.436 -2.090 1.00 0.00 C ATOM 1117 CG LEU A 73 7.513 3.810 -0.619 1.00 0.00 C ATOM 1118 CD1 LEU A 73 7.672 5.315 -0.468 1.00 0.00 C ATOM 1119 CD2 LEU A 73 6.340 3.310 0.212 1.00 0.00 C ATOM 0 H LEU A 73 8.933 1.572 -2.005 1.00 0.00 H new ATOM 0 HA LEU A 73 6.170 1.684 -1.628 1.00 0.00 H new ATOM 0 HB2 LEU A 73 8.261 3.631 -2.616 1.00 0.00 H new ATOM 0 HB3 LEU A 73 6.574 4.098 -2.520 1.00 0.00 H new ATOM 0 HG LEU A 73 8.421 3.330 -0.254 1.00 0.00 H new ATOM 0 HD11 LEU A 73 7.804 5.563 0.585 1.00 0.00 H new ATOM 0 HD12 LEU A 73 8.544 5.647 -1.031 1.00 0.00 H new ATOM 0 HD13 LEU A 73 6.782 5.815 -0.850 1.00 0.00 H new ATOM 0 HD21 LEU A 73 6.490 3.585 1.256 1.00 0.00 H new ATOM 0 HD22 LEU A 73 5.417 3.761 -0.153 1.00 0.00 H new ATOM 0 HD23 LEU A 73 6.271 2.225 0.129 1.00 0.00 H new ATOM 1131 N CYS A 74 7.038 1.346 -4.702 1.00 0.00 N ATOM 1132 CA CYS A 74 6.554 1.189 -6.069 1.00 0.00 C ATOM 1133 C CYS A 74 5.563 0.033 -6.164 1.00 0.00 C ATOM 1134 O CYS A 74 4.495 0.164 -6.763 1.00 0.00 O ATOM 1135 CB CYS A 74 7.725 0.953 -7.023 1.00 0.00 C ATOM 1136 SG CYS A 74 7.381 1.403 -8.740 1.00 0.00 S ATOM 0 H CYS A 74 7.989 1.010 -4.550 1.00 0.00 H new ATOM 0 HA CYS A 74 6.042 2.108 -6.355 1.00 0.00 H new ATOM 0 HB2 CYS A 74 8.585 1.525 -6.674 1.00 0.00 H new ATOM 0 HB3 CYS A 74 8.005 -0.100 -6.984 1.00 0.00 H new ATOM 0 HG CYS A 74 8.432 1.169 -9.469 1.00 0.00 H new ATOM 1142 N THR A 75 5.925 -1.101 -5.572 1.00 0.00 N ATOM 1143 CA THR A 75 5.070 -2.281 -5.593 1.00 0.00 C ATOM 1144 C THR A 75 3.810 -2.062 -4.762 1.00 0.00 C ATOM 1145 O THR A 75 2.717 -2.470 -5.156 1.00 0.00 O ATOM 1146 CB THR A 75 5.812 -3.522 -5.062 1.00 0.00 C ATOM 1147 OG1 THR A 75 5.296 -4.704 -5.684 1.00 0.00 O ATOM 1148 CG2 THR A 75 5.669 -3.633 -3.552 1.00 0.00 C ATOM 0 H THR A 75 6.805 -1.227 -5.072 1.00 0.00 H new ATOM 0 HA THR A 75 4.791 -2.451 -6.633 1.00 0.00 H new ATOM 0 HB THR A 75 6.870 -3.417 -5.304 1.00 0.00 H new ATOM 0 HG1 THR A 75 5.774 -5.489 -5.343 1.00 0.00 H new ATOM 0 HG21 THR A 75 6.201 -4.517 -3.200 1.00 0.00 H new ATOM 0 HG22 THR A 75 6.089 -2.745 -3.080 1.00 0.00 H new ATOM 0 HG23 THR A 75 4.614 -3.717 -3.292 1.00 0.00 H new ATOM 1156 N ILE A 76 3.970 -1.415 -3.612 1.00 0.00 N ATOM 1157 CA ILE A 76 2.845 -1.141 -2.728 1.00 0.00 C ATOM 1158 C ILE A 76 1.853 -0.185 -3.380 1.00 0.00 C ATOM 1159 O ILE A 76 0.651 -0.249 -3.122 1.00 0.00 O ATOM 1160 CB ILE A 76 3.315 -0.541 -1.389 1.00 0.00 C ATOM 1161 CG1 ILE A 76 4.407 -1.415 -0.769 1.00 0.00 C ATOM 1162 CG2 ILE A 76 2.140 -0.395 -0.433 1.00 0.00 C ATOM 1163 CD1 ILE A 76 4.839 -0.957 0.607 1.00 0.00 C ATOM 0 H ILE A 76 4.868 -1.071 -3.271 1.00 0.00 H new ATOM 0 HA ILE A 76 2.354 -2.095 -2.537 1.00 0.00 H new ATOM 0 HB ILE A 76 3.731 0.449 -1.577 1.00 0.00 H new ATOM 0 HG12 ILE A 76 4.047 -2.442 -0.705 1.00 0.00 H new ATOM 0 HG13 ILE A 76 5.274 -1.422 -1.430 1.00 0.00 H new ATOM 0 HG21 ILE A 76 2.488 0.030 0.509 1.00 0.00 H new ATOM 0 HG22 ILE A 76 1.392 0.263 -0.874 1.00 0.00 H new ATOM 0 HG23 ILE A 76 1.698 -1.374 -0.248 1.00 0.00 H new ATOM 0 HD11 ILE A 76 5.615 -1.623 0.985 1.00 0.00 H new ATOM 0 HD12 ILE A 76 5.230 0.059 0.546 1.00 0.00 H new ATOM 0 HD13 ILE A 76 3.984 -0.977 1.282 1.00 0.00 H new ATOM 1175 N ARG A 77 2.364 0.702 -4.228 1.00 0.00 N ATOM 1176 CA ARG A 77 1.523 1.672 -4.919 1.00 0.00 C ATOM 1177 C ARG A 77 0.587 0.976 -5.903 1.00 0.00 C ATOM 1178 O ARG A 77 -0.581 1.346 -6.030 1.00 0.00 O ATOM 1179 CB ARG A 77 2.389 2.694 -5.658 1.00 0.00 C ATOM 1180 CG ARG A 77 1.600 3.600 -6.589 1.00 0.00 C ATOM 1181 CD ARG A 77 0.836 4.664 -5.816 1.00 0.00 C ATOM 1182 NE ARG A 77 -0.161 5.335 -6.647 1.00 0.00 N ATOM 1183 CZ ARG A 77 -0.645 6.543 -6.383 1.00 0.00 C ATOM 1184 NH1 ARG A 77 -0.226 7.210 -5.316 1.00 0.00 N ATOM 1185 NH2 ARG A 77 -1.550 7.087 -7.186 1.00 0.00 N ATOM 0 H ARG A 77 3.357 0.769 -4.453 1.00 0.00 H new ATOM 0 HA ARG A 77 0.919 2.189 -4.173 1.00 0.00 H new ATOM 0 HB2 ARG A 77 2.915 3.308 -4.927 1.00 0.00 H new ATOM 0 HB3 ARG A 77 3.147 2.165 -6.236 1.00 0.00 H new ATOM 0 HG2 ARG A 77 2.279 4.079 -7.294 1.00 0.00 H new ATOM 0 HG3 ARG A 77 0.902 3.002 -7.175 1.00 0.00 H new ATOM 0 HD2 ARG A 77 0.344 4.206 -4.958 1.00 0.00 H new ATOM 0 HD3 ARG A 77 1.537 5.401 -5.425 1.00 0.00 H new ATOM 0 HE ARG A 77 -0.504 4.849 -7.475 1.00 0.00 H new ATOM 0 HH11 ARG A 77 0.470 6.795 -4.696 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -0.599 8.138 -5.115 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -1.875 6.577 -8.008 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -1.921 8.015 -6.982 1.00 0.00 H new ATOM 1199 N ARG A 78 1.107 -0.031 -6.596 1.00 0.00 N ATOM 1200 CA ARG A 78 0.318 -0.777 -7.569 1.00 0.00 C ATOM 1201 C ARG A 78 -0.799 -1.556 -6.881 1.00 0.00 C ATOM 1202 O ARG A 78 -1.877 -1.746 -7.445 1.00 0.00 O ATOM 1203 CB ARG A 78 1.213 -1.736 -8.356 1.00 0.00 C ATOM 1204 CG ARG A 78 1.910 -1.085 -9.540 1.00 0.00 C ATOM 1205 CD ARG A 78 3.232 -1.769 -9.853 1.00 0.00 C ATOM 1206 NE ARG A 78 3.595 -1.639 -11.262 1.00 0.00 N ATOM 1207 CZ ARG A 78 2.906 -2.195 -12.253 1.00 0.00 C ATOM 1208 NH1 ARG A 78 1.825 -2.915 -11.990 1.00 0.00 N ATOM 1209 NH2 ARG A 78 3.300 -2.031 -13.509 1.00 0.00 N ATOM 0 H ARG A 78 2.071 -0.349 -6.502 1.00 0.00 H new ATOM 0 HA ARG A 78 -0.132 -0.063 -8.258 1.00 0.00 H new ATOM 0 HB2 ARG A 78 1.965 -2.150 -7.685 1.00 0.00 H new ATOM 0 HB3 ARG A 78 0.610 -2.571 -8.714 1.00 0.00 H new ATOM 0 HG2 ARG A 78 1.261 -1.128 -10.414 1.00 0.00 H new ATOM 0 HG3 ARG A 78 2.086 -0.031 -9.325 1.00 0.00 H new ATOM 0 HD2 ARG A 78 4.019 -1.337 -9.235 1.00 0.00 H new ATOM 0 HD3 ARG A 78 3.165 -2.825 -9.592 1.00 0.00 H new ATOM 0 HE ARG A 78 4.423 -1.092 -11.498 1.00 0.00 H new ATOM 0 HH11 ARG A 78 1.520 -3.043 -11.025 1.00 0.00 H new ATOM 0 HH12 ARG A 78 1.298 -3.341 -12.752 1.00 0.00 H new ATOM 0 HH21 ARG A 78 4.132 -1.478 -13.714 1.00 0.00 H new ATOM 0 HH22 ARG A 78 2.771 -2.458 -14.269 1.00 0.00 H new ATOM 1223 N PHE A 79 -0.534 -2.006 -5.659 1.00 0.00 N ATOM 1224 CA PHE A 79 -1.515 -2.766 -4.894 1.00 0.00 C ATOM 1225 C PHE A 79 -2.770 -1.935 -4.641 1.00 0.00 C ATOM 1226 O PHE A 79 -3.886 -2.370 -4.929 1.00 0.00 O ATOM 1227 CB PHE A 79 -0.915 -3.221 -3.562 1.00 0.00 C ATOM 1228 CG PHE A 79 -1.677 -4.339 -2.911 1.00 0.00 C ATOM 1229 CD1 PHE A 79 -3.002 -4.169 -2.542 1.00 0.00 C ATOM 1230 CD2 PHE A 79 -1.070 -5.561 -2.670 1.00 0.00 C ATOM 1231 CE1 PHE A 79 -3.705 -5.196 -1.942 1.00 0.00 C ATOM 1232 CE2 PHE A 79 -1.769 -6.592 -2.071 1.00 0.00 C ATOM 1233 CZ PHE A 79 -3.089 -6.409 -1.707 1.00 0.00 C ATOM 0 H PHE A 79 0.353 -1.857 -5.177 1.00 0.00 H new ATOM 0 HA PHE A 79 -1.792 -3.644 -5.478 1.00 0.00 H new ATOM 0 HB2 PHE A 79 0.114 -3.541 -3.727 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -0.879 -2.371 -2.880 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -3.490 -3.223 -2.725 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -0.039 -5.710 -2.954 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -4.736 -5.050 -1.657 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -1.284 -7.539 -1.888 1.00 0.00 H new ATOM 0 HZ PHE A 79 -3.638 -7.213 -1.240 1.00 0.00 H new ATOM 1243 N LEU A 80 -2.579 -0.736 -4.101 1.00 0.00 N ATOM 1244 CA LEU A 80 -3.694 0.158 -3.809 1.00 0.00 C ATOM 1245 C LEU A 80 -4.490 0.468 -5.073 1.00 0.00 C ATOM 1246 O LEU A 80 -5.706 0.645 -5.025 1.00 0.00 O ATOM 1247 CB LEU A 80 -3.183 1.456 -3.183 1.00 0.00 C ATOM 1248 CG LEU A 80 -2.199 1.300 -2.022 1.00 0.00 C ATOM 1249 CD1 LEU A 80 -1.618 2.650 -1.630 1.00 0.00 C ATOM 1250 CD2 LEU A 80 -2.881 0.645 -0.830 1.00 0.00 C ATOM 0 H LEU A 80 -1.663 -0.361 -3.857 1.00 0.00 H new ATOM 0 HA LEU A 80 -4.353 -0.344 -3.101 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -2.703 2.048 -3.963 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -4.041 2.029 -2.831 1.00 0.00 H new ATOM 0 HG LEU A 80 -1.382 0.656 -2.347 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -0.920 2.519 -0.803 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -1.093 3.082 -2.482 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -2.423 3.318 -1.324 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -2.166 0.542 -0.013 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -3.717 1.263 -0.504 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -3.248 -0.340 -1.117 1.00 0.00 H new ATOM 1262 N ASN A 81 -3.794 0.530 -6.203 1.00 0.00 N ATOM 1263 CA ASN A 81 -4.436 0.817 -7.481 1.00 0.00 C ATOM 1264 C ASN A 81 -5.481 -0.242 -7.815 1.00 0.00 C ATOM 1265 O ASN A 81 -6.299 -0.061 -8.718 1.00 0.00 O ATOM 1266 CB ASN A 81 -3.390 0.887 -8.596 1.00 0.00 C ATOM 1267 CG ASN A 81 -2.825 2.283 -8.773 1.00 0.00 C ATOM 1268 OD1 ASN A 81 -3.558 3.272 -8.729 1.00 0.00 O ATOM 1269 ND2 ASN A 81 -1.516 2.371 -8.974 1.00 0.00 N ATOM 0 H ASN A 81 -2.786 0.386 -6.260 1.00 0.00 H new ATOM 0 HA ASN A 81 -4.936 1.782 -7.399 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -2.578 0.195 -8.372 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -3.840 0.559 -9.533 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -1.080 3.284 -9.099 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -0.946 1.525 -9.003 1.00 0.00 H new ATOM 1276 N LEU A 82 -5.450 -1.349 -7.080 1.00 0.00 N ATOM 1277 CA LEU A 82 -6.396 -2.438 -7.296 1.00 0.00 C ATOM 1278 C LEU A 82 -7.760 -2.102 -6.702 1.00 0.00 C ATOM 1279 O LEU A 82 -7.877 -1.326 -5.754 1.00 0.00 O ATOM 1280 CB LEU A 82 -5.863 -3.732 -6.679 1.00 0.00 C ATOM 1281 CG LEU A 82 -4.576 -4.287 -7.289 1.00 0.00 C ATOM 1282 CD1 LEU A 82 -4.013 -5.404 -6.424 1.00 0.00 C ATOM 1283 CD2 LEU A 82 -4.828 -4.783 -8.706 1.00 0.00 C ATOM 0 H LEU A 82 -4.780 -1.516 -6.329 1.00 0.00 H new ATOM 0 HA LEU A 82 -6.513 -2.576 -8.371 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -5.693 -3.561 -5.616 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -6.637 -4.495 -6.759 1.00 0.00 H new ATOM 0 HG LEU A 82 -3.841 -3.483 -7.332 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -3.097 -5.786 -6.874 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -3.794 -5.018 -5.428 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -4.744 -6.209 -6.348 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -3.901 -5.175 -9.125 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -5.579 -5.572 -8.687 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -5.184 -3.958 -9.322 1.00 0.00 H new ATOM 1295 N PRO A 83 -8.817 -2.700 -7.271 1.00 0.00 N ATOM 1296 CA PRO A 83 -10.192 -2.481 -6.812 1.00 0.00 C ATOM 1297 C PRO A 83 -10.452 -3.102 -5.444 1.00 0.00 C ATOM 1298 O PRO A 83 -9.868 -4.129 -5.098 1.00 0.00 O ATOM 1299 CB PRO A 83 -11.038 -3.174 -7.884 1.00 0.00 C ATOM 1300 CG PRO A 83 -10.140 -4.211 -8.463 1.00 0.00 C ATOM 1301 CD PRO A 83 -8.751 -3.637 -8.405 1.00 0.00 C ATOM 0 HA PRO A 83 -10.418 -1.422 -6.690 1.00 0.00 H new ATOM 0 HB2 PRO A 83 -11.934 -3.622 -7.453 1.00 0.00 H new ATOM 0 HB3 PRO A 83 -11.369 -2.467 -8.645 1.00 0.00 H new ATOM 0 HG2 PRO A 83 -10.202 -5.141 -7.897 1.00 0.00 H new ATOM 0 HG3 PRO A 83 -10.423 -4.443 -9.490 1.00 0.00 H new ATOM 0 HD2 PRO A 83 -8.002 -4.412 -8.243 1.00 0.00 H new ATOM 0 HD3 PRO A 83 -8.487 -3.128 -9.332 1.00 0.00 H new ATOM 1309 N GLN A 84 -11.332 -2.474 -4.672 1.00 0.00 N ATOM 1310 CA GLN A 84 -11.669 -2.966 -3.341 1.00 0.00 C ATOM 1311 C GLN A 84 -11.951 -4.465 -3.370 1.00 0.00 C ATOM 1312 O GLN A 84 -11.494 -5.210 -2.503 1.00 0.00 O ATOM 1313 CB GLN A 84 -12.884 -2.217 -2.790 1.00 0.00 C ATOM 1314 CG GLN A 84 -13.286 -2.657 -1.391 1.00 0.00 C ATOM 1315 CD GLN A 84 -12.279 -2.242 -0.337 1.00 0.00 C ATOM 1316 OE1 GLN A 84 -11.073 -2.231 -0.583 1.00 0.00 O ATOM 1317 NE2 GLN A 84 -12.771 -1.898 0.848 1.00 0.00 N ATOM 0 H GLN A 84 -11.825 -1.624 -4.945 1.00 0.00 H new ATOM 0 HA GLN A 84 -10.814 -2.788 -2.688 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -12.667 -1.149 -2.778 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -13.728 -2.363 -3.465 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -14.259 -2.231 -1.146 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -13.399 -3.741 -1.374 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -13.778 -1.922 1.008 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -12.142 -1.610 1.597 1.00 0.00 H new ATOM 1326 N HIS A 85 -12.706 -4.900 -4.374 1.00 0.00 N ATOM 1327 CA HIS A 85 -13.049 -6.311 -4.516 1.00 0.00 C ATOM 1328 C HIS A 85 -11.792 -7.164 -4.655 1.00 0.00 C ATOM 1329 O HIS A 85 -11.785 -8.339 -4.289 1.00 0.00 O ATOM 1330 CB HIS A 85 -13.956 -6.517 -5.730 1.00 0.00 C ATOM 1331 CG HIS A 85 -13.208 -6.808 -6.994 1.00 0.00 C ATOM 1332 ND1 HIS A 85 -12.945 -5.850 -7.951 1.00 0.00 N ATOM 1333 CD2 HIS A 85 -12.663 -7.958 -7.456 1.00 0.00 C ATOM 1334 CE1 HIS A 85 -12.274 -6.399 -8.947 1.00 0.00 C ATOM 1335 NE2 HIS A 85 -12.089 -7.677 -8.671 1.00 0.00 N ATOM 0 H HIS A 85 -13.092 -4.297 -5.100 1.00 0.00 H new ATOM 0 HA HIS A 85 -13.581 -6.623 -3.617 1.00 0.00 H new ATOM 0 HB2 HIS A 85 -14.641 -7.340 -5.526 1.00 0.00 H new ATOM 0 HB3 HIS A 85 -14.564 -5.624 -5.875 1.00 0.00 H new ATOM 0 HD2 HIS A 85 -12.677 -8.918 -6.961 1.00 0.00 H new ATOM 0 HE1 HIS A 85 -11.934 -5.889 -9.836 1.00 0.00 H new ATOM 0 HE2 HIS A 85 -11.599 -8.347 -9.264 1.00 0.00 H new ATOM 1344 N GLU A 86 -10.731 -6.565 -5.187 1.00 0.00 N ATOM 1345 CA GLU A 86 -9.469 -7.271 -5.375 1.00 0.00 C ATOM 1346 C GLU A 86 -8.680 -7.332 -4.070 1.00 0.00 C ATOM 1347 O GLU A 86 -8.492 -8.405 -3.496 1.00 0.00 O ATOM 1348 CB GLU A 86 -8.633 -6.587 -6.458 1.00 0.00 C ATOM 1349 CG GLU A 86 -8.888 -7.127 -7.855 1.00 0.00 C ATOM 1350 CD GLU A 86 -8.070 -8.367 -8.160 1.00 0.00 C ATOM 1351 OE1 GLU A 86 -6.826 -8.266 -8.190 1.00 0.00 O ATOM 1352 OE2 GLU A 86 -8.676 -9.439 -8.368 1.00 0.00 O ATOM 0 H GLU A 86 -10.720 -5.593 -5.495 1.00 0.00 H new ATOM 0 HA GLU A 86 -9.695 -8.290 -5.690 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -8.844 -5.518 -6.447 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -7.576 -6.706 -6.219 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -9.947 -7.360 -7.963 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -8.656 -6.354 -8.587 1.00 0.00 H new ATOM 1359 N ARG A 87 -8.221 -6.174 -3.608 1.00 0.00 N ATOM 1360 CA ARG A 87 -7.451 -6.095 -2.373 1.00 0.00 C ATOM 1361 C ARG A 87 -8.039 -7.014 -1.306 1.00 0.00 C ATOM 1362 O ARG A 87 -7.312 -7.745 -0.633 1.00 0.00 O ATOM 1363 CB ARG A 87 -7.417 -4.654 -1.859 1.00 0.00 C ATOM 1364 CG ARG A 87 -7.225 -3.620 -2.956 1.00 0.00 C ATOM 1365 CD ARG A 87 -6.644 -2.327 -2.406 1.00 0.00 C ATOM 1366 NE ARG A 87 -7.093 -1.161 -3.163 1.00 0.00 N ATOM 1367 CZ ARG A 87 -8.236 -0.528 -2.928 1.00 0.00 C ATOM 1368 NH1 ARG A 87 -9.043 -0.946 -1.963 1.00 0.00 N ATOM 1369 NH2 ARG A 87 -8.575 0.526 -3.660 1.00 0.00 N ATOM 0 H ARG A 87 -8.369 -5.277 -4.071 1.00 0.00 H new ATOM 0 HA ARG A 87 -6.433 -6.421 -2.587 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -8.347 -4.443 -1.332 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -6.610 -4.555 -1.133 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -6.563 -4.021 -3.723 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -8.182 -3.415 -3.436 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -6.934 -2.215 -1.361 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -5.556 -2.379 -2.431 1.00 0.00 H new ATOM 0 HE ARG A 87 -6.495 -0.814 -3.913 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -8.786 -1.756 -1.399 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -9.921 -0.458 -1.785 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -7.957 0.850 -4.404 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -9.453 1.012 -3.479 1.00 0.00 H new ATOM 1383 N ASP A 88 -9.358 -6.971 -1.158 1.00 0.00 N ATOM 1384 CA ASP A 88 -10.044 -7.800 -0.173 1.00 0.00 C ATOM 1385 C ASP A 88 -9.721 -9.276 -0.386 1.00 0.00 C ATOM 1386 O ASP A 88 -9.514 -10.021 0.572 1.00 0.00 O ATOM 1387 CB ASP A 88 -11.555 -7.579 -0.254 1.00 0.00 C ATOM 1388 CG ASP A 88 -12.027 -6.465 0.659 1.00 0.00 C ATOM 1389 OD1 ASP A 88 -11.964 -5.290 0.242 1.00 0.00 O ATOM 1390 OD2 ASP A 88 -12.459 -6.768 1.792 1.00 0.00 O ATOM 0 H ASP A 88 -9.974 -6.371 -1.707 1.00 0.00 H new ATOM 0 HA ASP A 88 -9.694 -7.509 0.818 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -11.830 -7.343 -1.282 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -12.069 -8.503 0.010 1.00 0.00 H new ATOM 1395 N VAL A 89 -9.679 -9.692 -1.647 1.00 0.00 N ATOM 1396 CA VAL A 89 -9.381 -11.078 -1.986 1.00 0.00 C ATOM 1397 C VAL A 89 -7.969 -11.458 -1.554 1.00 0.00 C ATOM 1398 O VAL A 89 -7.765 -12.474 -0.889 1.00 0.00 O ATOM 1399 CB VAL A 89 -9.530 -11.331 -3.498 1.00 0.00 C ATOM 1400 CG1 VAL A 89 -9.221 -12.783 -3.830 1.00 0.00 C ATOM 1401 CG2 VAL A 89 -10.927 -10.954 -3.966 1.00 0.00 C ATOM 0 H VAL A 89 -9.848 -9.088 -2.452 1.00 0.00 H new ATOM 0 HA VAL A 89 -10.101 -11.697 -1.450 1.00 0.00 H new ATOM 0 HB VAL A 89 -8.813 -10.702 -4.026 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -9.332 -12.942 -4.903 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -8.198 -13.015 -3.532 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -9.911 -13.434 -3.293 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -11.014 -11.139 -5.037 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -11.664 -11.554 -3.433 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -11.105 -9.898 -3.765 1.00 0.00 H new ATOM 1411 N ILE A 90 -6.998 -10.636 -1.937 1.00 0.00 N ATOM 1412 CA ILE A 90 -5.605 -10.885 -1.588 1.00 0.00 C ATOM 1413 C ILE A 90 -5.446 -11.107 -0.088 1.00 0.00 C ATOM 1414 O ILE A 90 -4.842 -12.089 0.344 1.00 0.00 O ATOM 1415 CB ILE A 90 -4.699 -9.717 -2.022 1.00 0.00 C ATOM 1416 CG1 ILE A 90 -4.713 -9.571 -3.545 1.00 0.00 C ATOM 1417 CG2 ILE A 90 -3.280 -9.933 -1.518 1.00 0.00 C ATOM 1418 CD1 ILE A 90 -4.243 -8.216 -4.025 1.00 0.00 C ATOM 0 H ILE A 90 -7.150 -9.792 -2.489 1.00 0.00 H new ATOM 0 HA ILE A 90 -5.302 -11.787 -2.120 1.00 0.00 H new ATOM 0 HB ILE A 90 -5.083 -8.796 -1.584 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -4.079 -10.343 -3.982 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -5.725 -9.746 -3.910 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -2.651 -9.100 -1.832 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -3.286 -9.993 -0.430 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -2.885 -10.861 -1.930 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -4.279 -8.183 -5.114 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -4.891 -7.441 -3.617 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -3.220 -8.046 -3.690 1.00 0.00 H new ATOM 1430 N TYR A 91 -5.993 -10.190 0.702 1.00 0.00 N ATOM 1431 CA TYR A 91 -5.911 -10.286 2.155 1.00 0.00 C ATOM 1432 C TYR A 91 -6.607 -11.546 2.658 1.00 0.00 C ATOM 1433 O TYR A 91 -6.083 -12.258 3.514 1.00 0.00 O ATOM 1434 CB TYR A 91 -6.537 -9.050 2.804 1.00 0.00 C ATOM 1435 CG TYR A 91 -5.957 -7.745 2.306 1.00 0.00 C ATOM 1436 CD1 TYR A 91 -4.600 -7.474 2.425 1.00 0.00 C ATOM 1437 CD2 TYR A 91 -6.768 -6.784 1.715 1.00 0.00 C ATOM 1438 CE1 TYR A 91 -4.067 -6.283 1.973 1.00 0.00 C ATOM 1439 CE2 TYR A 91 -6.243 -5.590 1.258 1.00 0.00 C ATOM 1440 CZ TYR A 91 -4.892 -5.344 1.389 1.00 0.00 C ATOM 1441 OH TYR A 91 -4.365 -4.157 0.935 1.00 0.00 O ATOM 0 H TYR A 91 -6.498 -9.372 0.361 1.00 0.00 H new ATOM 0 HA TYR A 91 -4.858 -10.340 2.432 1.00 0.00 H new ATOM 0 HB2 TYR A 91 -7.611 -9.056 2.616 1.00 0.00 H new ATOM 0 HB3 TYR A 91 -6.402 -9.109 3.884 1.00 0.00 H new ATOM 0 HD1 TYR A 91 -3.950 -8.208 2.879 1.00 0.00 H new ATOM 0 HD2 TYR A 91 -7.826 -6.973 1.611 1.00 0.00 H new ATOM 0 HE1 TYR A 91 -3.010 -6.088 2.076 1.00 0.00 H new ATOM 0 HE2 TYR A 91 -6.887 -4.853 0.801 1.00 0.00 H new ATOM 0 HH TYR A 91 -4.078 -4.261 0.004 1.00 0.00 H new ATOM 1451 N GLU A 92 -7.792 -11.816 2.118 1.00 0.00 N ATOM 1452 CA GLU A 92 -8.561 -12.990 2.512 1.00 0.00 C ATOM 1453 C GLU A 92 -7.771 -14.270 2.252 1.00 0.00 C ATOM 1454 O GLU A 92 -7.494 -15.037 3.173 1.00 0.00 O ATOM 1455 CB GLU A 92 -9.890 -13.035 1.755 1.00 0.00 C ATOM 1456 CG GLU A 92 -10.914 -12.034 2.263 1.00 0.00 C ATOM 1457 CD GLU A 92 -11.433 -12.381 3.645 1.00 0.00 C ATOM 1458 OE1 GLU A 92 -11.793 -13.556 3.865 1.00 0.00 O ATOM 1459 OE2 GLU A 92 -11.479 -11.477 4.506 1.00 0.00 O ATOM 0 H GLU A 92 -8.240 -11.238 1.407 1.00 0.00 H new ATOM 0 HA GLU A 92 -8.763 -12.919 3.581 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -9.703 -12.846 0.698 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -10.308 -14.039 1.830 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -10.465 -11.041 2.286 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -11.750 -11.990 1.565 1.00 0.00 H new ATOM 1466 N GLU A 93 -7.414 -14.492 0.991 1.00 0.00 N ATOM 1467 CA GLU A 93 -6.658 -15.679 0.610 1.00 0.00 C ATOM 1468 C GLU A 93 -5.399 -15.819 1.461 1.00 0.00 C ATOM 1469 O GLU A 93 -5.043 -16.918 1.884 1.00 0.00 O ATOM 1470 CB GLU A 93 -6.280 -15.616 -0.872 1.00 0.00 C ATOM 1471 CG GLU A 93 -7.478 -15.616 -1.806 1.00 0.00 C ATOM 1472 CD GLU A 93 -7.166 -16.233 -3.156 1.00 0.00 C ATOM 1473 OE1 GLU A 93 -6.609 -15.522 -4.018 1.00 0.00 O ATOM 1474 OE2 GLU A 93 -7.478 -17.427 -3.348 1.00 0.00 O ATOM 0 H GLU A 93 -7.636 -13.866 0.217 1.00 0.00 H new ATOM 0 HA GLU A 93 -7.290 -16.551 0.780 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -5.691 -14.716 -1.050 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -5.643 -16.467 -1.112 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -8.297 -16.165 -1.341 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -7.822 -14.592 -1.950 1.00 0.00 H new ATOM 1481 N GLU A 94 -4.730 -14.697 1.707 1.00 0.00 N ATOM 1482 CA GLU A 94 -3.510 -14.695 2.506 1.00 0.00 C ATOM 1483 C GLU A 94 -3.809 -15.069 3.955 1.00 0.00 C ATOM 1484 O GLU A 94 -3.387 -16.121 4.436 1.00 0.00 O ATOM 1485 CB GLU A 94 -2.840 -13.321 2.451 1.00 0.00 C ATOM 1486 CG GLU A 94 -1.578 -13.225 3.292 1.00 0.00 C ATOM 1487 CD GLU A 94 -0.487 -14.166 2.817 1.00 0.00 C ATOM 1488 OE1 GLU A 94 -0.408 -14.412 1.595 1.00 0.00 O ATOM 1489 OE2 GLU A 94 0.285 -14.656 3.666 1.00 0.00 O ATOM 0 H GLU A 94 -5.012 -13.778 1.365 1.00 0.00 H new ATOM 0 HA GLU A 94 -2.831 -15.439 2.089 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -2.595 -13.087 1.415 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -3.550 -12.566 2.789 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -1.206 -12.201 3.266 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -1.820 -13.450 4.331 1.00 0.00 H new ATOM 1496 N SER A 95 -4.539 -14.200 4.646 1.00 0.00 N ATOM 1497 CA SER A 95 -4.891 -14.436 6.042 1.00 0.00 C ATOM 1498 C SER A 95 -6.401 -14.343 6.244 1.00 0.00 C ATOM 1499 O SER A 95 -7.001 -13.287 6.046 1.00 0.00 O ATOM 1500 CB SER A 95 -4.181 -13.427 6.946 1.00 0.00 C ATOM 1501 OG SER A 95 -4.024 -13.940 8.258 1.00 0.00 O ATOM 0 H SER A 95 -4.899 -13.326 4.262 1.00 0.00 H new ATOM 0 HA SER A 95 -4.567 -15.442 6.308 1.00 0.00 H new ATOM 0 HB2 SER A 95 -3.204 -13.184 6.528 1.00 0.00 H new ATOM 0 HB3 SER A 95 -4.753 -12.500 6.981 1.00 0.00 H new ATOM 0 HG SER A 95 -3.566 -13.277 8.816 1.00 0.00 H new ATOM 1507 N SER A 96 -7.007 -15.458 6.640 1.00 0.00 N ATOM 1508 CA SER A 96 -8.447 -15.505 6.866 1.00 0.00 C ATOM 1509 C SER A 96 -8.875 -14.436 7.867 1.00 0.00 C ATOM 1510 O SER A 96 -8.308 -14.324 8.953 1.00 0.00 O ATOM 1511 CB SER A 96 -8.860 -16.889 7.372 1.00 0.00 C ATOM 1512 OG SER A 96 -8.331 -17.138 8.663 1.00 0.00 O ATOM 0 H SER A 96 -6.524 -16.340 6.811 1.00 0.00 H new ATOM 0 HA SER A 96 -8.946 -15.309 5.917 1.00 0.00 H new ATOM 0 HB2 SER A 96 -9.947 -16.960 7.401 1.00 0.00 H new ATOM 0 HB3 SER A 96 -8.509 -17.653 6.678 1.00 0.00 H new ATOM 0 HG SER A 96 -8.039 -16.293 9.065 1.00 0.00 H new ATOM 1518 N GLY A 97 -9.882 -13.652 7.492 1.00 0.00 N ATOM 1519 CA GLY A 97 -10.370 -12.602 8.367 1.00 0.00 C ATOM 1520 C GLY A 97 -11.880 -12.474 8.332 1.00 0.00 C ATOM 1521 O GLY A 97 -12.530 -12.813 7.344 1.00 0.00 O ATOM 0 H GLY A 97 -10.368 -13.726 6.598 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -10.049 -12.806 9.389 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -9.921 -11.652 8.076 1.00 0.00 H new ATOM 1525 N PRO A 98 -12.460 -11.974 9.433 1.00 0.00 N ATOM 1526 CA PRO A 98 -13.910 -11.791 9.550 1.00 0.00 C ATOM 1527 C PRO A 98 -14.428 -10.674 8.651 1.00 0.00 C ATOM 1528 O PRO A 98 -13.823 -9.605 8.562 1.00 0.00 O ATOM 1529 CB PRO A 98 -14.104 -11.425 11.024 1.00 0.00 C ATOM 1530 CG PRO A 98 -12.804 -10.830 11.440 1.00 0.00 C ATOM 1531 CD PRO A 98 -11.746 -11.549 10.649 1.00 0.00 C ATOM 0 HA PRO A 98 -14.459 -12.681 9.242 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -14.923 -10.717 11.152 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -14.347 -12.304 11.622 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -12.782 -9.759 11.237 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -12.643 -10.955 12.511 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -10.906 -10.895 10.414 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -11.344 -12.401 11.197 1.00 0.00 H new ATOM 1539 N SER A 99 -15.550 -10.928 7.986 1.00 0.00 N ATOM 1540 CA SER A 99 -16.148 -9.944 7.091 1.00 0.00 C ATOM 1541 C SER A 99 -16.400 -8.628 7.821 1.00 0.00 C ATOM 1542 O SER A 99 -16.252 -8.543 9.040 1.00 0.00 O ATOM 1543 CB SER A 99 -17.459 -10.479 6.512 1.00 0.00 C ATOM 1544 OG SER A 99 -17.724 -9.913 5.240 1.00 0.00 O ATOM 0 H SER A 99 -16.064 -11.807 8.050 1.00 0.00 H new ATOM 0 HA SER A 99 -15.449 -9.759 6.276 1.00 0.00 H new ATOM 0 HB2 SER A 99 -17.406 -11.564 6.427 1.00 0.00 H new ATOM 0 HB3 SER A 99 -18.280 -10.252 7.192 1.00 0.00 H new ATOM 0 HG SER A 99 -18.566 -10.272 4.891 1.00 0.00 H new ATOM 1550 N SER A 100 -16.782 -7.603 7.065 1.00 0.00 N ATOM 1551 CA SER A 100 -17.052 -6.290 7.638 1.00 0.00 C ATOM 1552 C SER A 100 -18.546 -6.100 7.883 1.00 0.00 C ATOM 1553 O SER A 100 -19.358 -6.951 7.523 1.00 0.00 O ATOM 1554 CB SER A 100 -16.532 -5.189 6.711 1.00 0.00 C ATOM 1555 OG SER A 100 -17.198 -5.218 5.461 1.00 0.00 O ATOM 0 H SER A 100 -16.911 -7.657 6.055 1.00 0.00 H new ATOM 0 HA SER A 100 -16.534 -6.225 8.595 1.00 0.00 H new ATOM 0 HB2 SER A 100 -16.676 -4.216 7.181 1.00 0.00 H new ATOM 0 HB3 SER A 100 -15.460 -5.314 6.558 1.00 0.00 H new ATOM 0 HG SER A 100 -16.849 -4.504 4.888 1.00 0.00 H new ATOM 1561 N GLY A 101 -18.901 -4.976 8.499 1.00 0.00 N ATOM 1562 CA GLY A 101 -20.296 -4.694 8.782 1.00 0.00 C ATOM 1563 C GLY A 101 -20.623 -4.812 10.257 1.00 0.00 C ATOM 1564 O GLY A 101 -20.941 -3.818 10.910 1.00 0.00 O ATOM 0 H GLY A 101 -18.247 -4.256 8.807 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -20.537 -3.688 8.439 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -20.925 -5.383 8.217 1.00 0.00 H new TER 1568 GLY A 101