USER MOD reduce.3.24.130724 H: found=0, std=0, add=1017, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 1016 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 85 GLN : amide:sc= -0.279 K(o=-0.36,f=-1.7) USER MOD Set 1.2: A 92 LYS NZ :NH3+ -164:sc= -0.0846 (180deg=0) USER MOD Set 2.1: A 20 MET CE :methyl 159:sc= -1.01 (180deg=-1.42) USER MOD Set 2.2: A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 SER OG : rot 73:sc= 0.373 USER MOD Single : A 15 THR OG1 : rot 170:sc= 1.43 USER MOD Single : A 16 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 19 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 SER OG : rot -36:sc= 0.0379 USER MOD Single : A 33 THR OG1 : rot 180:sc= -0.304 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 SER OG : rot 77:sc= 0.821 USER MOD Single : A 43 LYS NZ :NH3+ -164:sc= 1.25 (180deg=1.19) USER MOD Single : A 45 LYS NZ :NH3+ 152:sc= 0.357 (180deg=0.0938) USER MOD Single : A 51 GLN : amide:sc= -1.94! C(o=-1.9!,f=-1.3!) USER MOD Single : A 56 ASN : amide:sc= -3.95! C(o=-3.9!,f=-2.4!) USER MOD Single : A 59 THR OG1 : rot -61:sc= 1.89 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 71 ASN : amide:sc= -0.139 X(o=-0.14,f=-0.1) USER MOD Single : A 73 ASN : amide:sc= -1.17 K(o=-1.2,f=-0.39) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 THR OG1 : rot 8:sc= 0.981 USER MOD Single : A 78 LYS NZ :NH3+ -179:sc= 1.93 (180deg=1.87) USER MOD Single : A 89 LYS NZ :NH3+ -171:sc= 1.16 (180deg=0.785) USER MOD Single : A 90 ASN : amide:sc= -0.0201 K(o=-0.02,f=-1) USER MOD Single : A 91 GLN : amide:sc= -2.48! K(o=-2.5!,f=-1.6) USER MOD Single : A 97 GLN : amide:sc= -1.25 K(o=-1.3,f=-2.5) USER MOD Single : A 99 LYS NZ :NH3+ -114:sc= 0.277 (180deg=0) USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 LYS NZ :NH3+ -139:sc= 0.792 (180deg=0.187) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 GLN : amide:sc= 0.537 K(o=0.54,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -18.697 -19.423 -9.852 1.00 0.00 N ATOM 2 CA GLY A 1 -19.543 -18.310 -9.459 1.00 0.00 C ATOM 3 C GLY A 1 -18.816 -17.408 -8.502 1.00 0.00 C ATOM 4 O GLY A 1 -18.438 -17.851 -7.406 1.00 0.00 O ATOM 0 H1 GLY A 1 -19.215 -20.036 -10.513 1.00 0.00 H new ATOM 0 H2 GLY A 1 -17.839 -19.060 -10.315 1.00 0.00 H new ATOM 0 H3 GLY A 1 -18.430 -19.971 -9.009 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -19.845 -17.746 -10.341 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -20.454 -18.685 -8.993 1.00 0.00 H new ATOM 10 N PRO A 2 -18.558 -16.138 -8.889 1.00 0.00 N ATOM 11 CA PRO A 2 -17.845 -15.195 -8.046 1.00 0.00 C ATOM 12 C PRO A 2 -18.621 -14.841 -6.780 1.00 0.00 C ATOM 13 O PRO A 2 -19.775 -14.377 -6.830 1.00 0.00 O ATOM 14 CB PRO A 2 -17.647 -13.961 -8.932 1.00 0.00 C ATOM 15 CG PRO A 2 -18.696 -14.067 -9.976 1.00 0.00 C ATOM 16 CD PRO A 2 -18.935 -15.535 -10.187 1.00 0.00 C ATOM 0 HA PRO A 2 -16.904 -15.614 -7.690 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -17.753 -13.041 -8.357 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -16.650 -13.948 -9.373 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -19.611 -13.566 -9.660 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -18.374 -13.589 -10.901 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -19.976 -15.740 -10.437 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -18.328 -15.927 -11.003 1.00 0.00 H new ATOM 24 N LEU A 3 -17.995 -15.074 -5.671 1.00 0.00 N ATOM 25 CA LEU A 3 -18.566 -14.801 -4.382 1.00 0.00 C ATOM 26 C LEU A 3 -17.935 -13.513 -3.880 1.00 0.00 C ATOM 27 O LEU A 3 -16.926 -13.068 -4.460 1.00 0.00 O ATOM 28 CB LEU A 3 -18.219 -15.964 -3.434 1.00 0.00 C ATOM 29 CG LEU A 3 -18.863 -15.960 -2.048 1.00 0.00 C ATOM 30 CD1 LEU A 3 -20.363 -16.189 -2.152 1.00 0.00 C ATOM 31 CD2 LEU A 3 -18.218 -17.009 -1.164 1.00 0.00 C ATOM 0 H LEU A 3 -17.055 -15.467 -5.630 1.00 0.00 H new ATOM 0 HA LEU A 3 -19.650 -14.699 -4.432 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -18.493 -16.895 -3.930 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -17.137 -15.979 -3.302 1.00 0.00 H new ATOM 0 HG LEU A 3 -18.702 -14.982 -1.594 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -20.802 -16.183 -1.154 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -20.811 -15.396 -2.751 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -20.552 -17.153 -2.625 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -18.687 -16.994 -0.180 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -18.348 -17.994 -1.613 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -17.154 -16.795 -1.062 1.00 0.00 H new ATOM 43 N GLY A 4 -18.502 -12.918 -2.835 1.00 0.00 N ATOM 44 CA GLY A 4 -17.939 -11.722 -2.233 1.00 0.00 C ATOM 45 C GLY A 4 -16.652 -12.043 -1.500 1.00 0.00 C ATOM 46 O GLY A 4 -16.606 -12.093 -0.271 1.00 0.00 O ATOM 0 H GLY A 4 -19.356 -13.250 -2.388 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -17.747 -10.977 -3.005 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -18.658 -11.285 -1.540 1.00 0.00 H new ATOM 50 N SER A 5 -15.639 -12.279 -2.261 1.00 0.00 N ATOM 51 CA SER A 5 -14.364 -12.661 -1.779 1.00 0.00 C ATOM 52 C SER A 5 -13.533 -11.412 -1.524 1.00 0.00 C ATOM 53 O SER A 5 -13.536 -10.492 -2.360 1.00 0.00 O ATOM 54 CB SER A 5 -13.717 -13.529 -2.850 1.00 0.00 C ATOM 55 OG SER A 5 -14.618 -14.575 -3.250 1.00 0.00 O ATOM 0 H SER A 5 -15.682 -12.207 -3.278 1.00 0.00 H new ATOM 0 HA SER A 5 -14.439 -13.216 -0.844 1.00 0.00 H new ATOM 0 HB2 SER A 5 -13.451 -12.918 -3.713 1.00 0.00 H new ATOM 0 HB3 SER A 5 -12.792 -13.961 -2.469 1.00 0.00 H new ATOM 0 HG SER A 5 -15.344 -14.194 -3.786 1.00 0.00 H new ATOM 61 N PRO A 6 -12.861 -11.322 -0.360 1.00 0.00 N ATOM 62 CA PRO A 6 -12.014 -10.183 -0.039 1.00 0.00 C ATOM 63 C PRO A 6 -10.814 -10.098 -0.975 1.00 0.00 C ATOM 64 O PRO A 6 -9.889 -10.927 -0.910 1.00 0.00 O ATOM 65 CB PRO A 6 -11.555 -10.441 1.408 1.00 0.00 C ATOM 66 CG PRO A 6 -12.476 -11.487 1.928 1.00 0.00 C ATOM 67 CD PRO A 6 -12.879 -12.306 0.739 1.00 0.00 C ATOM 0 HA PRO A 6 -12.546 -9.238 -0.150 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -10.519 -10.778 1.438 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -11.612 -9.532 2.007 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -11.982 -12.104 2.679 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -13.346 -11.038 2.407 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -12.184 -13.126 0.559 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -13.867 -12.748 0.869 1.00 0.00 H new ATOM 75 N LEU A 7 -10.899 -9.177 -1.901 1.00 0.00 N ATOM 76 CA LEU A 7 -9.821 -8.874 -2.825 1.00 0.00 C ATOM 77 C LEU A 7 -9.519 -7.407 -2.690 1.00 0.00 C ATOM 78 O LEU A 7 -8.370 -6.991 -2.684 1.00 0.00 O ATOM 79 CB LEU A 7 -10.215 -9.201 -4.269 1.00 0.00 C ATOM 80 CG LEU A 7 -10.533 -10.665 -4.576 1.00 0.00 C ATOM 81 CD1 LEU A 7 -10.957 -10.805 -6.016 1.00 0.00 C ATOM 82 CD2 LEU A 7 -9.330 -11.560 -4.294 1.00 0.00 C ATOM 0 H LEU A 7 -11.731 -8.604 -2.041 1.00 0.00 H new ATOM 0 HA LEU A 7 -8.946 -9.480 -2.588 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -11.087 -8.601 -4.529 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -9.404 -8.884 -4.924 1.00 0.00 H new ATOM 0 HG LEU A 7 -11.349 -10.982 -3.926 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -11.182 -11.850 -6.229 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -11.845 -10.199 -6.194 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -10.151 -10.468 -6.667 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -9.585 -12.595 -4.521 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -8.491 -11.248 -4.916 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -9.053 -11.477 -3.243 1.00 0.00 H new ATOM 94 N ILE A 8 -10.584 -6.625 -2.648 1.00 0.00 N ATOM 95 CA ILE A 8 -10.534 -5.235 -2.298 1.00 0.00 C ATOM 96 C ILE A 8 -11.427 -5.080 -1.096 1.00 0.00 C ATOM 97 O ILE A 8 -12.651 -4.920 -1.224 1.00 0.00 O ATOM 98 CB ILE A 8 -11.007 -4.276 -3.438 1.00 0.00 C ATOM 99 CG1 ILE A 8 -10.167 -4.479 -4.684 1.00 0.00 C ATOM 100 CG2 ILE A 8 -10.933 -2.810 -2.994 1.00 0.00 C ATOM 101 CD1 ILE A 8 -10.656 -5.561 -5.631 1.00 0.00 C ATOM 0 H ILE A 8 -11.524 -6.956 -2.863 1.00 0.00 H new ATOM 0 HA ILE A 8 -9.499 -4.954 -2.103 1.00 0.00 H new ATOM 0 HB ILE A 8 -12.046 -4.515 -3.664 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -10.122 -3.536 -5.229 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -9.148 -4.720 -4.380 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -11.268 -2.166 -3.807 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -11.574 -2.660 -2.125 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -9.904 -2.560 -2.734 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -9.986 -5.624 -6.488 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -10.672 -6.519 -5.111 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -11.661 -5.317 -5.974 1.00 0.00 H new ATOM 113 N GLY A 9 -10.847 -5.216 0.053 1.00 0.00 N ATOM 114 CA GLY A 9 -11.631 -5.220 1.258 1.00 0.00 C ATOM 115 C GLY A 9 -11.011 -4.428 2.359 1.00 0.00 C ATOM 116 O GLY A 9 -10.606 -3.276 2.158 1.00 0.00 O ATOM 0 H GLY A 9 -9.842 -5.325 0.188 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -12.621 -4.819 1.042 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -11.770 -6.248 1.591 1.00 0.00 H new ATOM 120 N GLU A 10 -10.926 -5.024 3.518 1.00 0.00 N ATOM 121 CA GLU A 10 -10.388 -4.373 4.681 1.00 0.00 C ATOM 122 C GLU A 10 -9.227 -5.155 5.239 1.00 0.00 C ATOM 123 O GLU A 10 -9.215 -6.393 5.223 1.00 0.00 O ATOM 124 CB GLU A 10 -11.456 -4.186 5.748 1.00 0.00 C ATOM 125 CG GLU A 10 -12.612 -3.322 5.304 1.00 0.00 C ATOM 126 CD GLU A 10 -13.592 -3.090 6.400 1.00 0.00 C ATOM 127 OE1 GLU A 10 -13.335 -2.225 7.244 1.00 0.00 O ATOM 128 OE2 GLU A 10 -14.646 -3.769 6.433 1.00 0.00 O ATOM 0 H GLU A 10 -11.231 -5.983 3.682 1.00 0.00 H new ATOM 0 HA GLU A 10 -10.033 -3.388 4.376 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -11.837 -5.164 6.044 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -11.000 -3.741 6.632 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -12.232 -2.364 4.949 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -13.116 -3.797 4.462 1.00 0.00 H new ATOM 135 N ILE A 11 -8.259 -4.446 5.724 1.00 0.00 N ATOM 136 CA ILE A 11 -7.092 -5.053 6.264 1.00 0.00 C ATOM 137 C ILE A 11 -7.138 -5.007 7.769 1.00 0.00 C ATOM 138 O ILE A 11 -7.195 -3.932 8.375 1.00 0.00 O ATOM 139 CB ILE A 11 -5.816 -4.367 5.787 1.00 0.00 C ATOM 140 CG1 ILE A 11 -5.747 -4.366 4.316 1.00 0.00 C ATOM 141 CG2 ILE A 11 -4.602 -5.071 6.303 1.00 0.00 C ATOM 142 CD1 ILE A 11 -4.528 -3.657 3.784 1.00 0.00 C ATOM 0 H ILE A 11 -8.258 -3.426 5.755 1.00 0.00 H new ATOM 0 HA ILE A 11 -7.075 -6.086 5.915 1.00 0.00 H new ATOM 0 HB ILE A 11 -5.841 -3.345 6.166 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -5.747 -5.395 3.957 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -6.642 -3.889 3.916 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -3.707 -4.561 5.948 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -4.614 -5.066 7.393 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -4.599 -6.101 5.945 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -4.534 -3.690 2.695 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -4.537 -2.619 4.115 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -3.629 -4.149 4.157 1.00 0.00 H new ATOM 154 N GLY A 12 -7.148 -6.151 8.342 1.00 0.00 N ATOM 155 CA GLY A 12 -7.100 -6.300 9.741 1.00 0.00 C ATOM 156 C GLY A 12 -6.047 -7.310 10.078 1.00 0.00 C ATOM 157 O GLY A 12 -5.442 -7.892 9.149 1.00 0.00 O ATOM 0 H GLY A 12 -7.191 -7.034 7.833 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -6.874 -5.345 10.216 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -8.069 -6.623 10.121 1.00 0.00 H new ATOM 161 N PRO A 13 -5.806 -7.584 11.364 1.00 0.00 N ATOM 162 CA PRO A 13 -4.771 -8.536 11.808 1.00 0.00 C ATOM 163 C PRO A 13 -4.962 -9.946 11.222 1.00 0.00 C ATOM 164 O PRO A 13 -4.000 -10.666 10.973 1.00 0.00 O ATOM 165 CB PRO A 13 -4.940 -8.570 13.338 1.00 0.00 C ATOM 166 CG PRO A 13 -6.294 -7.998 13.591 1.00 0.00 C ATOM 167 CD PRO A 13 -6.512 -6.985 12.513 1.00 0.00 C ATOM 0 HA PRO A 13 -3.780 -8.226 11.478 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -4.864 -9.588 13.721 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -4.166 -7.984 13.833 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -7.059 -8.774 13.560 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -6.347 -7.538 14.578 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -7.571 -6.835 12.305 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -6.099 -6.012 12.781 1.00 0.00 H new ATOM 175 N GLU A 14 -6.185 -10.302 10.957 1.00 0.00 N ATOM 176 CA GLU A 14 -6.511 -11.621 10.476 1.00 0.00 C ATOM 177 C GLU A 14 -6.729 -11.684 8.963 1.00 0.00 C ATOM 178 O GLU A 14 -6.833 -12.774 8.390 1.00 0.00 O ATOM 179 CB GLU A 14 -7.683 -12.230 11.276 1.00 0.00 C ATOM 180 CG GLU A 14 -8.650 -11.211 11.901 1.00 0.00 C ATOM 181 CD GLU A 14 -9.304 -10.281 10.911 1.00 0.00 C ATOM 182 OE1 GLU A 14 -10.400 -10.604 10.399 1.00 0.00 O ATOM 183 OE2 GLU A 14 -8.750 -9.196 10.665 1.00 0.00 O ATOM 0 H GLU A 14 -6.991 -9.686 11.067 1.00 0.00 H new ATOM 0 HA GLU A 14 -5.634 -12.244 10.654 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -8.250 -12.887 10.616 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -7.274 -12.853 12.071 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -9.427 -11.751 12.441 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -8.106 -10.616 12.635 1.00 0.00 H new ATOM 190 N THR A 15 -6.780 -10.543 8.302 1.00 0.00 N ATOM 191 CA THR A 15 -6.950 -10.567 6.871 1.00 0.00 C ATOM 192 C THR A 15 -5.636 -10.310 6.180 1.00 0.00 C ATOM 193 O THR A 15 -5.331 -10.929 5.166 1.00 0.00 O ATOM 194 CB THR A 15 -8.025 -9.572 6.369 1.00 0.00 C ATOM 195 OG1 THR A 15 -7.665 -8.230 6.701 1.00 0.00 O ATOM 196 CG2 THR A 15 -9.355 -9.882 6.998 1.00 0.00 C ATOM 0 H THR A 15 -6.708 -9.616 8.722 1.00 0.00 H new ATOM 0 HA THR A 15 -7.306 -11.566 6.618 1.00 0.00 H new ATOM 0 HB THR A 15 -8.094 -9.673 5.286 1.00 0.00 H new ATOM 0 HG1 THR A 15 -8.264 -7.607 6.239 1.00 0.00 H new ATOM 0 HG21 THR A 15 -10.102 -9.175 6.637 1.00 0.00 H new ATOM 0 HG22 THR A 15 -9.656 -10.895 6.732 1.00 0.00 H new ATOM 0 HG23 THR A 15 -9.273 -9.800 8.082 1.00 0.00 H new ATOM 204 N TYR A 16 -4.810 -9.441 6.771 1.00 0.00 N ATOM 205 CA TYR A 16 -3.547 -9.073 6.139 1.00 0.00 C ATOM 206 C TYR A 16 -2.636 -10.276 5.992 1.00 0.00 C ATOM 207 O TYR A 16 -1.900 -10.383 5.021 1.00 0.00 O ATOM 208 CB TYR A 16 -2.816 -7.923 6.868 1.00 0.00 C ATOM 209 CG TYR A 16 -1.802 -8.325 7.933 1.00 0.00 C ATOM 210 CD1 TYR A 16 -2.181 -8.594 9.235 1.00 0.00 C ATOM 211 CD2 TYR A 16 -0.449 -8.426 7.612 1.00 0.00 C ATOM 212 CE1 TYR A 16 -1.245 -8.957 10.189 1.00 0.00 C ATOM 213 CE2 TYR A 16 0.484 -8.787 8.553 1.00 0.00 C ATOM 214 CZ TYR A 16 0.084 -9.053 9.838 1.00 0.00 C ATOM 215 OH TYR A 16 1.020 -9.417 10.776 1.00 0.00 O ATOM 0 H TYR A 16 -4.991 -8.989 7.668 1.00 0.00 H new ATOM 0 HA TYR A 16 -3.803 -8.703 5.146 1.00 0.00 H new ATOM 0 HB2 TYR A 16 -2.303 -7.318 6.121 1.00 0.00 H new ATOM 0 HB3 TYR A 16 -3.566 -7.285 7.335 1.00 0.00 H new ATOM 0 HD1 TYR A 16 -3.222 -8.520 9.512 1.00 0.00 H new ATOM 0 HD2 TYR A 16 -0.128 -8.216 6.602 1.00 0.00 H new ATOM 0 HE1 TYR A 16 -1.555 -9.164 11.203 1.00 0.00 H new ATOM 0 HE2 TYR A 16 1.527 -8.861 8.283 1.00 0.00 H new ATOM 0 HH TYR A 16 1.908 -9.437 10.361 1.00 0.00 H new ATOM 225 N SER A 17 -2.742 -11.200 6.937 1.00 0.00 N ATOM 226 CA SER A 17 -1.921 -12.389 6.969 1.00 0.00 C ATOM 227 C SER A 17 -2.205 -13.244 5.725 1.00 0.00 C ATOM 228 O SER A 17 -1.318 -13.909 5.194 1.00 0.00 O ATOM 229 CB SER A 17 -2.207 -13.176 8.268 1.00 0.00 C ATOM 230 OG SER A 17 -1.244 -14.191 8.496 1.00 0.00 O ATOM 0 H SER A 17 -3.408 -11.139 7.707 1.00 0.00 H new ATOM 0 HA SER A 17 -0.866 -12.115 6.959 1.00 0.00 H new ATOM 0 HB2 SER A 17 -2.217 -12.489 9.114 1.00 0.00 H new ATOM 0 HB3 SER A 17 -3.199 -13.624 8.210 1.00 0.00 H new ATOM 0 HG SER A 17 -1.458 -14.665 9.327 1.00 0.00 H new ATOM 236 N ASP A 18 -3.413 -13.129 5.203 1.00 0.00 N ATOM 237 CA ASP A 18 -3.820 -13.923 4.049 1.00 0.00 C ATOM 238 C ASP A 18 -3.186 -13.365 2.797 1.00 0.00 C ATOM 239 O ASP A 18 -2.673 -14.110 1.935 1.00 0.00 O ATOM 240 CB ASP A 18 -5.334 -13.926 3.887 1.00 0.00 C ATOM 241 CG ASP A 18 -5.788 -14.876 2.804 1.00 0.00 C ATOM 242 OD1 ASP A 18 -5.873 -16.090 3.072 1.00 0.00 O ATOM 243 OD2 ASP A 18 -6.067 -14.435 1.664 1.00 0.00 O ATOM 0 H ASP A 18 -4.131 -12.496 5.556 1.00 0.00 H new ATOM 0 HA ASP A 18 -3.488 -14.948 4.211 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -5.799 -14.206 4.832 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -5.675 -12.918 3.651 1.00 0.00 H new ATOM 248 N TYR A 19 -3.109 -12.044 2.733 1.00 0.00 N ATOM 249 CA TYR A 19 -2.583 -11.400 1.567 1.00 0.00 C ATOM 250 C TYR A 19 -1.075 -11.530 1.605 1.00 0.00 C ATOM 251 O TYR A 19 -0.395 -11.536 0.581 1.00 0.00 O ATOM 252 CB TYR A 19 -3.007 -9.935 1.549 1.00 0.00 C ATOM 253 CG TYR A 19 -4.502 -9.721 1.723 1.00 0.00 C ATOM 254 CD1 TYR A 19 -5.427 -10.426 0.962 1.00 0.00 C ATOM 255 CD2 TYR A 19 -4.981 -8.850 2.685 1.00 0.00 C ATOM 256 CE1 TYR A 19 -6.787 -10.257 1.155 1.00 0.00 C ATOM 257 CE2 TYR A 19 -6.333 -8.683 2.893 1.00 0.00 C ATOM 258 CZ TYR A 19 -7.231 -9.385 2.128 1.00 0.00 C ATOM 259 OH TYR A 19 -8.575 -9.237 2.358 1.00 0.00 O ATOM 0 H TYR A 19 -3.405 -11.411 3.476 1.00 0.00 H new ATOM 0 HA TYR A 19 -2.968 -11.866 0.660 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -2.480 -9.405 2.343 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -2.694 -9.489 0.605 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -5.079 -11.117 0.208 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -4.281 -8.289 3.286 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -7.495 -10.803 0.549 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -6.685 -8.003 3.655 1.00 0.00 H new ATOM 0 HH TYR A 19 -8.714 -8.586 3.077 1.00 0.00 H new ATOM 269 N MET A 20 -0.586 -11.716 2.808 1.00 0.00 N ATOM 270 CA MET A 20 0.811 -11.880 3.072 1.00 0.00 C ATOM 271 C MET A 20 1.211 -13.316 2.775 1.00 0.00 C ATOM 272 O MET A 20 2.361 -13.615 2.528 1.00 0.00 O ATOM 273 CB MET A 20 1.073 -11.533 4.532 1.00 0.00 C ATOM 274 CG MET A 20 2.461 -11.012 4.811 1.00 0.00 C ATOM 275 SD MET A 20 2.893 -9.640 3.716 1.00 0.00 S ATOM 276 CE MET A 20 1.385 -8.640 3.745 1.00 0.00 C ATOM 0 H MET A 20 -1.167 -11.757 3.645 1.00 0.00 H new ATOM 0 HA MET A 20 1.404 -11.220 2.438 1.00 0.00 H new ATOM 0 HB2 MET A 20 0.347 -10.785 4.851 1.00 0.00 H new ATOM 0 HB3 MET A 20 0.903 -12.422 5.140 1.00 0.00 H new ATOM 0 HG2 MET A 20 2.525 -10.684 5.848 1.00 0.00 H new ATOM 0 HG3 MET A 20 3.184 -11.818 4.687 1.00 0.00 H new ATOM 0 HE1 MET A 20 1.619 -7.620 3.441 1.00 0.00 H new ATOM 0 HE2 MET A 20 0.654 -9.065 3.057 1.00 0.00 H new ATOM 0 HE3 MET A 20 0.973 -8.632 4.754 1.00 0.00 H new ATOM 286 N SER A 21 0.247 -14.193 2.790 1.00 0.00 N ATOM 287 CA SER A 21 0.489 -15.563 2.471 1.00 0.00 C ATOM 288 C SER A 21 0.249 -15.791 0.967 1.00 0.00 C ATOM 289 O SER A 21 0.640 -16.825 0.414 1.00 0.00 O ATOM 290 CB SER A 21 -0.415 -16.471 3.322 1.00 0.00 C ATOM 291 OG SER A 21 -0.016 -17.834 3.233 1.00 0.00 O ATOM 0 H SER A 21 -0.722 -13.976 3.023 1.00 0.00 H new ATOM 0 HA SER A 21 1.525 -15.814 2.698 1.00 0.00 H new ATOM 0 HB2 SER A 21 -0.381 -16.148 4.362 1.00 0.00 H new ATOM 0 HB3 SER A 21 -1.449 -16.371 2.991 1.00 0.00 H new ATOM 0 HG SER A 21 0.298 -18.024 2.325 1.00 0.00 H new ATOM 297 N ALA A 22 -0.378 -14.812 0.302 1.00 0.00 N ATOM 298 CA ALA A 22 -0.674 -14.921 -1.119 1.00 0.00 C ATOM 299 C ALA A 22 0.600 -14.842 -1.961 1.00 0.00 C ATOM 300 O ALA A 22 0.688 -15.440 -3.032 1.00 0.00 O ATOM 301 CB ALA A 22 -1.669 -13.850 -1.540 1.00 0.00 C ATOM 0 H ALA A 22 -0.687 -13.940 0.731 1.00 0.00 H new ATOM 0 HA ALA A 22 -1.124 -15.898 -1.294 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -1.879 -13.947 -2.605 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -2.594 -13.971 -0.976 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -1.248 -12.864 -1.341 1.00 0.00 H new ATOM 307 N GLY A 23 1.583 -14.101 -1.474 1.00 0.00 N ATOM 308 CA GLY A 23 2.848 -13.998 -2.187 1.00 0.00 C ATOM 309 C GLY A 23 2.833 -12.912 -3.240 1.00 0.00 C ATOM 310 O GLY A 23 3.725 -12.828 -4.076 1.00 0.00 O ATOM 0 H GLY A 23 1.533 -13.571 -0.604 1.00 0.00 H new ATOM 0 HA2 GLY A 23 3.648 -13.797 -1.474 1.00 0.00 H new ATOM 0 HA3 GLY A 23 3.074 -14.954 -2.659 1.00 0.00 H new ATOM 314 N ILE A 24 1.818 -12.098 -3.198 1.00 0.00 N ATOM 315 CA ILE A 24 1.658 -10.989 -4.111 1.00 0.00 C ATOM 316 C ILE A 24 1.511 -9.708 -3.312 1.00 0.00 C ATOM 317 O ILE A 24 1.034 -9.765 -2.185 1.00 0.00 O ATOM 318 CB ILE A 24 0.440 -11.171 -5.060 1.00 0.00 C ATOM 319 CG1 ILE A 24 -0.793 -11.675 -4.292 1.00 0.00 C ATOM 320 CG2 ILE A 24 0.790 -12.096 -6.218 1.00 0.00 C ATOM 321 CD1 ILE A 24 -2.079 -11.669 -5.088 1.00 0.00 C ATOM 0 H ILE A 24 1.062 -12.183 -2.519 1.00 0.00 H new ATOM 0 HA ILE A 24 2.545 -10.943 -4.743 1.00 0.00 H new ATOM 0 HB ILE A 24 0.188 -10.196 -5.477 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -0.599 -12.691 -3.948 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -0.928 -11.058 -3.404 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -0.077 -12.209 -6.869 1.00 0.00 H new ATOM 0 HG22 ILE A 24 1.617 -11.671 -6.786 1.00 0.00 H new ATOM 0 HG23 ILE A 24 1.081 -13.072 -5.829 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -2.894 -12.040 -4.466 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -2.303 -10.652 -5.410 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -1.969 -12.311 -5.962 1.00 0.00 H new ATOM 333 N PRO A 25 1.932 -8.557 -3.871 1.00 0.00 N ATOM 334 CA PRO A 25 1.919 -7.246 -3.183 1.00 0.00 C ATOM 335 C PRO A 25 0.554 -6.861 -2.595 1.00 0.00 C ATOM 336 O PRO A 25 -0.505 -7.165 -3.158 1.00 0.00 O ATOM 337 CB PRO A 25 2.321 -6.252 -4.281 1.00 0.00 C ATOM 338 CG PRO A 25 2.172 -7.003 -5.562 1.00 0.00 C ATOM 339 CD PRO A 25 2.460 -8.426 -5.236 1.00 0.00 C ATOM 0 HA PRO A 25 2.587 -7.260 -2.322 1.00 0.00 H new ATOM 0 HB2 PRO A 25 1.682 -5.369 -4.266 1.00 0.00 H new ATOM 0 HB3 PRO A 25 3.346 -5.907 -4.144 1.00 0.00 H new ATOM 0 HG2 PRO A 25 1.166 -6.891 -5.966 1.00 0.00 H new ATOM 0 HG3 PRO A 25 2.862 -6.628 -6.317 1.00 0.00 H new ATOM 0 HD2 PRO A 25 1.967 -9.108 -5.928 1.00 0.00 H new ATOM 0 HD3 PRO A 25 3.527 -8.644 -5.280 1.00 0.00 H new ATOM 347 N LEU A 26 0.582 -6.198 -1.471 1.00 0.00 N ATOM 348 CA LEU A 26 -0.611 -5.804 -0.781 1.00 0.00 C ATOM 349 C LEU A 26 -0.661 -4.289 -0.759 1.00 0.00 C ATOM 350 O LEU A 26 0.268 -3.644 -0.319 1.00 0.00 O ATOM 351 CB LEU A 26 -0.545 -6.313 0.659 1.00 0.00 C ATOM 352 CG LEU A 26 -1.872 -6.547 1.427 1.00 0.00 C ATOM 353 CD1 LEU A 26 -1.595 -6.993 2.840 1.00 0.00 C ATOM 354 CD2 LEU A 26 -2.755 -5.331 1.447 1.00 0.00 C ATOM 0 H LEU A 26 1.444 -5.914 -1.005 1.00 0.00 H new ATOM 0 HA LEU A 26 -1.491 -6.213 -1.277 1.00 0.00 H new ATOM 0 HB2 LEU A 26 0.003 -7.255 0.652 1.00 0.00 H new ATOM 0 HB3 LEU A 26 0.049 -5.603 1.234 1.00 0.00 H new ATOM 0 HG LEU A 26 -2.405 -7.331 0.889 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -2.538 -7.152 3.363 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -1.028 -7.924 2.823 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -1.018 -6.226 3.357 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -3.669 -5.554 1.998 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -2.230 -4.508 1.932 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -3.007 -5.048 0.425 1.00 0.00 H new ATOM 366 N ALA A 27 -1.728 -3.753 -1.208 1.00 0.00 N ATOM 367 CA ALA A 27 -1.939 -2.346 -1.195 1.00 0.00 C ATOM 368 C ALA A 27 -2.760 -1.965 0.030 1.00 0.00 C ATOM 369 O ALA A 27 -3.947 -2.311 0.139 1.00 0.00 O ATOM 370 CB ALA A 27 -2.623 -1.911 -2.461 1.00 0.00 C ATOM 0 H ALA A 27 -2.502 -4.285 -1.606 1.00 0.00 H new ATOM 0 HA ALA A 27 -0.978 -1.835 -1.142 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -2.779 -0.832 -2.438 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -2.001 -2.170 -3.318 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -3.586 -2.415 -2.546 1.00 0.00 H new ATOM 376 N TYR A 28 -2.114 -1.295 0.942 1.00 0.00 N ATOM 377 CA TYR A 28 -2.699 -0.847 2.179 1.00 0.00 C ATOM 378 C TYR A 28 -3.258 0.508 1.989 1.00 0.00 C ATOM 379 O TYR A 28 -2.528 1.438 1.642 1.00 0.00 O ATOM 380 CB TYR A 28 -1.646 -0.734 3.272 1.00 0.00 C ATOM 381 CG TYR A 28 -1.174 -2.020 3.906 1.00 0.00 C ATOM 382 CD1 TYR A 28 -0.308 -2.878 3.249 1.00 0.00 C ATOM 383 CD2 TYR A 28 -1.584 -2.359 5.185 1.00 0.00 C ATOM 384 CE1 TYR A 28 0.129 -4.041 3.849 1.00 0.00 C ATOM 385 CE2 TYR A 28 -1.146 -3.516 5.796 1.00 0.00 C ATOM 386 CZ TYR A 28 -0.290 -4.354 5.122 1.00 0.00 C ATOM 387 OH TYR A 28 0.152 -5.514 5.725 1.00 0.00 O ATOM 0 H TYR A 28 -1.132 -1.036 0.844 1.00 0.00 H new ATOM 0 HA TYR A 28 -3.464 -1.569 2.465 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -0.778 -0.224 2.854 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -2.043 -0.094 4.060 1.00 0.00 H new ATOM 0 HD1 TYR A 28 0.030 -2.633 2.253 1.00 0.00 H new ATOM 0 HD2 TYR A 28 -2.260 -1.704 5.715 1.00 0.00 H new ATOM 0 HE1 TYR A 28 0.798 -4.704 3.321 1.00 0.00 H new ATOM 0 HE2 TYR A 28 -1.473 -3.761 6.796 1.00 0.00 H new ATOM 0 HH TYR A 28 -0.237 -5.585 6.622 1.00 0.00 H new ATOM 397 N ILE A 29 -4.508 0.651 2.195 1.00 0.00 N ATOM 398 CA ILE A 29 -5.088 1.937 2.086 1.00 0.00 C ATOM 399 C ILE A 29 -5.521 2.418 3.428 1.00 0.00 C ATOM 400 O ILE A 29 -6.624 2.132 3.877 1.00 0.00 O ATOM 401 CB ILE A 29 -6.265 2.008 1.115 1.00 0.00 C ATOM 402 CG1 ILE A 29 -5.870 1.402 -0.225 1.00 0.00 C ATOM 403 CG2 ILE A 29 -6.693 3.460 0.947 1.00 0.00 C ATOM 404 CD1 ILE A 29 -6.428 0.029 -0.474 1.00 0.00 C ATOM 0 H ILE A 29 -5.152 -0.101 2.440 1.00 0.00 H new ATOM 0 HA ILE A 29 -4.310 2.582 1.677 1.00 0.00 H new ATOM 0 HB ILE A 29 -7.104 1.438 1.512 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -6.203 2.066 -1.023 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -4.783 1.355 -0.282 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -7.533 3.514 0.254 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -6.993 3.865 1.913 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -5.860 4.042 0.553 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -6.097 -0.327 -1.450 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -6.075 -0.653 0.299 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -7.517 0.069 -0.452 1.00 0.00 H new ATOM 416 N PHE A 30 -4.641 3.094 4.077 1.00 0.00 N ATOM 417 CA PHE A 30 -4.916 3.671 5.349 1.00 0.00 C ATOM 418 C PHE A 30 -5.676 4.917 5.131 1.00 0.00 C ATOM 419 O PHE A 30 -5.331 5.685 4.278 1.00 0.00 O ATOM 420 CB PHE A 30 -3.634 4.019 6.062 1.00 0.00 C ATOM 421 CG PHE A 30 -2.875 2.870 6.618 1.00 0.00 C ATOM 422 CD1 PHE A 30 -2.136 2.019 5.816 1.00 0.00 C ATOM 423 CD2 PHE A 30 -2.916 2.638 7.966 1.00 0.00 C ATOM 424 CE1 PHE A 30 -1.467 0.951 6.370 1.00 0.00 C ATOM 425 CE2 PHE A 30 -2.256 1.599 8.525 1.00 0.00 C ATOM 426 CZ PHE A 30 -1.527 0.738 7.727 1.00 0.00 C ATOM 0 H PHE A 30 -3.695 3.266 3.736 1.00 0.00 H new ATOM 0 HA PHE A 30 -5.478 2.959 5.953 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -2.988 4.556 5.368 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -3.867 4.705 6.876 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -2.084 2.193 4.751 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -3.489 3.300 8.598 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -0.897 0.283 5.741 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -2.298 1.442 9.593 1.00 0.00 H new ATOM 0 HZ PHE A 30 -1.006 -0.099 8.168 1.00 0.00 H new ATOM 436 N ALA A 31 -6.707 5.095 5.857 1.00 0.00 N ATOM 437 CA ALA A 31 -7.476 6.335 5.780 1.00 0.00 C ATOM 438 C ALA A 31 -7.987 6.758 7.120 1.00 0.00 C ATOM 439 O ALA A 31 -8.675 5.993 7.790 1.00 0.00 O ATOM 440 CB ALA A 31 -8.598 6.291 4.725 1.00 0.00 C ATOM 0 H ALA A 31 -7.065 4.412 6.525 1.00 0.00 H new ATOM 0 HA ALA A 31 -6.777 7.099 5.440 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -9.130 7.242 4.720 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -8.165 6.112 3.741 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -9.294 5.488 4.967 1.00 0.00 H new ATOM 446 N GLU A 32 -7.585 7.957 7.557 1.00 0.00 N ATOM 447 CA GLU A 32 -8.058 8.502 8.823 1.00 0.00 C ATOM 448 C GLU A 32 -9.494 8.903 8.655 1.00 0.00 C ATOM 449 O GLU A 32 -10.308 8.808 9.578 1.00 0.00 O ATOM 450 CB GLU A 32 -7.314 9.784 9.220 1.00 0.00 C ATOM 451 CG GLU A 32 -5.805 9.726 9.356 1.00 0.00 C ATOM 452 CD GLU A 32 -5.262 11.054 9.859 1.00 0.00 C ATOM 453 OE1 GLU A 32 -5.322 12.063 9.121 1.00 0.00 O ATOM 454 OE2 GLU A 32 -4.854 11.139 11.038 1.00 0.00 O ATOM 0 H GLU A 32 -6.937 8.561 7.052 1.00 0.00 H new ATOM 0 HA GLU A 32 -7.903 7.736 9.582 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -7.552 10.549 8.481 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -7.721 10.123 10.173 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -5.527 8.929 10.045 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -5.357 9.485 8.392 1.00 0.00 H new ATOM 461 N THR A 33 -9.795 9.314 7.452 1.00 0.00 N ATOM 462 CA THR A 33 -11.051 9.901 7.140 1.00 0.00 C ATOM 463 C THR A 33 -12.117 8.862 6.874 1.00 0.00 C ATOM 464 O THR A 33 -12.080 8.166 5.874 1.00 0.00 O ATOM 465 CB THR A 33 -10.888 10.856 5.951 1.00 0.00 C ATOM 466 OG1 THR A 33 -9.987 10.262 4.988 1.00 0.00 O ATOM 467 CG2 THR A 33 -10.329 12.191 6.407 1.00 0.00 C ATOM 0 H THR A 33 -9.159 9.245 6.657 1.00 0.00 H new ATOM 0 HA THR A 33 -11.389 10.467 8.008 1.00 0.00 H new ATOM 0 HB THR A 33 -11.865 11.026 5.498 1.00 0.00 H new ATOM 0 HG1 THR A 33 -9.880 10.867 4.224 1.00 0.00 H new ATOM 0 HG21 THR A 33 -10.221 12.853 5.548 1.00 0.00 H new ATOM 0 HG22 THR A 33 -11.009 12.642 7.130 1.00 0.00 H new ATOM 0 HG23 THR A 33 -9.355 12.038 6.871 1.00 0.00 H new ATOM 475 N ALA A 34 -13.059 8.749 7.785 1.00 0.00 N ATOM 476 CA ALA A 34 -14.149 7.798 7.640 1.00 0.00 C ATOM 477 C ALA A 34 -15.230 8.391 6.765 1.00 0.00 C ATOM 478 O ALA A 34 -16.071 7.684 6.220 1.00 0.00 O ATOM 479 CB ALA A 34 -14.720 7.428 9.000 1.00 0.00 C ATOM 0 H ALA A 34 -13.095 9.305 8.639 1.00 0.00 H new ATOM 0 HA ALA A 34 -13.765 6.892 7.171 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -15.535 6.715 8.871 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -13.938 6.979 9.613 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -15.097 8.324 9.493 1.00 0.00 H new ATOM 485 N GLU A 35 -15.169 9.692 6.607 1.00 0.00 N ATOM 486 CA GLU A 35 -16.140 10.433 5.851 1.00 0.00 C ATOM 487 C GLU A 35 -15.974 10.126 4.384 1.00 0.00 C ATOM 488 O GLU A 35 -16.869 9.578 3.746 1.00 0.00 O ATOM 489 CB GLU A 35 -15.991 11.953 6.079 1.00 0.00 C ATOM 490 CG GLU A 35 -16.124 12.438 7.528 1.00 0.00 C ATOM 491 CD GLU A 35 -14.997 11.963 8.411 1.00 0.00 C ATOM 492 OE1 GLU A 35 -13.826 12.121 8.021 1.00 0.00 O ATOM 493 OE2 GLU A 35 -15.258 11.396 9.490 1.00 0.00 O ATOM 0 H GLU A 35 -14.431 10.271 7.008 1.00 0.00 H new ATOM 0 HA GLU A 35 -17.133 10.135 6.187 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -15.016 12.262 5.703 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -16.741 12.465 5.476 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -16.154 13.528 7.540 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -17.072 12.089 7.937 1.00 0.00 H new ATOM 500 N GLU A 36 -14.803 10.413 3.872 1.00 0.00 N ATOM 501 CA GLU A 36 -14.544 10.239 2.468 1.00 0.00 C ATOM 502 C GLU A 36 -13.833 8.929 2.160 1.00 0.00 C ATOM 503 O GLU A 36 -13.454 8.694 1.023 1.00 0.00 O ATOM 504 CB GLU A 36 -13.797 11.442 1.884 1.00 0.00 C ATOM 505 CG GLU A 36 -12.500 11.772 2.585 1.00 0.00 C ATOM 506 CD GLU A 36 -11.830 12.996 2.006 1.00 0.00 C ATOM 507 OE1 GLU A 36 -12.250 14.120 2.329 1.00 0.00 O ATOM 508 OE2 GLU A 36 -10.853 12.854 1.233 1.00 0.00 O ATOM 0 H GLU A 36 -14.013 10.769 4.410 1.00 0.00 H new ATOM 0 HA GLU A 36 -15.515 10.182 1.976 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -13.588 11.249 0.832 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -14.450 12.314 1.924 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -12.694 11.934 3.645 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -11.823 10.921 2.511 1.00 0.00 H new ATOM 515 N ARG A 37 -13.703 8.046 3.169 1.00 0.00 N ATOM 516 CA ARG A 37 -13.080 6.715 2.969 1.00 0.00 C ATOM 517 C ARG A 37 -13.803 5.978 1.863 1.00 0.00 C ATOM 518 O ARG A 37 -13.191 5.280 1.059 1.00 0.00 O ATOM 519 CB ARG A 37 -13.163 5.850 4.236 1.00 0.00 C ATOM 520 CG ARG A 37 -12.579 4.449 4.061 1.00 0.00 C ATOM 521 CD ARG A 37 -12.984 3.536 5.192 1.00 0.00 C ATOM 522 NE ARG A 37 -12.457 2.170 5.025 1.00 0.00 N ATOM 523 CZ ARG A 37 -12.381 1.244 6.004 1.00 0.00 C ATOM 524 NH1 ARG A 37 -12.732 1.543 7.252 1.00 0.00 N ATOM 525 NH2 ARG A 37 -11.942 0.023 5.727 1.00 0.00 N ATOM 0 H ARG A 37 -14.016 8.224 4.123 1.00 0.00 H new ATOM 0 HA ARG A 37 -12.033 6.883 2.718 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -12.636 6.355 5.046 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -14.206 5.764 4.539 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -12.917 4.029 3.114 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -11.492 4.510 4.013 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -12.625 3.949 6.135 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -14.072 3.498 5.254 1.00 0.00 H new ATOM 0 HE ARG A 37 -12.124 1.904 4.098 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -13.063 2.481 7.478 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -12.670 0.834 7.983 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -11.662 -0.215 4.775 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -11.884 -0.678 6.466 1.00 0.00 H new ATOM 539 N LYS A 38 -15.103 6.167 1.827 1.00 0.00 N ATOM 540 CA LYS A 38 -15.947 5.533 0.854 1.00 0.00 C ATOM 541 C LYS A 38 -15.549 5.898 -0.579 1.00 0.00 C ATOM 542 O LYS A 38 -15.360 5.025 -1.408 1.00 0.00 O ATOM 543 CB LYS A 38 -17.430 5.836 1.117 1.00 0.00 C ATOM 544 CG LYS A 38 -17.781 7.319 1.221 1.00 0.00 C ATOM 545 CD LYS A 38 -19.268 7.523 1.460 1.00 0.00 C ATOM 546 CE LYS A 38 -20.088 6.952 0.318 1.00 0.00 C ATOM 547 NZ LYS A 38 -21.533 7.176 0.478 1.00 0.00 N ATOM 0 H LYS A 38 -15.603 6.771 2.480 1.00 0.00 H new ATOM 0 HA LYS A 38 -15.803 4.458 0.960 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -18.023 5.394 0.316 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -17.727 5.343 2.043 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -17.215 7.772 2.035 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -17.485 7.829 0.304 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -19.558 7.044 2.395 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -19.480 8.587 1.567 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -19.758 7.401 -0.619 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -19.898 5.881 0.242 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -22.040 6.764 -0.331 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -21.859 6.725 1.356 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -21.723 8.198 0.522 1.00 0.00 H new ATOM 561 N GLU A 39 -15.360 7.184 -0.850 1.00 0.00 N ATOM 562 CA GLU A 39 -15.005 7.602 -2.188 1.00 0.00 C ATOM 563 C GLU A 39 -13.524 7.375 -2.446 1.00 0.00 C ATOM 564 O GLU A 39 -13.115 7.147 -3.581 1.00 0.00 O ATOM 565 CB GLU A 39 -15.407 9.044 -2.470 1.00 0.00 C ATOM 566 CG GLU A 39 -14.743 10.075 -1.595 1.00 0.00 C ATOM 567 CD GLU A 39 -15.171 11.453 -1.959 1.00 0.00 C ATOM 568 OE1 GLU A 39 -14.528 12.079 -2.819 1.00 0.00 O ATOM 569 OE2 GLU A 39 -16.179 11.925 -1.422 1.00 0.00 O ATOM 0 H GLU A 39 -15.446 7.939 -0.170 1.00 0.00 H new ATOM 0 HA GLU A 39 -15.571 6.983 -2.883 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -15.178 9.272 -3.511 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -16.487 9.133 -2.354 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -14.988 9.880 -0.551 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -13.660 9.992 -1.690 1.00 0.00 H new ATOM 576 N LEU A 40 -12.740 7.402 -1.383 1.00 0.00 N ATOM 577 CA LEU A 40 -11.326 7.128 -1.436 1.00 0.00 C ATOM 578 C LEU A 40 -11.183 5.678 -2.000 1.00 0.00 C ATOM 579 O LEU A 40 -10.543 5.432 -3.049 1.00 0.00 O ATOM 580 CB LEU A 40 -10.799 7.279 0.038 1.00 0.00 C ATOM 581 CG LEU A 40 -9.313 7.594 0.300 1.00 0.00 C ATOM 582 CD1 LEU A 40 -8.434 6.432 -0.068 1.00 0.00 C ATOM 583 CD2 LEU A 40 -8.905 8.840 -0.468 1.00 0.00 C ATOM 0 H LEU A 40 -13.079 7.619 -0.446 1.00 0.00 H new ATOM 0 HA LEU A 40 -10.749 7.797 -2.074 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -11.385 8.066 0.512 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -11.030 6.351 0.561 1.00 0.00 H new ATOM 0 HG LEU A 40 -9.185 7.777 1.367 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -7.393 6.687 0.129 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -8.713 5.562 0.526 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -8.558 6.203 -1.126 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -7.854 9.057 -0.278 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -9.054 8.675 -1.535 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -9.514 9.684 -0.143 1.00 0.00 H new ATOM 595 N SER A 41 -11.935 4.775 -1.393 1.00 0.00 N ATOM 596 CA SER A 41 -11.935 3.374 -1.771 1.00 0.00 C ATOM 597 C SER A 41 -12.702 3.159 -3.081 1.00 0.00 C ATOM 598 O SER A 41 -12.520 2.174 -3.762 1.00 0.00 O ATOM 599 CB SER A 41 -12.553 2.542 -0.659 1.00 0.00 C ATOM 600 OG SER A 41 -11.988 2.893 0.604 1.00 0.00 O ATOM 0 H SER A 41 -12.565 4.995 -0.621 1.00 0.00 H new ATOM 0 HA SER A 41 -10.904 3.058 -1.927 1.00 0.00 H new ATOM 0 HB2 SER A 41 -13.632 2.698 -0.637 1.00 0.00 H new ATOM 0 HB3 SER A 41 -12.388 1.483 -0.855 1.00 0.00 H new ATOM 0 HG SER A 41 -12.369 3.743 0.908 1.00 0.00 H new ATOM 606 N ASP A 42 -13.533 4.105 -3.424 1.00 0.00 N ATOM 607 CA ASP A 42 -14.332 4.053 -4.643 1.00 0.00 C ATOM 608 C ASP A 42 -13.484 4.218 -5.853 1.00 0.00 C ATOM 609 O ASP A 42 -13.700 3.586 -6.852 1.00 0.00 O ATOM 610 CB ASP A 42 -15.323 5.142 -4.620 1.00 0.00 C ATOM 611 CG ASP A 42 -16.247 5.132 -5.816 1.00 0.00 C ATOM 612 OD1 ASP A 42 -17.145 4.250 -5.884 1.00 0.00 O ATOM 613 OD2 ASP A 42 -16.067 5.995 -6.723 1.00 0.00 O ATOM 0 H ASP A 42 -13.684 4.946 -2.868 1.00 0.00 H new ATOM 0 HA ASP A 42 -14.821 3.080 -4.684 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -15.917 5.065 -3.709 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -14.801 6.098 -4.580 1.00 0.00 H new ATOM 618 N LYS A 43 -12.541 5.094 -5.755 1.00 0.00 N ATOM 619 CA LYS A 43 -11.570 5.335 -6.805 1.00 0.00 C ATOM 620 C LYS A 43 -10.627 4.122 -6.886 1.00 0.00 C ATOM 621 O LYS A 43 -10.232 3.604 -8.007 1.00 0.00 O ATOM 622 CB LYS A 43 -10.850 6.651 -6.460 1.00 0.00 C ATOM 623 CG LYS A 43 -11.362 7.915 -7.207 1.00 0.00 C ATOM 624 CD LYS A 43 -12.896 8.012 -7.389 1.00 0.00 C ATOM 625 CE LYS A 43 -13.638 8.522 -6.165 1.00 0.00 C ATOM 626 NZ LYS A 43 -15.113 8.581 -6.398 1.00 0.00 N ATOM 0 H LYS A 43 -12.409 5.682 -4.932 1.00 0.00 H new ATOM 0 HA LYS A 43 -12.023 5.445 -7.791 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -10.941 6.823 -5.388 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -9.788 6.530 -6.674 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -11.022 8.797 -6.665 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -10.895 7.947 -8.191 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -13.110 8.671 -8.230 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -13.283 7.027 -7.650 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -13.429 7.871 -5.316 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -13.271 9.515 -5.904 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -15.556 9.174 -5.667 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -15.300 8.989 -7.336 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -15.510 7.621 -6.353 1.00 0.00 H new ATOM 640 N LEU A 44 -10.377 3.587 -5.718 1.00 0.00 N ATOM 641 CA LEU A 44 -9.562 2.440 -5.571 1.00 0.00 C ATOM 642 C LEU A 44 -10.242 1.197 -6.096 1.00 0.00 C ATOM 643 O LEU A 44 -9.599 0.261 -6.495 1.00 0.00 O ATOM 644 CB LEU A 44 -9.285 2.267 -4.129 1.00 0.00 C ATOM 645 CG LEU A 44 -8.414 3.316 -3.494 1.00 0.00 C ATOM 646 CD1 LEU A 44 -8.198 2.987 -2.056 1.00 0.00 C ATOM 647 CD2 LEU A 44 -7.093 3.456 -4.231 1.00 0.00 C ATOM 0 H LEU A 44 -10.745 3.951 -4.839 1.00 0.00 H new ATOM 0 HA LEU A 44 -8.645 2.581 -6.144 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -10.236 2.242 -3.597 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -8.813 1.295 -3.984 1.00 0.00 H new ATOM 0 HG LEU A 44 -8.921 4.278 -3.561 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -7.567 3.749 -1.599 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -9.159 2.956 -1.542 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -7.711 2.015 -1.974 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -6.486 4.222 -3.748 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -6.562 2.505 -4.209 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -7.282 3.742 -5.266 1.00 0.00 H new ATOM 659 N LYS A 45 -11.530 1.238 -6.137 1.00 0.00 N ATOM 660 CA LYS A 45 -12.338 0.097 -6.484 1.00 0.00 C ATOM 661 C LYS A 45 -12.089 -0.375 -7.935 1.00 0.00 C ATOM 662 O LYS A 45 -11.776 -1.546 -8.143 1.00 0.00 O ATOM 663 CB LYS A 45 -13.811 0.392 -6.134 1.00 0.00 C ATOM 664 CG LYS A 45 -14.823 -0.699 -6.411 1.00 0.00 C ATOM 665 CD LYS A 45 -16.179 -0.344 -5.779 1.00 0.00 C ATOM 666 CE LYS A 45 -16.691 1.030 -6.228 1.00 0.00 C ATOM 667 NZ LYS A 45 -17.986 1.388 -5.602 1.00 0.00 N ATOM 0 H LYS A 45 -12.071 2.077 -5.928 1.00 0.00 H new ATOM 0 HA LYS A 45 -12.042 -0.765 -5.886 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -13.863 0.638 -5.073 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -14.116 1.282 -6.683 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -14.939 -0.832 -7.487 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -14.464 -1.647 -6.010 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -16.911 -1.106 -6.045 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -16.085 -0.357 -4.693 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -15.949 1.789 -5.979 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -16.802 1.036 -7.312 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -18.064 2.423 -5.532 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -18.766 1.021 -6.184 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -18.038 0.972 -4.650 1.00 0.00 H new ATOM 681 N PRO A 46 -12.167 0.515 -8.955 1.00 0.00 N ATOM 682 CA PRO A 46 -11.869 0.160 -10.338 1.00 0.00 C ATOM 683 C PRO A 46 -10.405 -0.050 -10.535 1.00 0.00 C ATOM 684 O PRO A 46 -10.000 -1.069 -11.140 1.00 0.00 O ATOM 685 CB PRO A 46 -12.290 1.399 -11.099 1.00 0.00 C ATOM 686 CG PRO A 46 -13.255 1.990 -10.202 1.00 0.00 C ATOM 687 CD PRO A 46 -12.600 1.892 -8.905 1.00 0.00 C ATOM 0 HA PRO A 46 -12.366 -0.758 -10.650 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -11.449 2.066 -11.290 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -12.729 1.154 -12.066 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -13.472 3.025 -10.467 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -14.203 1.452 -10.217 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -11.768 2.589 -8.803 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -13.281 2.086 -8.077 1.00 0.00 H new ATOM 695 N ILE A 47 -9.561 0.872 -9.963 1.00 0.00 N ATOM 696 CA ILE A 47 -8.129 0.731 -10.213 1.00 0.00 C ATOM 697 C ILE A 47 -7.594 -0.573 -9.676 1.00 0.00 C ATOM 698 O ILE A 47 -6.624 -1.093 -10.174 1.00 0.00 O ATOM 699 CB ILE A 47 -7.263 1.957 -9.759 1.00 0.00 C ATOM 700 CG1 ILE A 47 -7.310 2.245 -8.249 1.00 0.00 C ATOM 701 CG2 ILE A 47 -7.678 3.173 -10.514 1.00 0.00 C ATOM 702 CD1 ILE A 47 -6.452 1.339 -7.390 1.00 0.00 C ATOM 0 H ILE A 47 -9.841 1.655 -9.373 1.00 0.00 H new ATOM 0 HA ILE A 47 -8.031 0.713 -11.298 1.00 0.00 H new ATOM 0 HB ILE A 47 -6.230 1.691 -9.982 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -7.000 3.277 -8.083 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -8.344 2.165 -7.913 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -7.074 4.023 -10.196 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -7.534 3.005 -11.581 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -8.730 3.382 -10.318 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -6.556 1.625 -6.343 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -6.773 0.305 -7.518 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -5.409 1.434 -7.690 1.00 0.00 H new ATOM 714 N ALA A 48 -8.301 -1.133 -8.712 1.00 0.00 N ATOM 715 CA ALA A 48 -7.849 -2.356 -8.074 1.00 0.00 C ATOM 716 C ALA A 48 -8.544 -3.548 -8.635 1.00 0.00 C ATOM 717 O ALA A 48 -8.055 -4.640 -8.519 1.00 0.00 O ATOM 718 CB ALA A 48 -8.063 -2.295 -6.606 1.00 0.00 C ATOM 0 H ALA A 48 -9.183 -0.765 -8.356 1.00 0.00 H new ATOM 0 HA ALA A 48 -6.782 -2.452 -8.274 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -7.717 -3.222 -6.149 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -7.505 -1.456 -6.191 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -9.125 -2.162 -6.398 1.00 0.00 H new ATOM 724 N GLU A 49 -9.685 -3.353 -9.247 1.00 0.00 N ATOM 725 CA GLU A 49 -10.384 -4.406 -9.884 1.00 0.00 C ATOM 726 C GLU A 49 -9.585 -4.810 -11.116 1.00 0.00 C ATOM 727 O GLU A 49 -9.632 -5.944 -11.576 1.00 0.00 O ATOM 728 CB GLU A 49 -11.716 -3.872 -10.300 1.00 0.00 C ATOM 729 CG GLU A 49 -12.725 -4.923 -10.478 1.00 0.00 C ATOM 730 CD GLU A 49 -14.051 -4.375 -10.885 1.00 0.00 C ATOM 731 OE1 GLU A 49 -14.266 -4.151 -12.089 1.00 0.00 O ATOM 732 OE2 GLU A 49 -14.904 -4.141 -10.004 1.00 0.00 O ATOM 0 H GLU A 49 -10.147 -2.446 -9.310 1.00 0.00 H new ATOM 0 HA GLU A 49 -10.515 -5.267 -9.228 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -12.067 -3.162 -9.551 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -11.605 -3.321 -11.234 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -12.380 -5.630 -11.232 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -12.835 -5.479 -9.547 1.00 0.00 H new ATOM 739 N ALA A 50 -8.787 -3.872 -11.569 1.00 0.00 N ATOM 740 CA ALA A 50 -7.944 -4.039 -12.715 1.00 0.00 C ATOM 741 C ALA A 50 -6.739 -4.898 -12.361 1.00 0.00 C ATOM 742 O ALA A 50 -6.067 -5.450 -13.225 1.00 0.00 O ATOM 743 CB ALA A 50 -7.479 -2.673 -13.141 1.00 0.00 C ATOM 0 H ALA A 50 -8.709 -2.952 -11.136 1.00 0.00 H new ATOM 0 HA ALA A 50 -8.493 -4.532 -13.518 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -6.833 -2.764 -14.014 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -8.342 -2.056 -13.391 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -6.924 -2.207 -12.327 1.00 0.00 H new ATOM 749 N GLN A 51 -6.506 -5.029 -11.087 1.00 0.00 N ATOM 750 CA GLN A 51 -5.338 -5.670 -10.570 1.00 0.00 C ATOM 751 C GLN A 51 -5.653 -6.484 -9.329 1.00 0.00 C ATOM 752 O GLN A 51 -4.805 -6.731 -8.489 1.00 0.00 O ATOM 753 CB GLN A 51 -4.318 -4.595 -10.310 1.00 0.00 C ATOM 754 CG GLN A 51 -4.817 -3.403 -9.568 1.00 0.00 C ATOM 755 CD GLN A 51 -3.734 -2.402 -9.363 1.00 0.00 C ATOM 756 OE1 GLN A 51 -3.703 -1.693 -8.382 1.00 0.00 O ATOM 757 NE2 GLN A 51 -2.853 -2.296 -10.320 1.00 0.00 N ATOM 0 H GLN A 51 -7.139 -4.684 -10.365 1.00 0.00 H new ATOM 0 HA GLN A 51 -4.941 -6.386 -11.289 1.00 0.00 H new ATOM 0 HB2 GLN A 51 -3.491 -5.031 -9.749 1.00 0.00 H new ATOM 0 HB3 GLN A 51 -3.914 -4.263 -11.266 1.00 0.00 H new ATOM 0 HG2 GLN A 51 -5.638 -2.946 -10.120 1.00 0.00 H new ATOM 0 HG3 GLN A 51 -5.216 -3.714 -8.602 1.00 0.00 H new ATOM 0 HE21 GLN A 51 -2.907 -2.909 -11.133 1.00 0.00 H new ATOM 0 HE22 GLN A 51 -2.110 -1.600 -10.254 1.00 0.00 H new ATOM 766 N ARG A 52 -6.853 -7.004 -9.308 1.00 0.00 N ATOM 767 CA ARG A 52 -7.394 -7.750 -8.192 1.00 0.00 C ATOM 768 C ARG A 52 -6.842 -9.165 -8.165 1.00 0.00 C ATOM 769 O ARG A 52 -6.984 -9.897 -7.186 1.00 0.00 O ATOM 770 CB ARG A 52 -8.910 -7.767 -8.307 1.00 0.00 C ATOM 771 CG ARG A 52 -9.434 -8.381 -9.593 1.00 0.00 C ATOM 772 CD ARG A 52 -10.936 -8.373 -9.607 1.00 0.00 C ATOM 773 NE ARG A 52 -11.486 -8.711 -10.924 1.00 0.00 N ATOM 774 CZ ARG A 52 -12.793 -8.665 -11.249 1.00 0.00 C ATOM 775 NH1 ARG A 52 -13.710 -8.380 -10.326 1.00 0.00 N ATOM 776 NH2 ARG A 52 -13.181 -8.915 -12.496 1.00 0.00 N ATOM 0 H ARG A 52 -7.504 -6.920 -10.089 1.00 0.00 H new ATOM 0 HA ARG A 52 -7.101 -7.269 -7.259 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -9.320 -8.319 -7.461 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -9.280 -6.745 -8.230 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -9.054 -7.825 -10.450 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -9.069 -9.404 -9.690 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -11.307 -9.084 -8.868 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -11.294 -7.387 -9.309 1.00 0.00 H new ATOM 0 HE ARG A 52 -10.830 -9.003 -11.648 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -13.425 -8.194 -9.364 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -14.697 -8.347 -10.581 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -12.489 -9.142 -13.210 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -14.171 -8.879 -12.739 1.00 0.00 H new ATOM 790 N GLY A 53 -6.248 -9.545 -9.252 1.00 0.00 N ATOM 791 CA GLY A 53 -5.622 -10.831 -9.350 1.00 0.00 C ATOM 792 C GLY A 53 -4.127 -10.736 -9.230 1.00 0.00 C ATOM 793 O GLY A 53 -3.422 -11.730 -9.390 1.00 0.00 O ATOM 0 H GLY A 53 -6.182 -8.976 -10.096 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -6.008 -11.484 -8.567 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -5.881 -11.289 -10.304 1.00 0.00 H new ATOM 797 N VAL A 54 -3.629 -9.556 -8.948 1.00 0.00 N ATOM 798 CA VAL A 54 -2.199 -9.370 -8.838 1.00 0.00 C ATOM 799 C VAL A 54 -1.824 -8.641 -7.541 1.00 0.00 C ATOM 800 O VAL A 54 -0.820 -8.958 -6.922 1.00 0.00 O ATOM 801 CB VAL A 54 -1.591 -8.677 -10.105 1.00 0.00 C ATOM 802 CG1 VAL A 54 -2.152 -7.287 -10.325 1.00 0.00 C ATOM 803 CG2 VAL A 54 -0.071 -8.647 -10.054 1.00 0.00 C ATOM 0 H VAL A 54 -4.186 -8.716 -8.791 1.00 0.00 H new ATOM 0 HA VAL A 54 -1.751 -10.362 -8.788 1.00 0.00 H new ATOM 0 HB VAL A 54 -1.887 -9.284 -10.960 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -1.700 -6.849 -11.215 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -3.232 -7.348 -10.459 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -1.928 -6.663 -9.460 1.00 0.00 H new ATOM 0 HG21 VAL A 54 0.314 -8.159 -10.950 1.00 0.00 H new ATOM 0 HG22 VAL A 54 0.253 -8.094 -9.172 1.00 0.00 H new ATOM 0 HG23 VAL A 54 0.312 -9.666 -10.004 1.00 0.00 H new ATOM 813 N ILE A 55 -2.629 -7.685 -7.134 1.00 0.00 N ATOM 814 CA ILE A 55 -2.388 -6.985 -5.887 1.00 0.00 C ATOM 815 C ILE A 55 -3.564 -7.228 -4.942 1.00 0.00 C ATOM 816 O ILE A 55 -4.706 -7.400 -5.389 1.00 0.00 O ATOM 817 CB ILE A 55 -2.174 -5.448 -6.124 1.00 0.00 C ATOM 818 CG1 ILE A 55 -0.954 -5.224 -7.011 1.00 0.00 C ATOM 819 CG2 ILE A 55 -1.971 -4.711 -4.802 1.00 0.00 C ATOM 820 CD1 ILE A 55 -0.749 -3.773 -7.445 1.00 0.00 C ATOM 0 H ILE A 55 -3.455 -7.373 -7.645 1.00 0.00 H new ATOM 0 HA ILE A 55 -1.473 -7.371 -5.438 1.00 0.00 H new ATOM 0 HB ILE A 55 -3.067 -5.056 -6.611 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -0.065 -5.560 -6.477 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -1.047 -5.847 -7.900 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -1.825 -3.648 -4.996 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -2.849 -4.847 -4.171 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -1.093 -5.111 -4.294 1.00 0.00 H new ATOM 0 HD11 ILE A 55 0.140 -3.703 -8.072 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -1.619 -3.436 -8.009 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -0.622 -3.144 -6.564 1.00 0.00 H new ATOM 832 N ASN A 56 -3.287 -7.315 -3.662 1.00 0.00 N ATOM 833 CA ASN A 56 -4.320 -7.479 -2.674 1.00 0.00 C ATOM 834 C ASN A 56 -4.688 -6.101 -2.205 1.00 0.00 C ATOM 835 O ASN A 56 -3.826 -5.379 -1.738 1.00 0.00 O ATOM 836 CB ASN A 56 -3.790 -8.217 -1.455 1.00 0.00 C ATOM 837 CG ASN A 56 -2.995 -9.474 -1.739 1.00 0.00 C ATOM 838 OD1 ASN A 56 -3.534 -10.570 -1.832 1.00 0.00 O ATOM 839 ND2 ASN A 56 -1.703 -9.328 -1.850 1.00 0.00 N ATOM 0 H ASN A 56 -2.342 -7.274 -3.280 1.00 0.00 H new ATOM 0 HA ASN A 56 -5.153 -8.033 -3.107 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -3.161 -7.533 -0.885 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -4.634 -8.480 -0.818 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -1.111 -10.141 -2.019 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -1.286 -8.401 -1.767 1.00 0.00 H new ATOM 846 N PHE A 57 -5.909 -5.717 -2.332 1.00 0.00 N ATOM 847 CA PHE A 57 -6.323 -4.410 -1.884 1.00 0.00 C ATOM 848 C PHE A 57 -7.088 -4.452 -0.586 1.00 0.00 C ATOM 849 O PHE A 57 -8.053 -5.194 -0.419 1.00 0.00 O ATOM 850 CB PHE A 57 -7.095 -3.678 -2.948 1.00 0.00 C ATOM 851 CG PHE A 57 -6.250 -2.803 -3.800 1.00 0.00 C ATOM 852 CD1 PHE A 57 -5.400 -3.330 -4.750 1.00 0.00 C ATOM 853 CD2 PHE A 57 -6.302 -1.440 -3.634 1.00 0.00 C ATOM 854 CE1 PHE A 57 -4.617 -2.499 -5.524 1.00 0.00 C ATOM 855 CE2 PHE A 57 -5.522 -0.601 -4.397 1.00 0.00 C ATOM 856 CZ PHE A 57 -4.676 -1.132 -5.345 1.00 0.00 C ATOM 0 H PHE A 57 -6.651 -6.283 -2.743 1.00 0.00 H new ATOM 0 HA PHE A 57 -5.408 -3.852 -1.689 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -7.604 -4.405 -3.581 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -7.867 -3.073 -2.473 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -5.347 -4.400 -4.889 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -6.966 -1.020 -2.893 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -3.958 -2.918 -6.270 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -5.573 0.468 -4.253 1.00 0.00 H new ATOM 0 HZ PHE A 57 -4.060 -0.480 -5.947 1.00 0.00 H new ATOM 866 N GLY A 58 -6.654 -3.653 0.322 1.00 0.00 N ATOM 867 CA GLY A 58 -7.256 -3.590 1.601 1.00 0.00 C ATOM 868 C GLY A 58 -7.239 -2.207 2.199 1.00 0.00 C ATOM 869 O GLY A 58 -6.213 -1.540 2.228 1.00 0.00 O ATOM 0 H GLY A 58 -5.864 -3.020 0.195 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -8.288 -3.934 1.527 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -6.739 -4.275 2.273 1.00 0.00 H new ATOM 873 N THR A 59 -8.352 -1.793 2.682 1.00 0.00 N ATOM 874 CA THR A 59 -8.490 -0.522 3.319 1.00 0.00 C ATOM 875 C THR A 59 -8.361 -0.702 4.826 1.00 0.00 C ATOM 876 O THR A 59 -8.785 -1.727 5.375 1.00 0.00 O ATOM 877 CB THR A 59 -9.843 0.138 2.957 1.00 0.00 C ATOM 878 OG1 THR A 59 -10.937 -0.752 3.275 1.00 0.00 O ATOM 879 CG2 THR A 59 -9.894 0.484 1.477 1.00 0.00 C ATOM 0 H THR A 59 -9.215 -2.335 2.648 1.00 0.00 H new ATOM 0 HA THR A 59 -7.700 0.141 2.966 1.00 0.00 H new ATOM 0 HB THR A 59 -9.937 1.054 3.541 1.00 0.00 H new ATOM 0 HG1 THR A 59 -10.854 -1.574 2.748 1.00 0.00 H new ATOM 0 HG21 THR A 59 -10.853 0.947 1.244 1.00 0.00 H new ATOM 0 HG22 THR A 59 -9.089 1.178 1.238 1.00 0.00 H new ATOM 0 HG23 THR A 59 -9.777 -0.425 0.887 1.00 0.00 H new ATOM 887 N ILE A 60 -7.758 0.239 5.471 1.00 0.00 N ATOM 888 CA ILE A 60 -7.516 0.184 6.877 1.00 0.00 C ATOM 889 C ILE A 60 -7.563 1.603 7.406 1.00 0.00 C ATOM 890 O ILE A 60 -7.367 2.550 6.660 1.00 0.00 O ATOM 891 CB ILE A 60 -6.142 -0.503 7.131 1.00 0.00 C ATOM 892 CG1 ILE A 60 -5.790 -0.572 8.620 1.00 0.00 C ATOM 893 CG2 ILE A 60 -5.035 0.147 6.308 1.00 0.00 C ATOM 894 CD1 ILE A 60 -4.453 -1.206 8.892 1.00 0.00 C ATOM 0 H ILE A 60 -7.411 1.089 5.026 1.00 0.00 H new ATOM 0 HA ILE A 60 -8.269 -0.406 7.399 1.00 0.00 H new ATOM 0 HB ILE A 60 -6.234 -1.535 6.793 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -5.796 0.436 9.034 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -6.563 -1.135 9.142 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -4.089 -0.356 6.509 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -5.273 0.063 5.248 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -4.951 1.199 6.579 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -4.269 -1.221 9.966 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -4.449 -2.226 8.509 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -3.670 -0.630 8.398 1.00 0.00 H new ATOM 906 N ASP A 61 -7.861 1.756 8.645 1.00 0.00 N ATOM 907 CA ASP A 61 -8.031 3.068 9.208 1.00 0.00 C ATOM 908 C ASP A 61 -6.693 3.641 9.619 1.00 0.00 C ATOM 909 O ASP A 61 -5.920 2.979 10.312 1.00 0.00 O ATOM 910 CB ASP A 61 -8.915 2.981 10.409 1.00 0.00 C ATOM 911 CG ASP A 61 -9.403 4.310 10.859 1.00 0.00 C ATOM 912 OD1 ASP A 61 -8.695 4.978 11.575 1.00 0.00 O ATOM 913 OD2 ASP A 61 -10.533 4.689 10.506 1.00 0.00 O ATOM 0 H ASP A 61 -7.996 0.988 9.303 1.00 0.00 H new ATOM 0 HA ASP A 61 -8.482 3.717 8.458 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -9.769 2.343 10.181 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -8.369 2.504 11.223 1.00 0.00 H new ATOM 918 N ALA A 62 -6.432 4.877 9.235 1.00 0.00 N ATOM 919 CA ALA A 62 -5.152 5.508 9.552 1.00 0.00 C ATOM 920 C ALA A 62 -5.180 6.186 10.905 1.00 0.00 C ATOM 921 O ALA A 62 -4.172 6.684 11.383 1.00 0.00 O ATOM 922 CB ALA A 62 -4.735 6.495 8.480 1.00 0.00 C ATOM 0 H ALA A 62 -7.079 5.464 8.708 1.00 0.00 H new ATOM 0 HA ALA A 62 -4.411 4.709 9.588 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -3.779 6.944 8.751 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -4.635 5.976 7.527 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -5.490 7.276 8.391 1.00 0.00 H new ATOM 928 N LYS A 63 -6.309 6.175 11.528 1.00 0.00 N ATOM 929 CA LYS A 63 -6.463 6.815 12.801 1.00 0.00 C ATOM 930 C LYS A 63 -6.483 5.770 13.917 1.00 0.00 C ATOM 931 O LYS A 63 -6.025 6.022 15.027 1.00 0.00 O ATOM 932 CB LYS A 63 -7.734 7.661 12.773 1.00 0.00 C ATOM 933 CG LYS A 63 -8.110 8.319 14.084 1.00 0.00 C ATOM 934 CD LYS A 63 -9.257 9.309 13.889 1.00 0.00 C ATOM 935 CE LYS A 63 -10.496 8.643 13.314 1.00 0.00 C ATOM 936 NZ LYS A 63 -11.551 9.616 12.977 1.00 0.00 N ATOM 0 H LYS A 63 -7.153 5.724 11.175 1.00 0.00 H new ATOM 0 HA LYS A 63 -5.619 7.474 13.003 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -7.615 8.438 12.018 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -8.563 7.029 12.453 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -8.401 7.557 14.807 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -7.244 8.836 14.497 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -9.504 9.769 14.846 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -8.935 10.110 13.224 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -10.222 8.083 12.420 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -10.886 7.923 14.034 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -12.375 9.114 12.589 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -11.833 10.133 13.834 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -11.190 10.288 12.270 1.00 0.00 H new ATOM 950 N ALA A 64 -7.002 4.605 13.610 1.00 0.00 N ATOM 951 CA ALA A 64 -7.056 3.511 14.546 1.00 0.00 C ATOM 952 C ALA A 64 -5.844 2.624 14.400 1.00 0.00 C ATOM 953 O ALA A 64 -5.222 2.239 15.393 1.00 0.00 O ATOM 954 CB ALA A 64 -8.320 2.691 14.345 1.00 0.00 C ATOM 0 H ALA A 64 -7.401 4.390 12.696 1.00 0.00 H new ATOM 0 HA ALA A 64 -7.066 3.932 15.551 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -8.339 1.871 15.062 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -9.193 3.326 14.496 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -8.335 2.288 13.332 1.00 0.00 H new ATOM 960 N PHE A 65 -5.505 2.277 13.163 1.00 0.00 N ATOM 961 CA PHE A 65 -4.386 1.402 12.930 1.00 0.00 C ATOM 962 C PHE A 65 -3.292 2.096 12.131 1.00 0.00 C ATOM 963 O PHE A 65 -2.398 1.443 11.590 1.00 0.00 O ATOM 964 CB PHE A 65 -4.837 0.175 12.164 1.00 0.00 C ATOM 965 CG PHE A 65 -5.897 -0.648 12.829 1.00 0.00 C ATOM 966 CD1 PHE A 65 -5.565 -1.549 13.820 1.00 0.00 C ATOM 967 CD2 PHE A 65 -7.226 -0.526 12.453 1.00 0.00 C ATOM 968 CE1 PHE A 65 -6.532 -2.315 14.428 1.00 0.00 C ATOM 969 CE2 PHE A 65 -8.197 -1.290 13.059 1.00 0.00 C ATOM 970 CZ PHE A 65 -7.850 -2.185 14.048 1.00 0.00 C ATOM 0 H PHE A 65 -5.989 2.590 12.321 1.00 0.00 H new ATOM 0 HA PHE A 65 -3.987 1.117 13.903 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -5.207 0.493 11.189 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -3.969 -0.459 11.985 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -4.533 -1.654 14.122 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -7.501 0.174 11.678 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -6.259 -3.017 15.202 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -9.230 -1.188 12.760 1.00 0.00 H new ATOM 0 HZ PHE A 65 -8.611 -2.784 14.525 1.00 0.00 H new ATOM 980 N GLY A 66 -3.319 3.403 12.117 1.00 0.00 N ATOM 981 CA GLY A 66 -2.432 4.160 11.253 1.00 0.00 C ATOM 982 C GLY A 66 -0.966 4.086 11.572 1.00 0.00 C ATOM 983 O GLY A 66 -0.154 4.423 10.724 1.00 0.00 O ATOM 0 H GLY A 66 -3.942 3.971 12.691 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -2.577 3.816 10.229 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -2.736 5.206 11.284 1.00 0.00 H new ATOM 987 N ALA A 67 -0.609 3.604 12.750 1.00 0.00 N ATOM 988 CA ALA A 67 0.801 3.456 13.115 1.00 0.00 C ATOM 989 C ALA A 67 1.479 2.452 12.184 1.00 0.00 C ATOM 990 O ALA A 67 2.688 2.514 11.939 1.00 0.00 O ATOM 991 CB ALA A 67 0.942 3.013 14.559 1.00 0.00 C ATOM 0 H ALA A 67 -1.267 3.308 13.471 1.00 0.00 H new ATOM 0 HA ALA A 67 1.288 4.425 13.008 1.00 0.00 H new ATOM 0 HB1 ALA A 67 1.999 2.910 14.806 1.00 0.00 H new ATOM 0 HB2 ALA A 67 0.487 3.756 15.214 1.00 0.00 H new ATOM 0 HB3 ALA A 67 0.442 2.054 14.696 1.00 0.00 H new ATOM 997 N HIS A 68 0.674 1.564 11.619 1.00 0.00 N ATOM 998 CA HIS A 68 1.156 0.561 10.706 1.00 0.00 C ATOM 999 C HIS A 68 1.481 1.176 9.336 1.00 0.00 C ATOM 1000 O HIS A 68 2.306 0.646 8.602 1.00 0.00 O ATOM 1001 CB HIS A 68 0.144 -0.598 10.555 1.00 0.00 C ATOM 1002 CG HIS A 68 -0.099 -1.411 11.803 1.00 0.00 C ATOM 1003 ND1 HIS A 68 0.500 -2.630 12.066 1.00 0.00 N ATOM 1004 CD2 HIS A 68 -0.927 -1.174 12.854 1.00 0.00 C ATOM 1005 CE1 HIS A 68 0.026 -3.083 13.228 1.00 0.00 C ATOM 1006 NE2 HIS A 68 -0.844 -2.236 13.751 1.00 0.00 N ATOM 0 H HIS A 68 -0.331 1.526 11.787 1.00 0.00 H new ATOM 0 HA HIS A 68 2.075 0.151 11.125 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -0.808 -0.186 10.219 1.00 0.00 H new ATOM 0 HB3 HIS A 68 0.497 -1.266 9.769 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -1.551 -0.301 12.975 1.00 0.00 H new ATOM 0 HE1 HIS A 68 0.315 -4.019 13.682 1.00 0.00 H new ATOM 0 HE2 HIS A 68 -1.350 -2.339 14.630 1.00 0.00 H new ATOM 1014 N ALA A 69 0.879 2.339 9.022 1.00 0.00 N ATOM 1015 CA ALA A 69 1.085 2.991 7.713 1.00 0.00 C ATOM 1016 C ALA A 69 2.516 3.322 7.549 1.00 0.00 C ATOM 1017 O ALA A 69 3.112 3.079 6.530 1.00 0.00 O ATOM 1018 CB ALA A 69 0.250 4.263 7.568 1.00 0.00 C ATOM 0 H ALA A 69 0.252 2.843 9.649 1.00 0.00 H new ATOM 0 HA ALA A 69 0.764 2.293 6.940 1.00 0.00 H new ATOM 0 HB1 ALA A 69 0.433 4.709 6.590 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -0.808 4.017 7.662 1.00 0.00 H new ATOM 0 HB3 ALA A 69 0.528 4.972 8.348 1.00 0.00 H new ATOM 1024 N GLY A 70 3.084 3.840 8.562 1.00 0.00 N ATOM 1025 CA GLY A 70 4.453 4.177 8.455 1.00 0.00 C ATOM 1026 C GLY A 70 5.368 3.377 9.290 1.00 0.00 C ATOM 1027 O GLY A 70 6.463 3.822 9.586 1.00 0.00 O ATOM 0 H GLY A 70 2.641 4.039 9.459 1.00 0.00 H new ATOM 0 HA2 GLY A 70 4.755 4.073 7.413 1.00 0.00 H new ATOM 0 HA3 GLY A 70 4.573 5.228 8.719 1.00 0.00 H new ATOM 1031 N ASN A 71 4.964 2.173 9.658 1.00 0.00 N ATOM 1032 CA ASN A 71 5.930 1.285 10.286 1.00 0.00 C ATOM 1033 C ASN A 71 6.790 0.715 9.161 1.00 0.00 C ATOM 1034 O ASN A 71 7.875 0.179 9.366 1.00 0.00 O ATOM 1035 CB ASN A 71 5.284 0.160 11.160 1.00 0.00 C ATOM 1036 CG ASN A 71 4.861 -1.144 10.448 1.00 0.00 C ATOM 1037 OD1 ASN A 71 4.987 -2.221 11.026 1.00 0.00 O ATOM 1038 ND2 ASN A 71 4.268 -1.076 9.289 1.00 0.00 N ATOM 0 H ASN A 71 4.022 1.800 9.542 1.00 0.00 H new ATOM 0 HA ASN A 71 6.531 1.849 10.999 1.00 0.00 H new ATOM 0 HB2 ASN A 71 5.991 -0.101 11.948 1.00 0.00 H new ATOM 0 HB3 ASN A 71 4.403 0.577 11.648 1.00 0.00 H new ATOM 0 HD21 ASN A 71 3.903 -1.922 8.853 1.00 0.00 H new ATOM 0 HD22 ASN A 71 4.169 -0.176 8.819 1.00 0.00 H new ATOM 1045 N LEU A 72 6.267 0.912 7.952 1.00 0.00 N ATOM 1046 CA LEU A 72 6.883 0.534 6.735 1.00 0.00 C ATOM 1047 C LEU A 72 7.549 1.740 6.073 1.00 0.00 C ATOM 1048 O LEU A 72 8.559 1.584 5.400 1.00 0.00 O ATOM 1049 CB LEU A 72 5.828 -0.140 5.811 1.00 0.00 C ATOM 1050 CG LEU A 72 4.547 0.630 5.409 1.00 0.00 C ATOM 1051 CD1 LEU A 72 4.815 1.682 4.365 1.00 0.00 C ATOM 1052 CD2 LEU A 72 3.486 -0.306 4.898 1.00 0.00 C ATOM 0 H LEU A 72 5.361 1.361 7.816 1.00 0.00 H new ATOM 0 HA LEU A 72 7.672 -0.192 6.930 1.00 0.00 H new ATOM 0 HB2 LEU A 72 6.338 -0.424 4.890 1.00 0.00 H new ATOM 0 HB3 LEU A 72 5.512 -1.062 6.298 1.00 0.00 H new ATOM 0 HG LEU A 72 4.195 1.124 6.315 1.00 0.00 H new ATOM 0 HD11 LEU A 72 3.885 2.194 4.117 1.00 0.00 H new ATOM 0 HD12 LEU A 72 5.534 2.404 4.752 1.00 0.00 H new ATOM 0 HD13 LEU A 72 5.220 1.211 3.469 1.00 0.00 H new ATOM 0 HD21 LEU A 72 2.599 0.265 4.624 1.00 0.00 H new ATOM 0 HD22 LEU A 72 3.860 -0.837 4.023 1.00 0.00 H new ATOM 0 HD23 LEU A 72 3.229 -1.024 5.676 1.00 0.00 H new ATOM 1064 N ASN A 73 7.007 2.963 6.303 1.00 0.00 N ATOM 1065 CA ASN A 73 7.555 4.153 5.604 1.00 0.00 C ATOM 1066 C ASN A 73 6.915 5.472 6.036 1.00 0.00 C ATOM 1067 O ASN A 73 7.598 6.364 6.524 1.00 0.00 O ATOM 1068 CB ASN A 73 7.265 4.016 4.135 1.00 0.00 C ATOM 1069 CG ASN A 73 8.253 4.722 3.243 1.00 0.00 C ATOM 1070 OD1 ASN A 73 8.116 5.901 2.942 1.00 0.00 O ATOM 1071 ND2 ASN A 73 9.213 3.977 2.762 1.00 0.00 N ATOM 0 H ASN A 73 6.228 3.148 6.936 1.00 0.00 H new ATOM 0 HA ASN A 73 8.617 4.185 5.846 1.00 0.00 H new ATOM 0 HB2 ASN A 73 7.250 2.957 3.876 1.00 0.00 H new ATOM 0 HB3 ASN A 73 6.267 4.407 3.935 1.00 0.00 H new ATOM 0 HD21 ASN A 73 9.887 4.374 2.107 1.00 0.00 H new ATOM 0 HD22 ASN A 73 9.288 2.999 3.041 1.00 0.00 H new ATOM 1078 N LEU A 74 5.584 5.574 5.834 1.00 0.00 N ATOM 1079 CA LEU A 74 4.839 6.841 5.977 1.00 0.00 C ATOM 1080 C LEU A 74 5.022 7.561 7.309 1.00 0.00 C ATOM 1081 O LEU A 74 5.330 6.975 8.340 1.00 0.00 O ATOM 1082 CB LEU A 74 3.326 6.723 5.627 1.00 0.00 C ATOM 1083 CG LEU A 74 2.947 6.319 4.180 1.00 0.00 C ATOM 1084 CD1 LEU A 74 3.773 7.053 3.139 1.00 0.00 C ATOM 1085 CD2 LEU A 74 2.993 4.831 3.998 1.00 0.00 C ATOM 0 H LEU A 74 4.998 4.782 5.568 1.00 0.00 H new ATOM 0 HA LEU A 74 5.313 7.471 5.224 1.00 0.00 H new ATOM 0 HB2 LEU A 74 2.882 5.994 6.305 1.00 0.00 H new ATOM 0 HB3 LEU A 74 2.857 7.684 5.840 1.00 0.00 H new ATOM 0 HG LEU A 74 1.915 6.631 4.020 1.00 0.00 H new ATOM 0 HD11 LEU A 74 3.469 6.734 2.142 1.00 0.00 H new ATOM 0 HD12 LEU A 74 3.615 8.127 3.241 1.00 0.00 H new ATOM 0 HD13 LEU A 74 4.829 6.826 3.286 1.00 0.00 H new ATOM 0 HD21 LEU A 74 2.722 4.581 2.972 1.00 0.00 H new ATOM 0 HD22 LEU A 74 4.000 4.470 4.205 1.00 0.00 H new ATOM 0 HD23 LEU A 74 2.290 4.359 4.684 1.00 0.00 H new ATOM 1097 N LYS A 75 4.806 8.831 7.253 1.00 0.00 N ATOM 1098 CA LYS A 75 4.963 9.733 8.367 1.00 0.00 C ATOM 1099 C LYS A 75 3.766 9.671 9.355 1.00 0.00 C ATOM 1100 O LYS A 75 3.839 10.169 10.480 1.00 0.00 O ATOM 1101 CB LYS A 75 5.185 11.107 7.775 1.00 0.00 C ATOM 1102 CG LYS A 75 5.304 12.230 8.745 1.00 0.00 C ATOM 1103 CD LYS A 75 5.583 13.547 8.015 1.00 0.00 C ATOM 1104 CE LYS A 75 6.882 13.486 7.211 1.00 0.00 C ATOM 1105 NZ LYS A 75 7.127 14.719 6.455 1.00 0.00 N ATOM 0 H LYS A 75 4.502 9.299 6.399 1.00 0.00 H new ATOM 0 HA LYS A 75 5.817 9.450 8.982 1.00 0.00 H new ATOM 0 HB2 LYS A 75 6.093 11.078 7.172 1.00 0.00 H new ATOM 0 HB3 LYS A 75 4.359 11.326 7.098 1.00 0.00 H new ATOM 0 HG2 LYS A 75 4.384 12.317 9.324 1.00 0.00 H new ATOM 0 HG3 LYS A 75 6.107 12.023 9.452 1.00 0.00 H new ATOM 0 HD2 LYS A 75 4.752 13.775 7.347 1.00 0.00 H new ATOM 0 HD3 LYS A 75 5.642 14.359 8.740 1.00 0.00 H new ATOM 0 HE2 LYS A 75 7.717 13.305 7.888 1.00 0.00 H new ATOM 0 HE3 LYS A 75 6.841 12.642 6.522 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 8.018 14.631 5.926 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 6.344 14.880 5.790 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 7.193 15.522 7.113 1.00 0.00 H new ATOM 1119 N THR A 76 2.707 9.034 8.901 1.00 0.00 N ATOM 1120 CA THR A 76 1.451 8.738 9.660 1.00 0.00 C ATOM 1121 C THR A 76 0.744 9.992 10.193 1.00 0.00 C ATOM 1122 O THR A 76 -0.013 9.933 11.161 1.00 0.00 O ATOM 1123 CB THR A 76 1.706 7.711 10.822 1.00 0.00 C ATOM 1124 OG1 THR A 76 2.669 8.195 11.782 1.00 0.00 O ATOM 1125 CG2 THR A 76 2.222 6.418 10.260 1.00 0.00 C ATOM 0 H THR A 76 2.670 8.679 7.946 1.00 0.00 H new ATOM 0 HA THR A 76 0.774 8.286 8.935 1.00 0.00 H new ATOM 0 HB THR A 76 0.751 7.567 11.327 1.00 0.00 H new ATOM 0 HG1 THR A 76 2.878 9.133 11.591 1.00 0.00 H new ATOM 0 HG21 THR A 76 2.396 5.712 11.072 1.00 0.00 H new ATOM 0 HG22 THR A 76 1.488 6.003 9.569 1.00 0.00 H new ATOM 0 HG23 THR A 76 3.157 6.599 9.730 1.00 0.00 H new ATOM 1133 N ASP A 77 0.919 11.085 9.507 1.00 0.00 N ATOM 1134 CA ASP A 77 0.464 12.368 10.015 1.00 0.00 C ATOM 1135 C ASP A 77 -0.644 13.018 9.192 1.00 0.00 C ATOM 1136 O ASP A 77 -1.451 13.790 9.736 1.00 0.00 O ATOM 1137 CB ASP A 77 1.639 13.341 10.034 1.00 0.00 C ATOM 1138 CG ASP A 77 2.075 13.766 8.636 1.00 0.00 C ATOM 1139 OD1 ASP A 77 2.372 12.887 7.786 1.00 0.00 O ATOM 1140 OD2 ASP A 77 2.075 14.977 8.355 1.00 0.00 O ATOM 0 H ASP A 77 1.372 11.124 8.594 1.00 0.00 H new ATOM 0 HA ASP A 77 0.060 12.163 11.007 1.00 0.00 H new ATOM 0 HB2 ASP A 77 1.364 14.225 10.609 1.00 0.00 H new ATOM 0 HB3 ASP A 77 2.481 12.877 10.547 1.00 0.00 H new ATOM 1145 N LYS A 78 -0.697 12.746 7.915 1.00 0.00 N ATOM 1146 CA LYS A 78 -1.544 13.549 7.064 1.00 0.00 C ATOM 1147 C LYS A 78 -2.547 12.732 6.266 1.00 0.00 C ATOM 1148 O LYS A 78 -2.156 12.065 5.352 1.00 0.00 O ATOM 1149 CB LYS A 78 -0.652 14.314 6.065 1.00 0.00 C ATOM 1150 CG LYS A 78 -1.214 15.661 5.620 1.00 0.00 C ATOM 1151 CD LYS A 78 -1.092 16.715 6.717 1.00 0.00 C ATOM 1152 CE LYS A 78 0.214 17.535 6.604 1.00 0.00 C ATOM 1153 NZ LYS A 78 1.449 16.715 6.512 1.00 0.00 N ATOM 0 H LYS A 78 -0.182 11.999 7.449 1.00 0.00 H new ATOM 0 HA LYS A 78 -2.108 14.216 7.716 1.00 0.00 H new ATOM 0 HB2 LYS A 78 0.326 14.474 6.519 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -0.496 13.690 5.185 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -0.684 16.000 4.730 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -2.262 15.544 5.343 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -1.947 17.389 6.666 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -1.129 16.227 7.691 1.00 0.00 H new ATOM 0 HE2 LYS A 78 0.151 18.175 5.724 1.00 0.00 H new ATOM 0 HE3 LYS A 78 0.292 18.191 7.471 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 2.278 17.341 6.457 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 1.528 16.110 7.354 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 1.408 16.119 5.661 1.00 0.00 H new ATOM 1167 N PHE A 79 -3.834 12.770 6.647 1.00 0.00 N ATOM 1168 CA PHE A 79 -4.916 12.221 5.795 1.00 0.00 C ATOM 1169 C PHE A 79 -4.719 10.688 5.516 1.00 0.00 C ATOM 1170 O PHE A 79 -3.936 10.037 6.225 1.00 0.00 O ATOM 1171 CB PHE A 79 -4.959 13.079 4.493 1.00 0.00 C ATOM 1172 CG PHE A 79 -5.577 14.454 4.653 1.00 0.00 C ATOM 1173 CD1 PHE A 79 -5.005 15.414 5.475 1.00 0.00 C ATOM 1174 CD2 PHE A 79 -6.727 14.784 3.959 1.00 0.00 C ATOM 1175 CE1 PHE A 79 -5.568 16.667 5.603 1.00 0.00 C ATOM 1176 CE2 PHE A 79 -7.297 16.035 4.084 1.00 0.00 C ATOM 1177 CZ PHE A 79 -6.716 16.978 4.907 1.00 0.00 C ATOM 0 H PHE A 79 -4.155 13.170 7.529 1.00 0.00 H new ATOM 0 HA PHE A 79 -5.878 12.286 6.304 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -3.942 13.195 4.119 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -5.518 12.532 3.733 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -4.105 15.177 6.023 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -7.186 14.053 3.310 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -5.110 17.403 6.247 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -8.197 16.276 3.538 1.00 0.00 H new ATOM 0 HZ PHE A 79 -7.160 17.958 5.005 1.00 0.00 H new ATOM 1187 N PRO A 80 -5.511 10.030 4.599 1.00 0.00 N ATOM 1188 CA PRO A 80 -5.200 8.670 4.205 1.00 0.00 C ATOM 1189 C PRO A 80 -3.801 8.507 3.590 1.00 0.00 C ATOM 1190 O PRO A 80 -3.275 9.414 2.933 1.00 0.00 O ATOM 1191 CB PRO A 80 -6.304 8.294 3.202 1.00 0.00 C ATOM 1192 CG PRO A 80 -6.971 9.538 2.846 1.00 0.00 C ATOM 1193 CD PRO A 80 -6.818 10.448 4.018 1.00 0.00 C ATOM 0 HA PRO A 80 -5.176 8.014 5.076 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -5.881 7.813 2.320 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -7.007 7.588 3.644 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -6.525 9.976 1.953 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -8.024 9.364 2.624 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -6.809 11.496 3.717 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -7.634 10.328 4.731 1.00 0.00 H new ATOM 1201 N ALA A 81 -3.250 7.332 3.791 1.00 0.00 N ATOM 1202 CA ALA A 81 -1.925 6.975 3.379 1.00 0.00 C ATOM 1203 C ALA A 81 -1.980 5.633 2.658 1.00 0.00 C ATOM 1204 O ALA A 81 -2.501 4.656 3.185 1.00 0.00 O ATOM 1205 CB ALA A 81 -1.031 6.873 4.606 1.00 0.00 C ATOM 0 H ALA A 81 -3.738 6.573 4.266 1.00 0.00 H new ATOM 0 HA ALA A 81 -1.521 7.731 2.706 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -0.021 6.601 4.299 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -1.008 7.834 5.120 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -1.423 6.111 5.279 1.00 0.00 H new ATOM 1211 N PHE A 82 -1.460 5.584 1.475 1.00 0.00 N ATOM 1212 CA PHE A 82 -1.505 4.380 0.674 1.00 0.00 C ATOM 1213 C PHE A 82 -0.134 3.721 0.652 1.00 0.00 C ATOM 1214 O PHE A 82 0.824 4.325 0.213 1.00 0.00 O ATOM 1215 CB PHE A 82 -1.972 4.746 -0.737 1.00 0.00 C ATOM 1216 CG PHE A 82 -2.028 3.612 -1.707 1.00 0.00 C ATOM 1217 CD1 PHE A 82 -2.966 2.630 -1.568 1.00 0.00 C ATOM 1218 CD2 PHE A 82 -1.147 3.547 -2.770 1.00 0.00 C ATOM 1219 CE1 PHE A 82 -3.044 1.593 -2.459 1.00 0.00 C ATOM 1220 CE2 PHE A 82 -1.218 2.514 -3.672 1.00 0.00 C ATOM 1221 CZ PHE A 82 -2.171 1.534 -3.518 1.00 0.00 C ATOM 0 H PHE A 82 -0.990 6.371 1.027 1.00 0.00 H new ATOM 0 HA PHE A 82 -2.208 3.665 1.103 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -2.964 5.193 -0.669 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -1.305 5.510 -1.136 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -3.659 2.672 -0.741 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -0.397 4.314 -2.892 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -3.790 0.823 -2.329 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -0.527 2.471 -4.501 1.00 0.00 H new ATOM 0 HZ PHE A 82 -2.233 0.721 -4.227 1.00 0.00 H new ATOM 1231 N ALA A 83 -0.036 2.509 1.139 1.00 0.00 N ATOM 1232 CA ALA A 83 1.230 1.827 1.184 1.00 0.00 C ATOM 1233 C ALA A 83 1.170 0.459 0.533 1.00 0.00 C ATOM 1234 O ALA A 83 0.444 -0.397 0.979 1.00 0.00 O ATOM 1235 CB ALA A 83 1.661 1.684 2.612 1.00 0.00 C ATOM 0 H ALA A 83 -0.821 1.974 1.511 1.00 0.00 H new ATOM 0 HA ALA A 83 1.950 2.423 0.623 1.00 0.00 H new ATOM 0 HB1 ALA A 83 2.620 1.168 2.653 1.00 0.00 H new ATOM 0 HB2 ALA A 83 1.761 2.671 3.062 1.00 0.00 H new ATOM 0 HB3 ALA A 83 0.916 1.109 3.161 1.00 0.00 H new ATOM 1241 N ILE A 84 1.916 0.254 -0.517 1.00 0.00 N ATOM 1242 CA ILE A 84 1.959 -1.052 -1.139 1.00 0.00 C ATOM 1243 C ILE A 84 3.084 -1.848 -0.515 1.00 0.00 C ATOM 1244 O ILE A 84 4.253 -1.538 -0.706 1.00 0.00 O ATOM 1245 CB ILE A 84 2.215 -0.982 -2.659 1.00 0.00 C ATOM 1246 CG1 ILE A 84 1.233 -0.034 -3.336 1.00 0.00 C ATOM 1247 CG2 ILE A 84 2.108 -2.382 -3.276 1.00 0.00 C ATOM 1248 CD1 ILE A 84 1.542 0.210 -4.793 1.00 0.00 C ATOM 0 H ILE A 84 2.499 0.963 -0.961 1.00 0.00 H new ATOM 0 HA ILE A 84 0.986 -1.518 -0.981 1.00 0.00 H new ATOM 0 HB ILE A 84 3.223 -0.597 -2.817 1.00 0.00 H new ATOM 0 HG12 ILE A 84 0.226 -0.443 -3.249 1.00 0.00 H new ATOM 0 HG13 ILE A 84 1.236 0.919 -2.807 1.00 0.00 H new ATOM 0 HG21 ILE A 84 2.290 -2.322 -4.349 1.00 0.00 H new ATOM 0 HG22 ILE A 84 2.848 -3.039 -2.819 1.00 0.00 H new ATOM 0 HG23 ILE A 84 1.110 -2.782 -3.100 1.00 0.00 H new ATOM 0 HD11 ILE A 84 0.804 0.894 -5.212 1.00 0.00 H new ATOM 0 HD12 ILE A 84 2.536 0.648 -4.886 1.00 0.00 H new ATOM 0 HD13 ILE A 84 1.510 -0.735 -5.335 1.00 0.00 H new ATOM 1260 N GLN A 85 2.753 -2.835 0.233 1.00 0.00 N ATOM 1261 CA GLN A 85 3.744 -3.659 0.803 1.00 0.00 C ATOM 1262 C GLN A 85 3.993 -4.806 -0.116 1.00 0.00 C ATOM 1263 O GLN A 85 3.055 -5.412 -0.632 1.00 0.00 O ATOM 1264 CB GLN A 85 3.355 -4.157 2.182 1.00 0.00 C ATOM 1265 CG GLN A 85 4.303 -5.219 2.701 1.00 0.00 C ATOM 1266 CD GLN A 85 4.051 -5.616 4.107 1.00 0.00 C ATOM 1267 OE1 GLN A 85 3.619 -4.826 4.915 1.00 0.00 O ATOM 1268 NE2 GLN A 85 4.335 -6.838 4.403 1.00 0.00 N ATOM 0 H GLN A 85 1.793 -3.091 0.464 1.00 0.00 H new ATOM 0 HA GLN A 85 4.653 -3.071 0.931 1.00 0.00 H new ATOM 0 HB2 GLN A 85 3.338 -3.318 2.877 1.00 0.00 H new ATOM 0 HB3 GLN A 85 2.344 -4.562 2.147 1.00 0.00 H new ATOM 0 HG2 GLN A 85 4.227 -6.101 2.066 1.00 0.00 H new ATOM 0 HG3 GLN A 85 5.326 -4.852 2.615 1.00 0.00 H new ATOM 0 HE21 GLN A 85 4.697 -7.466 3.685 1.00 0.00 H new ATOM 0 HE22 GLN A 85 4.198 -7.177 5.355 1.00 0.00 H new ATOM 1277 N GLU A 86 5.226 -5.102 -0.329 1.00 0.00 N ATOM 1278 CA GLU A 86 5.543 -6.214 -1.186 1.00 0.00 C ATOM 1279 C GLU A 86 5.655 -7.443 -0.404 1.00 0.00 C ATOM 1280 O GLU A 86 6.319 -7.469 0.630 1.00 0.00 O ATOM 1281 CB GLU A 86 6.810 -6.024 -1.997 1.00 0.00 C ATOM 1282 CG GLU A 86 6.573 -5.770 -3.468 1.00 0.00 C ATOM 1283 CD GLU A 86 6.229 -7.057 -4.177 1.00 0.00 C ATOM 1284 OE1 GLU A 86 5.429 -7.834 -3.641 1.00 0.00 O ATOM 1285 OE2 GLU A 86 6.871 -7.360 -5.200 1.00 0.00 O ATOM 0 H GLU A 86 6.026 -4.607 0.065 1.00 0.00 H new ATOM 0 HA GLU A 86 4.719 -6.282 -1.896 1.00 0.00 H new ATOM 0 HB2 GLU A 86 7.372 -5.187 -1.581 1.00 0.00 H new ATOM 0 HB3 GLU A 86 7.433 -6.912 -1.889 1.00 0.00 H new ATOM 0 HG2 GLU A 86 5.763 -5.051 -3.593 1.00 0.00 H new ATOM 0 HG3 GLU A 86 7.464 -5.328 -3.915 1.00 0.00 H new ATOM 1292 N VAL A 87 5.032 -8.452 -0.886 1.00 0.00 N ATOM 1293 CA VAL A 87 5.110 -9.727 -0.273 1.00 0.00 C ATOM 1294 C VAL A 87 6.101 -10.553 -1.077 1.00 0.00 C ATOM 1295 O VAL A 87 6.509 -11.646 -0.683 1.00 0.00 O ATOM 1296 CB VAL A 87 3.714 -10.420 -0.200 1.00 0.00 C ATOM 1297 CG1 VAL A 87 3.779 -11.689 0.617 1.00 0.00 C ATOM 1298 CG2 VAL A 87 2.679 -9.468 0.380 1.00 0.00 C ATOM 0 H VAL A 87 4.449 -8.418 -1.722 1.00 0.00 H new ATOM 0 HA VAL A 87 5.446 -9.628 0.759 1.00 0.00 H new ATOM 0 HB VAL A 87 3.416 -10.686 -1.214 1.00 0.00 H new ATOM 0 HG11 VAL A 87 2.792 -12.151 0.651 1.00 0.00 H new ATOM 0 HG12 VAL A 87 4.488 -12.380 0.160 1.00 0.00 H new ATOM 0 HG13 VAL A 87 4.104 -11.453 1.630 1.00 0.00 H new ATOM 0 HG21 VAL A 87 1.711 -9.966 0.424 1.00 0.00 H new ATOM 0 HG22 VAL A 87 2.980 -9.171 1.384 1.00 0.00 H new ATOM 0 HG23 VAL A 87 2.603 -8.584 -0.253 1.00 0.00 H new ATOM 1308 N ALA A 88 6.541 -9.996 -2.188 1.00 0.00 N ATOM 1309 CA ALA A 88 7.473 -10.709 -3.026 1.00 0.00 C ATOM 1310 C ALA A 88 8.868 -10.205 -2.771 1.00 0.00 C ATOM 1311 O ALA A 88 9.795 -10.978 -2.558 1.00 0.00 O ATOM 1312 CB ALA A 88 7.102 -10.584 -4.494 1.00 0.00 C ATOM 0 H ALA A 88 6.273 -9.071 -2.523 1.00 0.00 H new ATOM 0 HA ALA A 88 7.431 -11.769 -2.775 1.00 0.00 H new ATOM 0 HB1 ALA A 88 7.824 -11.132 -5.100 1.00 0.00 H new ATOM 0 HB2 ALA A 88 6.106 -10.997 -4.654 1.00 0.00 H new ATOM 0 HB3 ALA A 88 7.110 -9.533 -4.783 1.00 0.00 H new ATOM 1318 N LYS A 89 9.001 -8.902 -2.731 1.00 0.00 N ATOM 1319 CA LYS A 89 10.288 -8.281 -2.525 1.00 0.00 C ATOM 1320 C LYS A 89 10.497 -8.024 -1.036 1.00 0.00 C ATOM 1321 O LYS A 89 11.630 -7.953 -0.564 1.00 0.00 O ATOM 1322 CB LYS A 89 10.326 -6.923 -3.213 1.00 0.00 C ATOM 1323 CG LYS A 89 9.814 -6.855 -4.639 1.00 0.00 C ATOM 1324 CD LYS A 89 10.580 -7.709 -5.611 1.00 0.00 C ATOM 1325 CE LYS A 89 9.984 -7.570 -7.008 1.00 0.00 C ATOM 1326 NZ LYS A 89 8.597 -8.113 -7.096 1.00 0.00 N ATOM 0 H LYS A 89 8.228 -8.246 -2.839 1.00 0.00 H new ATOM 0 HA LYS A 89 11.055 -8.943 -2.926 1.00 0.00 H new ATOM 0 HB2 LYS A 89 9.746 -6.223 -2.612 1.00 0.00 H new ATOM 0 HB3 LYS A 89 11.357 -6.570 -3.207 1.00 0.00 H new ATOM 0 HG2 LYS A 89 8.767 -7.159 -4.652 1.00 0.00 H new ATOM 0 HG3 LYS A 89 9.849 -5.819 -4.977 1.00 0.00 H new ATOM 0 HD2 LYS A 89 11.628 -7.411 -5.622 1.00 0.00 H new ATOM 0 HD3 LYS A 89 10.549 -8.752 -5.295 1.00 0.00 H new ATOM 0 HE2 LYS A 89 9.977 -6.518 -7.293 1.00 0.00 H new ATOM 0 HE3 LYS A 89 10.620 -8.090 -7.724 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 8.295 -8.135 -8.091 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 8.576 -9.077 -6.707 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 7.951 -7.506 -6.552 1.00 0.00 H new ATOM 1340 N ASN A 90 9.372 -7.892 -0.317 1.00 0.00 N ATOM 1341 CA ASN A 90 9.334 -7.464 1.095 1.00 0.00 C ATOM 1342 C ASN A 90 9.797 -6.022 1.128 1.00 0.00 C ATOM 1343 O ASN A 90 10.822 -5.652 1.683 1.00 0.00 O ATOM 1344 CB ASN A 90 10.141 -8.364 2.062 1.00 0.00 C ATOM 1345 CG ASN A 90 9.917 -7.988 3.526 1.00 0.00 C ATOM 1346 OD1 ASN A 90 8.836 -7.505 3.905 1.00 0.00 O ATOM 1347 ND2 ASN A 90 10.907 -8.205 4.352 1.00 0.00 N ATOM 0 H ASN A 90 8.447 -8.082 -0.704 1.00 0.00 H new ATOM 0 HA ASN A 90 8.314 -7.560 1.466 1.00 0.00 H new ATOM 0 HB2 ASN A 90 9.857 -9.405 1.909 1.00 0.00 H new ATOM 0 HB3 ASN A 90 11.203 -8.286 1.827 1.00 0.00 H new ATOM 0 HD21 ASN A 90 10.806 -7.977 5.341 1.00 0.00 H new ATOM 0 HD22 ASN A 90 11.781 -8.603 4.007 1.00 0.00 H new ATOM 1354 N GLN A 91 9.059 -5.235 0.412 1.00 0.00 N ATOM 1355 CA GLN A 91 9.360 -3.848 0.143 1.00 0.00 C ATOM 1356 C GLN A 91 8.152 -3.070 0.445 1.00 0.00 C ATOM 1357 O GLN A 91 7.129 -3.650 0.773 1.00 0.00 O ATOM 1358 CB GLN A 91 9.636 -3.685 -1.330 1.00 0.00 C ATOM 1359 CG GLN A 91 11.007 -3.174 -1.740 1.00 0.00 C ATOM 1360 CD GLN A 91 12.197 -4.127 -1.595 1.00 0.00 C ATOM 1361 OE1 GLN A 91 13.125 -4.056 -2.386 1.00 0.00 O ATOM 1362 NE2 GLN A 91 12.235 -4.943 -0.595 1.00 0.00 N ATOM 0 H GLN A 91 8.191 -5.546 -0.024 1.00 0.00 H new ATOM 0 HA GLN A 91 10.216 -3.523 0.734 1.00 0.00 H new ATOM 0 HB2 GLN A 91 9.482 -4.652 -1.809 1.00 0.00 H new ATOM 0 HB3 GLN A 91 8.889 -3.004 -1.738 1.00 0.00 H new ATOM 0 HG2 GLN A 91 10.951 -2.865 -2.784 1.00 0.00 H new ATOM 0 HG3 GLN A 91 11.220 -2.280 -1.154 1.00 0.00 H new ATOM 0 HE21 GLN A 91 11.451 -4.989 0.056 1.00 0.00 H new ATOM 0 HE22 GLN A 91 13.049 -5.542 -0.456 1.00 0.00 H new ATOM 1371 N LYS A 92 8.238 -1.769 0.336 1.00 0.00 N ATOM 1372 CA LYS A 92 7.122 -0.934 0.630 1.00 0.00 C ATOM 1373 C LYS A 92 7.130 0.213 -0.372 1.00 0.00 C ATOM 1374 O LYS A 92 8.063 1.027 -0.381 1.00 0.00 O ATOM 1375 CB LYS A 92 7.260 -0.365 2.045 1.00 0.00 C ATOM 1376 CG LYS A 92 7.796 -1.346 3.112 1.00 0.00 C ATOM 1377 CD LYS A 92 6.865 -2.478 3.533 1.00 0.00 C ATOM 1378 CE LYS A 92 7.519 -3.241 4.689 1.00 0.00 C ATOM 1379 NZ LYS A 92 6.665 -4.294 5.273 1.00 0.00 N ATOM 0 H LYS A 92 9.079 -1.271 0.043 1.00 0.00 H new ATOM 0 HA LYS A 92 6.194 -1.503 0.567 1.00 0.00 H new ATOM 0 HB2 LYS A 92 7.923 0.499 2.006 1.00 0.00 H new ATOM 0 HB3 LYS A 92 6.284 -0.003 2.368 1.00 0.00 H new ATOM 0 HG2 LYS A 92 8.719 -1.787 2.735 1.00 0.00 H new ATOM 0 HG3 LYS A 92 8.057 -0.772 4.001 1.00 0.00 H new ATOM 0 HD2 LYS A 92 5.899 -2.079 3.841 1.00 0.00 H new ATOM 0 HD3 LYS A 92 6.680 -3.148 2.694 1.00 0.00 H new ATOM 0 HE2 LYS A 92 8.445 -3.694 4.334 1.00 0.00 H new ATOM 0 HE3 LYS A 92 7.790 -2.532 5.471 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 7.046 -4.577 6.198 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 5.698 -3.930 5.394 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 6.648 -5.118 4.639 1.00 0.00 H new ATOM 1393 N PHE A 93 6.168 0.213 -1.249 1.00 0.00 N ATOM 1394 CA PHE A 93 5.971 1.282 -2.236 1.00 0.00 C ATOM 1395 C PHE A 93 4.752 2.122 -1.821 1.00 0.00 C ATOM 1396 O PHE A 93 3.627 1.795 -2.161 1.00 0.00 O ATOM 1397 CB PHE A 93 5.765 0.675 -3.659 1.00 0.00 C ATOM 1398 CG PHE A 93 6.887 -0.235 -4.059 1.00 0.00 C ATOM 1399 CD1 PHE A 93 6.872 -1.576 -3.709 1.00 0.00 C ATOM 1400 CD2 PHE A 93 7.957 0.245 -4.766 1.00 0.00 C ATOM 1401 CE1 PHE A 93 7.905 -2.407 -4.067 1.00 0.00 C ATOM 1402 CE2 PHE A 93 8.990 -0.582 -5.125 1.00 0.00 C ATOM 1403 CZ PHE A 93 8.967 -1.910 -4.777 1.00 0.00 C ATOM 0 H PHE A 93 5.477 -0.534 -1.315 1.00 0.00 H new ATOM 0 HA PHE A 93 6.854 1.920 -2.270 1.00 0.00 H new ATOM 0 HB2 PHE A 93 4.826 0.122 -3.683 1.00 0.00 H new ATOM 0 HB3 PHE A 93 5.678 1.482 -4.386 1.00 0.00 H new ATOM 0 HD1 PHE A 93 6.038 -1.972 -3.148 1.00 0.00 H new ATOM 0 HD2 PHE A 93 7.988 1.288 -5.044 1.00 0.00 H new ATOM 0 HE1 PHE A 93 7.881 -3.450 -3.790 1.00 0.00 H new ATOM 0 HE2 PHE A 93 9.825 -0.187 -5.684 1.00 0.00 H new ATOM 0 HZ PHE A 93 9.782 -2.560 -5.061 1.00 0.00 H new ATOM 1413 N PRO A 94 4.943 3.153 -0.989 1.00 0.00 N ATOM 1414 CA PRO A 94 3.860 3.959 -0.488 1.00 0.00 C ATOM 1415 C PRO A 94 3.732 5.360 -1.152 1.00 0.00 C ATOM 1416 O PRO A 94 4.711 5.963 -1.631 1.00 0.00 O ATOM 1417 CB PRO A 94 4.266 4.035 0.966 1.00 0.00 C ATOM 1418 CG PRO A 94 5.751 4.248 0.903 1.00 0.00 C ATOM 1419 CD PRO A 94 6.215 3.592 -0.394 1.00 0.00 C ATOM 0 HA PRO A 94 2.871 3.547 -0.685 1.00 0.00 H new ATOM 0 HB2 PRO A 94 3.764 4.854 1.481 1.00 0.00 H new ATOM 0 HB3 PRO A 94 4.014 3.120 1.502 1.00 0.00 H new ATOM 0 HG2 PRO A 94 5.993 5.311 0.911 1.00 0.00 H new ATOM 0 HG3 PRO A 94 6.246 3.801 1.765 1.00 0.00 H new ATOM 0 HD2 PRO A 94 6.746 4.293 -1.038 1.00 0.00 H new ATOM 0 HD3 PRO A 94 6.889 2.755 -0.209 1.00 0.00 H new ATOM 1427 N PHE A 95 2.519 5.837 -1.185 1.00 0.00 N ATOM 1428 CA PHE A 95 2.145 7.085 -1.809 1.00 0.00 C ATOM 1429 C PHE A 95 2.053 8.156 -0.728 1.00 0.00 C ATOM 1430 O PHE A 95 1.752 7.844 0.432 1.00 0.00 O ATOM 1431 CB PHE A 95 0.771 6.881 -2.497 1.00 0.00 C ATOM 1432 CG PHE A 95 0.241 8.027 -3.335 1.00 0.00 C ATOM 1433 CD1 PHE A 95 0.533 8.108 -4.681 1.00 0.00 C ATOM 1434 CD2 PHE A 95 -0.569 8.999 -2.780 1.00 0.00 C ATOM 1435 CE1 PHE A 95 0.040 9.134 -5.456 1.00 0.00 C ATOM 1436 CE2 PHE A 95 -1.067 10.030 -3.547 1.00 0.00 C ATOM 1437 CZ PHE A 95 -0.763 10.097 -4.888 1.00 0.00 C ATOM 0 H PHE A 95 1.729 5.351 -0.762 1.00 0.00 H new ATOM 0 HA PHE A 95 2.878 7.397 -2.552 1.00 0.00 H new ATOM 0 HB2 PHE A 95 0.840 5.999 -3.134 1.00 0.00 H new ATOM 0 HB3 PHE A 95 0.035 6.659 -1.724 1.00 0.00 H new ATOM 0 HD1 PHE A 95 1.159 7.354 -5.135 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -0.816 8.950 -1.730 1.00 0.00 H new ATOM 0 HE1 PHE A 95 0.283 9.183 -6.507 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -1.695 10.784 -3.097 1.00 0.00 H new ATOM 0 HZ PHE A 95 -1.153 10.902 -5.492 1.00 0.00 H new ATOM 1447 N ASP A 96 2.334 9.393 -1.108 1.00 0.00 N ATOM 1448 CA ASP A 96 2.284 10.542 -0.206 1.00 0.00 C ATOM 1449 C ASP A 96 0.937 10.703 0.380 1.00 0.00 C ATOM 1450 O ASP A 96 -0.080 10.641 -0.310 1.00 0.00 O ATOM 1451 CB ASP A 96 2.640 11.836 -0.915 1.00 0.00 C ATOM 1452 CG ASP A 96 4.071 11.901 -1.338 1.00 0.00 C ATOM 1453 OD1 ASP A 96 4.430 11.246 -2.324 1.00 0.00 O ATOM 1454 OD2 ASP A 96 4.856 12.652 -0.722 1.00 0.00 O ATOM 0 H ASP A 96 2.607 9.634 -2.061 1.00 0.00 H new ATOM 0 HA ASP A 96 3.016 10.342 0.577 1.00 0.00 H new ATOM 0 HB2 ASP A 96 2.003 11.949 -1.792 1.00 0.00 H new ATOM 0 HB3 ASP A 96 2.425 12.676 -0.254 1.00 0.00 H new ATOM 1459 N GLN A 97 0.940 11.021 1.604 1.00 0.00 N ATOM 1460 CA GLN A 97 -0.260 11.159 2.384 1.00 0.00 C ATOM 1461 C GLN A 97 -0.939 12.489 2.074 1.00 0.00 C ATOM 1462 O GLN A 97 -2.072 12.742 2.462 1.00 0.00 O ATOM 1463 CB GLN A 97 0.119 11.129 3.839 1.00 0.00 C ATOM 1464 CG GLN A 97 0.848 9.892 4.276 1.00 0.00 C ATOM 1465 CD GLN A 97 1.230 9.975 5.728 1.00 0.00 C ATOM 1466 OE1 GLN A 97 0.500 9.563 6.622 1.00 0.00 O ATOM 1467 NE2 GLN A 97 2.372 10.510 5.976 1.00 0.00 N ATOM 0 H GLN A 97 1.794 11.204 2.131 1.00 0.00 H new ATOM 0 HA GLN A 97 -0.948 10.348 2.146 1.00 0.00 H new ATOM 0 HB2 GLN A 97 0.743 11.996 4.055 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -0.786 11.230 4.438 1.00 0.00 H new ATOM 0 HG2 GLN A 97 0.218 9.018 4.112 1.00 0.00 H new ATOM 0 HG3 GLN A 97 1.743 9.759 3.668 1.00 0.00 H new ATOM 0 HE21 GLN A 97 2.956 10.843 5.209 1.00 0.00 H new ATOM 0 HE22 GLN A 97 2.694 10.601 6.940 1.00 0.00 H new ATOM 1476 N GLU A 98 -0.262 13.314 1.330 1.00 0.00 N ATOM 1477 CA GLU A 98 -0.746 14.637 1.091 1.00 0.00 C ATOM 1478 C GLU A 98 -0.730 14.970 -0.370 1.00 0.00 C ATOM 1479 O GLU A 98 -0.869 16.120 -0.766 1.00 0.00 O ATOM 1480 CB GLU A 98 0.033 15.630 1.962 1.00 0.00 C ATOM 1481 CG GLU A 98 1.546 15.452 1.939 1.00 0.00 C ATOM 1482 CD GLU A 98 2.216 16.207 3.063 1.00 0.00 C ATOM 1483 OE1 GLU A 98 2.285 15.673 4.204 1.00 0.00 O ATOM 1484 OE2 GLU A 98 2.677 17.349 2.851 1.00 0.00 O ATOM 0 H GLU A 98 0.626 13.092 0.880 1.00 0.00 H new ATOM 0 HA GLU A 98 -1.794 14.706 1.384 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -0.204 16.642 1.635 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -0.314 15.538 2.991 1.00 0.00 H new ATOM 0 HG2 GLU A 98 1.789 14.392 2.017 1.00 0.00 H new ATOM 0 HG3 GLU A 98 1.939 15.799 0.983 1.00 0.00 H new ATOM 1491 N LYS A 99 -0.620 13.940 -1.185 1.00 0.00 N ATOM 1492 CA LYS A 99 -0.604 14.126 -2.600 1.00 0.00 C ATOM 1493 C LYS A 99 -1.940 13.646 -3.193 1.00 0.00 C ATOM 1494 O LYS A 99 -2.104 13.534 -4.411 1.00 0.00 O ATOM 1495 CB LYS A 99 0.575 13.381 -3.173 1.00 0.00 C ATOM 1496 CG LYS A 99 0.995 13.890 -4.512 1.00 0.00 C ATOM 1497 CD LYS A 99 2.188 13.150 -5.090 1.00 0.00 C ATOM 1498 CE LYS A 99 3.443 13.400 -4.276 1.00 0.00 C ATOM 1499 NZ LYS A 99 4.629 12.736 -4.868 1.00 0.00 N ATOM 0 H LYS A 99 -0.541 12.970 -0.880 1.00 0.00 H new ATOM 0 HA LYS A 99 -0.494 15.180 -2.854 1.00 0.00 H new ATOM 0 HB2 LYS A 99 1.415 13.456 -2.483 1.00 0.00 H new ATOM 0 HB3 LYS A 99 0.324 12.324 -3.255 1.00 0.00 H new ATOM 0 HG2 LYS A 99 0.156 13.808 -5.203 1.00 0.00 H new ATOM 0 HG3 LYS A 99 1.238 14.949 -4.430 1.00 0.00 H new ATOM 0 HD2 LYS A 99 1.977 12.081 -5.116 1.00 0.00 H new ATOM 0 HD3 LYS A 99 2.351 13.468 -6.120 1.00 0.00 H new ATOM 0 HE2 LYS A 99 3.624 14.473 -4.208 1.00 0.00 H new ATOM 0 HE3 LYS A 99 3.294 13.037 -3.259 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 4.965 11.990 -4.227 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 4.371 12.315 -5.783 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 5.384 13.437 -5.010 1.00 0.00 H new ATOM 1513 N GLU A 100 -2.862 13.356 -2.280 1.00 0.00 N ATOM 1514 CA GLU A 100 -4.256 12.987 -2.558 1.00 0.00 C ATOM 1515 C GLU A 100 -4.431 11.632 -3.277 1.00 0.00 C ATOM 1516 O GLU A 100 -3.996 11.431 -4.413 1.00 0.00 O ATOM 1517 CB GLU A 100 -4.995 14.124 -3.276 1.00 0.00 C ATOM 1518 CG GLU A 100 -6.455 13.842 -3.547 1.00 0.00 C ATOM 1519 CD GLU A 100 -7.165 15.024 -4.132 1.00 0.00 C ATOM 1520 OE1 GLU A 100 -7.689 15.835 -3.365 1.00 0.00 O ATOM 1521 OE2 GLU A 100 -7.215 15.161 -5.372 1.00 0.00 O ATOM 0 H GLU A 100 -2.654 13.371 -1.281 1.00 0.00 H new ATOM 0 HA GLU A 100 -4.720 12.837 -1.583 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -4.917 15.029 -2.674 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -4.494 14.327 -4.223 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -6.538 12.997 -4.230 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -6.945 13.551 -2.618 1.00 0.00 H new ATOM 1528 N ILE A 101 -5.091 10.725 -2.600 1.00 0.00 N ATOM 1529 CA ILE A 101 -5.375 9.411 -3.124 1.00 0.00 C ATOM 1530 C ILE A 101 -6.622 9.472 -4.006 1.00 0.00 C ATOM 1531 O ILE A 101 -7.736 9.640 -3.521 1.00 0.00 O ATOM 1532 CB ILE A 101 -5.581 8.326 -1.990 1.00 0.00 C ATOM 1533 CG1 ILE A 101 -4.306 8.068 -1.160 1.00 0.00 C ATOM 1534 CG2 ILE A 101 -6.093 7.017 -2.551 1.00 0.00 C ATOM 1535 CD1 ILE A 101 -3.963 9.151 -0.174 1.00 0.00 C ATOM 0 H ILE A 101 -5.451 10.880 -1.658 1.00 0.00 H new ATOM 0 HA ILE A 101 -4.507 9.104 -3.707 1.00 0.00 H new ATOM 0 HB ILE A 101 -6.332 8.747 -1.322 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -4.426 7.129 -0.619 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -3.466 7.938 -1.842 1.00 0.00 H new ATOM 0 HG21 ILE A 101 -6.221 6.299 -1.741 1.00 0.00 H new ATOM 0 HG22 ILE A 101 -7.051 7.182 -3.044 1.00 0.00 H new ATOM 0 HG23 ILE A 101 -5.376 6.625 -3.273 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -3.053 8.881 0.361 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -3.806 10.090 -0.705 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -4.781 9.268 0.537 1.00 0.00 H new ATOM 1547 N THR A 102 -6.420 9.390 -5.283 1.00 0.00 N ATOM 1548 CA THR A 102 -7.487 9.377 -6.237 1.00 0.00 C ATOM 1549 C THR A 102 -7.288 8.214 -7.182 1.00 0.00 C ATOM 1550 O THR A 102 -6.257 7.537 -7.101 1.00 0.00 O ATOM 1551 CB THR A 102 -7.530 10.690 -7.023 1.00 0.00 C ATOM 1552 OG1 THR A 102 -6.197 11.113 -7.350 1.00 0.00 O ATOM 1553 CG2 THR A 102 -8.263 11.772 -6.266 1.00 0.00 C ATOM 0 H THR A 102 -5.492 9.329 -5.701 1.00 0.00 H new ATOM 0 HA THR A 102 -8.435 9.268 -5.710 1.00 0.00 H new ATOM 0 HB THR A 102 -8.082 10.510 -7.946 1.00 0.00 H new ATOM 0 HG1 THR A 102 -6.235 11.953 -7.854 1.00 0.00 H new ATOM 0 HG21 THR A 102 -8.272 12.688 -6.857 1.00 0.00 H new ATOM 0 HG22 THR A 102 -9.288 11.453 -6.076 1.00 0.00 H new ATOM 0 HG23 THR A 102 -7.759 11.957 -5.317 1.00 0.00 H new ATOM 1561 N PHE A 103 -8.249 8.008 -8.081 1.00 0.00 N ATOM 1562 CA PHE A 103 -8.236 6.911 -9.050 1.00 0.00 C ATOM 1563 C PHE A 103 -6.938 6.890 -9.780 1.00 0.00 C ATOM 1564 O PHE A 103 -6.145 5.977 -9.648 1.00 0.00 O ATOM 1565 CB PHE A 103 -9.364 7.138 -10.081 1.00 0.00 C ATOM 1566 CG PHE A 103 -9.464 6.169 -11.231 1.00 0.00 C ATOM 1567 CD1 PHE A 103 -8.648 6.324 -12.372 1.00 0.00 C ATOM 1568 CD2 PHE A 103 -10.413 5.137 -11.216 1.00 0.00 C ATOM 1569 CE1 PHE A 103 -8.776 5.469 -13.436 1.00 0.00 C ATOM 1570 CE2 PHE A 103 -10.533 4.299 -12.307 1.00 0.00 C ATOM 1571 CZ PHE A 103 -9.717 4.463 -13.407 1.00 0.00 C ATOM 0 H PHE A 103 -9.071 8.607 -8.159 1.00 0.00 H new ATOM 0 HA PHE A 103 -8.378 5.969 -8.521 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -10.314 7.125 -9.547 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -9.244 8.139 -10.495 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -7.919 7.120 -12.407 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -11.048 4.998 -10.354 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -8.137 5.584 -14.299 1.00 0.00 H new ATOM 0 HE2 PHE A 103 -11.271 3.510 -12.299 1.00 0.00 H new ATOM 0 HZ PHE A 103 -9.816 3.798 -14.252 1.00 0.00 H new ATOM 1581 N GLU A 104 -6.725 7.939 -10.497 1.00 0.00 N ATOM 1582 CA GLU A 104 -5.675 8.094 -11.368 1.00 0.00 C ATOM 1583 C GLU A 104 -4.355 8.171 -10.657 1.00 0.00 C ATOM 1584 O GLU A 104 -3.394 7.543 -11.088 1.00 0.00 O ATOM 1585 CB GLU A 104 -5.994 9.332 -12.060 1.00 0.00 C ATOM 1586 CG GLU A 104 -5.031 9.799 -12.997 1.00 0.00 C ATOM 1587 CD GLU A 104 -4.843 8.898 -14.178 1.00 0.00 C ATOM 1588 OE1 GLU A 104 -5.720 8.886 -15.060 1.00 0.00 O ATOM 1589 OE2 GLU A 104 -3.819 8.182 -14.250 1.00 0.00 O ATOM 0 H GLU A 104 -7.339 8.753 -10.468 1.00 0.00 H new ATOM 0 HA GLU A 104 -5.563 7.247 -12.045 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -6.941 9.197 -12.582 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -6.150 10.111 -11.313 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -5.331 10.786 -13.350 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -4.074 9.920 -12.489 1.00 0.00 H new ATOM 1596 N ALA A 105 -4.319 8.900 -9.554 1.00 0.00 N ATOM 1597 CA ALA A 105 -3.091 9.065 -8.813 1.00 0.00 C ATOM 1598 C ALA A 105 -2.562 7.713 -8.361 1.00 0.00 C ATOM 1599 O ALA A 105 -1.382 7.410 -8.515 1.00 0.00 O ATOM 1600 CB ALA A 105 -3.279 9.991 -7.625 1.00 0.00 C ATOM 0 H ALA A 105 -5.125 9.383 -9.157 1.00 0.00 H new ATOM 0 HA ALA A 105 -2.358 9.525 -9.476 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -2.335 10.093 -7.090 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -3.605 10.970 -7.975 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -4.033 9.576 -6.956 1.00 0.00 H new ATOM 1606 N ILE A 106 -3.462 6.893 -7.866 1.00 0.00 N ATOM 1607 CA ILE A 106 -3.126 5.574 -7.393 1.00 0.00 C ATOM 1608 C ILE A 106 -2.885 4.639 -8.533 1.00 0.00 C ATOM 1609 O ILE A 106 -1.948 3.878 -8.497 1.00 0.00 O ATOM 1610 CB ILE A 106 -4.214 5.021 -6.463 1.00 0.00 C ATOM 1611 CG1 ILE A 106 -4.333 5.906 -5.253 1.00 0.00 C ATOM 1612 CG2 ILE A 106 -3.965 3.575 -6.047 1.00 0.00 C ATOM 1613 CD1 ILE A 106 -3.019 6.158 -4.531 1.00 0.00 C ATOM 0 H ILE A 106 -4.451 7.126 -7.781 1.00 0.00 H new ATOM 0 HA ILE A 106 -2.203 5.658 -6.819 1.00 0.00 H new ATOM 0 HB ILE A 106 -5.151 5.020 -7.020 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -4.756 6.863 -5.558 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -5.037 5.454 -4.554 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -4.769 3.242 -5.390 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -3.935 2.941 -6.933 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -3.014 3.507 -5.520 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -3.194 6.805 -3.671 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -2.602 5.209 -4.192 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -2.317 6.641 -5.211 1.00 0.00 H new ATOM 1625 N LYS A 107 -3.720 4.721 -9.543 1.00 0.00 N ATOM 1626 CA LYS A 107 -3.589 3.892 -10.744 1.00 0.00 C ATOM 1627 C LYS A 107 -2.225 4.063 -11.338 1.00 0.00 C ATOM 1628 O LYS A 107 -1.540 3.100 -11.616 1.00 0.00 O ATOM 1629 CB LYS A 107 -4.612 4.298 -11.805 1.00 0.00 C ATOM 1630 CG LYS A 107 -4.549 3.464 -13.092 1.00 0.00 C ATOM 1631 CD LYS A 107 -5.591 3.895 -14.122 1.00 0.00 C ATOM 1632 CE LYS A 107 -5.411 5.345 -14.587 1.00 0.00 C ATOM 1633 NZ LYS A 107 -4.145 5.580 -15.323 1.00 0.00 N ATOM 0 H LYS A 107 -4.514 5.361 -9.566 1.00 0.00 H new ATOM 0 HA LYS A 107 -3.756 2.857 -10.447 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -5.612 4.214 -11.380 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -4.460 5.347 -12.058 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -3.554 3.551 -13.529 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -4.699 2.413 -12.847 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -5.535 3.233 -14.986 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -6.587 3.778 -13.694 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -6.250 5.619 -15.227 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -5.444 6.003 -13.719 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -3.734 6.488 -15.026 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -3.475 4.812 -15.115 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -4.337 5.605 -16.345 1.00 0.00 H new ATOM 1647 N ALA A 108 -1.853 5.298 -11.516 1.00 0.00 N ATOM 1648 CA ALA A 108 -0.551 5.629 -12.096 1.00 0.00 C ATOM 1649 C ALA A 108 0.584 5.224 -11.161 1.00 0.00 C ATOM 1650 O ALA A 108 1.651 4.820 -11.605 1.00 0.00 O ATOM 1651 CB ALA A 108 -0.468 7.101 -12.437 1.00 0.00 C ATOM 0 H ALA A 108 -2.424 6.107 -11.272 1.00 0.00 H new ATOM 0 HA ALA A 108 -0.444 5.062 -13.021 1.00 0.00 H new ATOM 0 HB1 ALA A 108 0.510 7.320 -12.866 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -1.246 7.352 -13.158 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -0.608 7.693 -11.532 1.00 0.00 H new ATOM 1657 N PHE A 109 0.331 5.320 -9.870 1.00 0.00 N ATOM 1658 CA PHE A 109 1.283 4.932 -8.861 1.00 0.00 C ATOM 1659 C PHE A 109 1.513 3.416 -8.917 1.00 0.00 C ATOM 1660 O PHE A 109 2.595 2.975 -9.212 1.00 0.00 O ATOM 1661 CB PHE A 109 0.780 5.363 -7.474 1.00 0.00 C ATOM 1662 CG PHE A 109 1.750 5.121 -6.362 1.00 0.00 C ATOM 1663 CD1 PHE A 109 2.743 6.043 -6.089 1.00 0.00 C ATOM 1664 CD2 PHE A 109 1.672 3.976 -5.595 1.00 0.00 C ATOM 1665 CE1 PHE A 109 3.640 5.825 -5.070 1.00 0.00 C ATOM 1666 CE2 PHE A 109 2.566 3.754 -4.577 1.00 0.00 C ATOM 1667 CZ PHE A 109 3.552 4.678 -4.317 1.00 0.00 C ATOM 0 H PHE A 109 -0.549 5.673 -9.495 1.00 0.00 H new ATOM 0 HA PHE A 109 2.235 5.429 -9.049 1.00 0.00 H new ATOM 0 HB2 PHE A 109 0.537 6.425 -7.503 1.00 0.00 H new ATOM 0 HB3 PHE A 109 -0.145 4.830 -7.255 1.00 0.00 H new ATOM 0 HD1 PHE A 109 2.815 6.943 -6.682 1.00 0.00 H new ATOM 0 HD2 PHE A 109 0.900 3.248 -5.798 1.00 0.00 H new ATOM 0 HE1 PHE A 109 4.411 6.552 -4.862 1.00 0.00 H new ATOM 0 HE2 PHE A 109 2.496 2.856 -3.981 1.00 0.00 H new ATOM 0 HZ PHE A 109 4.259 4.502 -3.519 1.00 0.00 H new ATOM 1677 N VAL A 110 0.470 2.632 -8.707 1.00 0.00 N ATOM 1678 CA VAL A 110 0.580 1.170 -8.716 1.00 0.00 C ATOM 1679 C VAL A 110 1.118 0.681 -10.071 1.00 0.00 C ATOM 1680 O VAL A 110 1.817 -0.306 -10.141 1.00 0.00 O ATOM 1681 CB VAL A 110 -0.775 0.478 -8.418 1.00 0.00 C ATOM 1682 CG1 VAL A 110 -1.284 0.797 -7.033 1.00 0.00 C ATOM 1683 CG2 VAL A 110 -1.772 0.880 -9.425 1.00 0.00 C ATOM 0 H VAL A 110 -0.472 2.979 -8.526 1.00 0.00 H new ATOM 0 HA VAL A 110 1.276 0.899 -7.922 1.00 0.00 H new ATOM 0 HB VAL A 110 -0.613 -0.599 -8.466 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -2.235 0.291 -6.869 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -0.560 0.458 -6.292 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -1.425 1.874 -6.936 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -2.722 0.391 -9.211 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -1.905 1.961 -9.394 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -1.427 0.585 -10.416 1.00 0.00 H new ATOM 1693 N ASP A 111 0.784 1.429 -11.117 1.00 0.00 N ATOM 1694 CA ASP A 111 1.230 1.189 -12.495 1.00 0.00 C ATOM 1695 C ASP A 111 2.719 1.285 -12.566 1.00 0.00 C ATOM 1696 O ASP A 111 3.388 0.405 -13.075 1.00 0.00 O ATOM 1697 CB ASP A 111 0.668 2.276 -13.386 1.00 0.00 C ATOM 1698 CG ASP A 111 0.852 2.011 -14.844 1.00 0.00 C ATOM 1699 OD1 ASP A 111 0.130 1.159 -15.398 1.00 0.00 O ATOM 1700 OD2 ASP A 111 1.720 2.635 -15.465 1.00 0.00 O ATOM 0 H ASP A 111 0.177 2.245 -11.033 1.00 0.00 H new ATOM 0 HA ASP A 111 0.894 0.201 -12.811 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -0.396 2.390 -13.178 1.00 0.00 H new ATOM 0 HB3 ASP A 111 1.146 3.223 -13.135 1.00 0.00 H new ATOM 1705 N ASP A 112 3.208 2.379 -12.032 1.00 0.00 N ATOM 1706 CA ASP A 112 4.639 2.715 -11.974 1.00 0.00 C ATOM 1707 C ASP A 112 5.317 1.644 -11.157 1.00 0.00 C ATOM 1708 O ASP A 112 6.301 1.082 -11.553 1.00 0.00 O ATOM 1709 CB ASP A 112 4.774 4.111 -11.305 1.00 0.00 C ATOM 1710 CG ASP A 112 5.990 4.957 -11.561 1.00 0.00 C ATOM 1711 OD1 ASP A 112 6.051 5.568 -12.638 1.00 0.00 O ATOM 1712 OD2 ASP A 112 6.816 5.151 -10.669 1.00 0.00 O ATOM 0 H ASP A 112 2.615 3.092 -11.608 1.00 0.00 H new ATOM 0 HA ASP A 112 5.100 2.758 -12.961 1.00 0.00 H new ATOM 0 HB2 ASP A 112 3.904 4.697 -11.601 1.00 0.00 H new ATOM 0 HB3 ASP A 112 4.705 3.961 -10.228 1.00 0.00 H new ATOM 1717 N PHE A 113 4.724 1.326 -10.049 1.00 0.00 N ATOM 1718 CA PHE A 113 5.205 0.283 -9.153 1.00 0.00 C ATOM 1719 C PHE A 113 5.366 -1.058 -9.869 1.00 0.00 C ATOM 1720 O PHE A 113 6.472 -1.547 -10.030 1.00 0.00 O ATOM 1721 CB PHE A 113 4.239 0.164 -7.955 1.00 0.00 C ATOM 1722 CG PHE A 113 4.119 -1.191 -7.331 1.00 0.00 C ATOM 1723 CD1 PHE A 113 5.189 -1.781 -6.705 1.00 0.00 C ATOM 1724 CD2 PHE A 113 2.934 -1.895 -7.430 1.00 0.00 C ATOM 1725 CE1 PHE A 113 5.080 -3.039 -6.182 1.00 0.00 C ATOM 1726 CE2 PHE A 113 2.826 -3.152 -6.918 1.00 0.00 C ATOM 1727 CZ PHE A 113 3.898 -3.724 -6.294 1.00 0.00 C ATOM 0 H PHE A 113 3.874 1.785 -9.722 1.00 0.00 H new ATOM 0 HA PHE A 113 6.196 0.561 -8.795 1.00 0.00 H new ATOM 0 HB2 PHE A 113 4.559 0.867 -7.186 1.00 0.00 H new ATOM 0 HB3 PHE A 113 3.248 0.479 -8.282 1.00 0.00 H new ATOM 0 HD1 PHE A 113 6.124 -1.247 -6.625 1.00 0.00 H new ATOM 0 HD2 PHE A 113 2.084 -1.443 -7.919 1.00 0.00 H new ATOM 0 HE1 PHE A 113 5.923 -3.492 -5.682 1.00 0.00 H new ATOM 0 HE2 PHE A 113 1.896 -3.695 -7.005 1.00 0.00 H new ATOM 0 HZ PHE A 113 3.814 -4.721 -5.887 1.00 0.00 H new ATOM 1737 N VAL A 114 4.254 -1.600 -10.310 1.00 0.00 N ATOM 1738 CA VAL A 114 4.190 -2.913 -10.944 1.00 0.00 C ATOM 1739 C VAL A 114 4.959 -2.944 -12.287 1.00 0.00 C ATOM 1740 O VAL A 114 5.260 -4.009 -12.817 1.00 0.00 O ATOM 1741 CB VAL A 114 2.699 -3.372 -11.113 1.00 0.00 C ATOM 1742 CG1 VAL A 114 1.960 -2.596 -12.189 1.00 0.00 C ATOM 1743 CG2 VAL A 114 2.565 -4.874 -11.301 1.00 0.00 C ATOM 0 H VAL A 114 3.347 -1.138 -10.241 1.00 0.00 H new ATOM 0 HA VAL A 114 4.688 -3.626 -10.287 1.00 0.00 H new ATOM 0 HB VAL A 114 2.210 -3.131 -10.169 1.00 0.00 H new ATOM 0 HG11 VAL A 114 0.934 -2.958 -12.259 1.00 0.00 H new ATOM 0 HG12 VAL A 114 1.954 -1.536 -11.934 1.00 0.00 H new ATOM 0 HG13 VAL A 114 2.461 -2.736 -13.147 1.00 0.00 H new ATOM 0 HG21 VAL A 114 1.512 -5.134 -11.413 1.00 0.00 H new ATOM 0 HG22 VAL A 114 3.111 -5.179 -12.194 1.00 0.00 H new ATOM 0 HG23 VAL A 114 2.975 -5.388 -10.432 1.00 0.00 H new ATOM 1753 N ALA A 115 5.279 -1.770 -12.821 1.00 0.00 N ATOM 1754 CA ALA A 115 6.081 -1.691 -14.035 1.00 0.00 C ATOM 1755 C ALA A 115 7.558 -1.719 -13.689 1.00 0.00 C ATOM 1756 O ALA A 115 8.390 -2.085 -14.509 1.00 0.00 O ATOM 1757 CB ALA A 115 5.764 -0.440 -14.829 1.00 0.00 C ATOM 0 H ALA A 115 4.998 -0.868 -12.436 1.00 0.00 H new ATOM 0 HA ALA A 115 5.835 -2.556 -14.652 1.00 0.00 H new ATOM 0 HB1 ALA A 115 6.380 -0.414 -15.728 1.00 0.00 H new ATOM 0 HB2 ALA A 115 4.711 -0.445 -15.111 1.00 0.00 H new ATOM 0 HB3 ALA A 115 5.972 0.440 -14.220 1.00 0.00 H new ATOM 1763 N GLY A 116 7.877 -1.294 -12.489 1.00 0.00 N ATOM 1764 CA GLY A 116 9.247 -1.306 -12.041 1.00 0.00 C ATOM 1765 C GLY A 116 9.792 0.075 -12.091 1.00 0.00 C ATOM 1766 O GLY A 116 11.001 0.294 -12.231 1.00 0.00 O ATOM 0 H GLY A 116 7.207 -0.937 -11.808 1.00 0.00 H new ATOM 0 HA2 GLY A 116 9.306 -1.696 -11.025 1.00 0.00 H new ATOM 0 HA3 GLY A 116 9.842 -1.967 -12.671 1.00 0.00 H new ATOM 1770 N LYS A 117 8.898 0.998 -11.971 1.00 0.00 N ATOM 1771 CA LYS A 117 9.175 2.378 -12.066 1.00 0.00 C ATOM 1772 C LYS A 117 9.316 2.956 -10.664 1.00 0.00 C ATOM 1773 O LYS A 117 10.279 3.683 -10.378 1.00 0.00 O ATOM 1774 CB LYS A 117 8.059 3.047 -12.902 1.00 0.00 C ATOM 1775 CG LYS A 117 8.504 3.845 -14.143 1.00 0.00 C ATOM 1776 CD LYS A 117 9.064 5.248 -13.838 1.00 0.00 C ATOM 1777 CE LYS A 117 10.410 5.242 -13.124 1.00 0.00 C ATOM 1778 NZ LYS A 117 10.857 6.607 -12.786 1.00 0.00 N ATOM 0 H LYS A 117 7.914 0.794 -11.797 1.00 0.00 H new ATOM 0 HA LYS A 117 10.119 2.568 -12.577 1.00 0.00 H new ATOM 0 HB2 LYS A 117 7.367 2.271 -13.228 1.00 0.00 H new ATOM 0 HB3 LYS A 117 7.501 3.718 -12.249 1.00 0.00 H new ATOM 0 HG2 LYS A 117 9.265 3.272 -14.673 1.00 0.00 H new ATOM 0 HG3 LYS A 117 7.654 3.946 -14.817 1.00 0.00 H new ATOM 0 HD2 LYS A 117 9.164 5.798 -14.774 1.00 0.00 H new ATOM 0 HD3 LYS A 117 8.343 5.789 -13.226 1.00 0.00 H new ATOM 0 HE2 LYS A 117 10.336 4.648 -12.213 1.00 0.00 H new ATOM 0 HE3 LYS A 117 11.156 4.762 -13.758 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 11.776 6.561 -12.302 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 10.952 7.167 -13.657 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 10.158 7.056 -12.161 1.00 0.00 H new ATOM 1792 N ILE A 118 8.380 2.627 -9.784 1.00 0.00 N ATOM 1793 CA ILE A 118 8.516 3.033 -8.393 1.00 0.00 C ATOM 1794 C ILE A 118 9.567 2.166 -7.733 1.00 0.00 C ATOM 1795 O ILE A 118 9.711 0.975 -8.054 1.00 0.00 O ATOM 1796 CB ILE A 118 7.195 2.911 -7.591 1.00 0.00 C ATOM 1797 CG1 ILE A 118 6.112 3.622 -8.294 1.00 0.00 C ATOM 1798 CG2 ILE A 118 7.312 3.517 -6.226 1.00 0.00 C ATOM 1799 CD1 ILE A 118 4.835 3.693 -7.546 1.00 0.00 C ATOM 0 H ILE A 118 7.538 2.093 -10.001 1.00 0.00 H new ATOM 0 HA ILE A 118 8.800 4.085 -8.390 1.00 0.00 H new ATOM 0 HB ILE A 118 6.979 1.846 -7.499 1.00 0.00 H new ATOM 0 HG12 ILE A 118 6.445 4.636 -8.516 1.00 0.00 H new ATOM 0 HG13 ILE A 118 5.932 3.129 -9.249 1.00 0.00 H new ATOM 0 HG21 ILE A 118 6.364 3.410 -5.698 1.00 0.00 H new ATOM 0 HG22 ILE A 118 8.098 3.008 -5.668 1.00 0.00 H new ATOM 0 HG23 ILE A 118 7.559 4.575 -6.317 1.00 0.00 H new ATOM 0 HD11 ILE A 118 4.096 4.233 -8.138 1.00 0.00 H new ATOM 0 HD12 ILE A 118 4.474 2.684 -7.347 1.00 0.00 H new ATOM 0 HD13 ILE A 118 4.995 4.214 -6.602 1.00 0.00 H new ATOM 1811 N GLU A 119 10.281 2.747 -6.839 1.00 0.00 N ATOM 1812 CA GLU A 119 11.313 2.075 -6.140 1.00 0.00 C ATOM 1813 C GLU A 119 11.137 2.308 -4.646 1.00 0.00 C ATOM 1814 O GLU A 119 10.558 3.329 -4.238 1.00 0.00 O ATOM 1815 CB GLU A 119 12.663 2.533 -6.656 1.00 0.00 C ATOM 1816 CG GLU A 119 12.910 4.016 -6.546 1.00 0.00 C ATOM 1817 CD GLU A 119 14.241 4.381 -7.098 1.00 0.00 C ATOM 1818 OE1 GLU A 119 14.442 4.233 -8.314 1.00 0.00 O ATOM 1819 OE2 GLU A 119 15.126 4.807 -6.326 1.00 0.00 O ATOM 0 H GLU A 119 10.161 3.723 -6.568 1.00 0.00 H new ATOM 0 HA GLU A 119 11.260 1.000 -6.311 1.00 0.00 H new ATOM 0 HB2 GLU A 119 13.444 2.007 -6.107 1.00 0.00 H new ATOM 0 HB3 GLU A 119 12.755 2.240 -7.702 1.00 0.00 H new ATOM 0 HG2 GLU A 119 12.130 4.558 -7.081 1.00 0.00 H new ATOM 0 HG3 GLU A 119 12.850 4.321 -5.501 1.00 0.00 H new ATOM 1826 N PRO A 120 11.577 1.376 -3.804 1.00 0.00 N ATOM 1827 CA PRO A 120 11.365 1.482 -2.380 1.00 0.00 C ATOM 1828 C PRO A 120 12.287 2.496 -1.721 1.00 0.00 C ATOM 1829 O PRO A 120 13.493 2.251 -1.547 1.00 0.00 O ATOM 1830 CB PRO A 120 11.666 0.090 -1.873 1.00 0.00 C ATOM 1831 CG PRO A 120 12.677 -0.446 -2.836 1.00 0.00 C ATOM 1832 CD PRO A 120 12.337 0.151 -4.166 1.00 0.00 C ATOM 0 HA PRO A 120 10.358 1.828 -2.150 1.00 0.00 H new ATOM 0 HB2 PRO A 120 12.059 0.114 -0.857 1.00 0.00 H new ATOM 0 HB3 PRO A 120 10.769 -0.529 -1.854 1.00 0.00 H new ATOM 0 HG2 PRO A 120 13.688 -0.173 -2.533 1.00 0.00 H new ATOM 0 HG3 PRO A 120 12.639 -1.535 -2.876 1.00 0.00 H new ATOM 0 HD2 PRO A 120 13.232 0.388 -4.742 1.00 0.00 H new ATOM 0 HD3 PRO A 120 11.739 -0.530 -4.772 1.00 0.00 H new ATOM 1840 N SER A 121 11.741 3.609 -1.345 1.00 0.00 N ATOM 1841 CA SER A 121 12.525 4.637 -0.725 1.00 0.00 C ATOM 1842 C SER A 121 12.627 4.352 0.779 1.00 0.00 C ATOM 1843 O SER A 121 11.865 4.876 1.585 1.00 0.00 O ATOM 1844 CB SER A 121 11.954 6.038 -1.037 1.00 0.00 C ATOM 1845 OG SER A 121 12.829 7.072 -0.617 1.00 0.00 O ATOM 0 H SER A 121 10.752 3.832 -1.456 1.00 0.00 H new ATOM 0 HA SER A 121 13.535 4.632 -1.136 1.00 0.00 H new ATOM 0 HB2 SER A 121 11.775 6.127 -2.109 1.00 0.00 H new ATOM 0 HB3 SER A 121 10.990 6.155 -0.542 1.00 0.00 H new ATOM 0 HG SER A 121 12.434 7.943 -0.833 1.00 0.00 H new ATOM 1851 N ILE A 122 13.475 3.366 1.071 1.00 0.00 N ATOM 1852 CA ILE A 122 13.849 2.846 2.395 1.00 0.00 C ATOM 1853 C ILE A 122 14.834 1.728 2.175 1.00 0.00 C ATOM 1854 O ILE A 122 15.879 1.641 2.817 1.00 0.00 O ATOM 1855 CB ILE A 122 12.672 2.234 3.212 1.00 0.00 C ATOM 1856 CG1 ILE A 122 11.677 1.479 2.308 1.00 0.00 C ATOM 1857 CG2 ILE A 122 12.004 3.230 4.143 1.00 0.00 C ATOM 1858 CD1 ILE A 122 10.638 0.724 3.048 1.00 0.00 C ATOM 0 H ILE A 122 13.961 2.865 0.327 1.00 0.00 H new ATOM 0 HA ILE A 122 14.235 3.694 2.961 1.00 0.00 H new ATOM 0 HB ILE A 122 13.112 1.489 3.875 1.00 0.00 H new ATOM 0 HG12 ILE A 122 11.189 2.195 1.647 1.00 0.00 H new ATOM 0 HG13 ILE A 122 12.232 0.787 1.675 1.00 0.00 H new ATOM 0 HG21 ILE A 122 11.194 2.738 4.681 1.00 0.00 H new ATOM 0 HG22 ILE A 122 12.736 3.609 4.856 1.00 0.00 H new ATOM 0 HG23 ILE A 122 11.602 4.059 3.561 1.00 0.00 H new ATOM 0 HD11 ILE A 122 9.979 0.222 2.340 1.00 0.00 H new ATOM 0 HD12 ILE A 122 11.114 -0.018 3.689 1.00 0.00 H new ATOM 0 HD13 ILE A 122 10.055 1.412 3.661 1.00 0.00 H new ATOM 1870 N LYS A 123 14.491 0.885 1.225 1.00 0.00 N ATOM 1871 CA LYS A 123 15.249 -0.279 0.917 1.00 0.00 C ATOM 1872 C LYS A 123 16.260 0.068 -0.128 1.00 0.00 C ATOM 1873 O LYS A 123 15.934 0.183 -1.305 1.00 0.00 O ATOM 1874 CB LYS A 123 14.330 -1.396 0.405 1.00 0.00 C ATOM 1875 CG LYS A 123 15.022 -2.739 0.180 1.00 0.00 C ATOM 1876 CD LYS A 123 15.474 -3.379 1.486 1.00 0.00 C ATOM 1877 CE LYS A 123 14.283 -3.729 2.375 1.00 0.00 C ATOM 1878 NZ LYS A 123 14.691 -4.355 3.639 1.00 0.00 N ATOM 0 H LYS A 123 13.662 1.003 0.643 1.00 0.00 H new ATOM 0 HA LYS A 123 15.751 -0.634 1.817 1.00 0.00 H new ATOM 0 HB2 LYS A 123 13.518 -1.536 1.119 1.00 0.00 H new ATOM 0 HB3 LYS A 123 13.877 -1.074 -0.533 1.00 0.00 H new ATOM 0 HG2 LYS A 123 14.341 -3.415 -0.337 1.00 0.00 H new ATOM 0 HG3 LYS A 123 15.885 -2.597 -0.471 1.00 0.00 H new ATOM 0 HD2 LYS A 123 16.048 -4.281 1.272 1.00 0.00 H new ATOM 0 HD3 LYS A 123 16.138 -2.697 2.017 1.00 0.00 H new ATOM 0 HE2 LYS A 123 13.714 -2.824 2.588 1.00 0.00 H new ATOM 0 HE3 LYS A 123 13.618 -4.404 1.837 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 13.847 -4.573 4.206 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 15.211 -5.233 3.439 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 15.304 -3.702 4.168 1.00 0.00 H new ATOM 1892 N SER A 124 17.430 0.317 0.306 1.00 0.00 N ATOM 1893 CA SER A 124 18.514 0.602 -0.558 1.00 0.00 C ATOM 1894 C SER A 124 19.691 -0.190 -0.058 1.00 0.00 C ATOM 1895 O SER A 124 20.243 0.113 1.005 1.00 0.00 O ATOM 1896 CB SER A 124 18.814 2.107 -0.540 1.00 0.00 C ATOM 1897 OG SER A 124 17.640 2.866 -0.862 1.00 0.00 O ATOM 0 H SER A 124 17.673 0.330 1.297 1.00 0.00 H new ATOM 0 HA SER A 124 18.285 0.329 -1.588 1.00 0.00 H new ATOM 0 HB2 SER A 124 19.181 2.397 0.444 1.00 0.00 H new ATOM 0 HB3 SER A 124 19.606 2.333 -1.255 1.00 0.00 H new ATOM 0 HG SER A 124 17.853 3.822 -0.843 1.00 0.00 H new ATOM 1903 N GLU A 125 20.026 -1.237 -0.758 1.00 0.00 N ATOM 1904 CA GLU A 125 21.110 -2.070 -0.373 1.00 0.00 C ATOM 1905 C GLU A 125 22.175 -1.870 -1.408 1.00 0.00 C ATOM 1906 O GLU A 125 22.122 -2.456 -2.503 1.00 0.00 O ATOM 1907 CB GLU A 125 20.684 -3.537 -0.306 1.00 0.00 C ATOM 1908 CG GLU A 125 21.734 -4.455 0.293 1.00 0.00 C ATOM 1909 CD GLU A 125 21.329 -5.898 0.253 1.00 0.00 C ATOM 1910 OE1 GLU A 125 20.437 -6.307 1.028 1.00 0.00 O ATOM 1911 OE2 GLU A 125 21.909 -6.671 -0.551 1.00 0.00 O ATOM 0 H GLU A 125 19.550 -1.530 -1.611 1.00 0.00 H new ATOM 0 HA GLU A 125 21.469 -1.810 0.623 1.00 0.00 H new ATOM 0 HB2 GLU A 125 19.770 -3.613 0.283 1.00 0.00 H new ATOM 0 HB3 GLU A 125 20.445 -3.882 -1.312 1.00 0.00 H new ATOM 0 HG2 GLU A 125 22.672 -4.330 -0.248 1.00 0.00 H new ATOM 0 HG3 GLU A 125 21.920 -4.162 1.326 1.00 0.00 H new ATOM 1918 N PRO A 126 23.098 -0.967 -1.150 1.00 0.00 N ATOM 1919 CA PRO A 126 24.085 -0.627 -2.102 1.00 0.00 C ATOM 1920 C PRO A 126 25.373 -1.397 -1.906 1.00 0.00 C ATOM 1921 O PRO A 126 25.533 -2.153 -0.923 1.00 0.00 O ATOM 1922 CB PRO A 126 24.280 0.858 -1.829 1.00 0.00 C ATOM 1923 CG PRO A 126 24.122 0.984 -0.341 1.00 0.00 C ATOM 1924 CD PRO A 126 23.259 -0.182 0.098 1.00 0.00 C ATOM 0 HA PRO A 126 23.793 -0.862 -3.125 1.00 0.00 H new ATOM 0 HB2 PRO A 126 25.263 1.197 -2.155 1.00 0.00 H new ATOM 0 HB3 PRO A 126 23.543 1.460 -2.360 1.00 0.00 H new ATOM 0 HG2 PRO A 126 25.092 0.958 0.156 1.00 0.00 H new ATOM 0 HG3 PRO A 126 23.655 1.933 -0.079 1.00 0.00 H new ATOM 0 HD2 PRO A 126 23.739 -0.766 0.883 1.00 0.00 H new ATOM 0 HD3 PRO A 126 22.299 0.152 0.491 1.00 0.00 H new ATOM 1932 N ILE A 127 26.272 -1.231 -2.831 1.00 0.00 N ATOM 1933 CA ILE A 127 27.573 -1.812 -2.722 1.00 0.00 C ATOM 1934 C ILE A 127 28.641 -0.721 -2.605 1.00 0.00 C ATOM 1935 O ILE A 127 29.033 -0.097 -3.603 1.00 0.00 O ATOM 1936 CB ILE A 127 27.903 -2.822 -3.866 1.00 0.00 C ATOM 1937 CG1 ILE A 127 27.689 -2.203 -5.260 1.00 0.00 C ATOM 1938 CG2 ILE A 127 27.067 -4.082 -3.704 1.00 0.00 C ATOM 1939 CD1 ILE A 127 28.067 -3.113 -6.405 1.00 0.00 C ATOM 0 H ILE A 127 26.122 -0.688 -3.682 1.00 0.00 H new ATOM 0 HA ILE A 127 27.575 -2.403 -1.806 1.00 0.00 H new ATOM 0 HB ILE A 127 28.959 -3.080 -3.789 1.00 0.00 H new ATOM 0 HG12 ILE A 127 26.641 -1.923 -5.364 1.00 0.00 H new ATOM 0 HG13 ILE A 127 28.273 -1.285 -5.332 1.00 0.00 H new ATOM 0 HG21 ILE A 127 27.303 -4.781 -4.506 1.00 0.00 H new ATOM 0 HG22 ILE A 127 27.289 -4.545 -2.742 1.00 0.00 H new ATOM 0 HG23 ILE A 127 26.009 -3.825 -3.747 1.00 0.00 H new ATOM 0 HD11 ILE A 127 27.886 -2.602 -7.351 1.00 0.00 H new ATOM 0 HD12 ILE A 127 29.123 -3.374 -6.329 1.00 0.00 H new ATOM 0 HD13 ILE A 127 27.465 -4.021 -6.362 1.00 0.00 H new ATOM 1951 N PRO A 128 29.021 -0.379 -1.359 1.00 0.00 N ATOM 1952 CA PRO A 128 30.102 0.553 -1.103 1.00 0.00 C ATOM 1953 C PRO A 128 31.372 0.039 -1.723 1.00 0.00 C ATOM 1954 O PRO A 128 31.717 -1.151 -1.585 1.00 0.00 O ATOM 1955 CB PRO A 128 30.229 0.575 0.415 1.00 0.00 C ATOM 1956 CG PRO A 128 28.904 0.131 0.910 1.00 0.00 C ATOM 1957 CD PRO A 128 28.382 -0.831 -0.118 1.00 0.00 C ATOM 0 HA PRO A 128 29.916 1.543 -1.519 1.00 0.00 H new ATOM 0 HB2 PRO A 128 31.022 -0.090 0.756 1.00 0.00 H new ATOM 0 HB3 PRO A 128 30.473 1.574 0.778 1.00 0.00 H new ATOM 0 HG2 PRO A 128 28.992 -0.349 1.885 1.00 0.00 H new ATOM 0 HG3 PRO A 128 28.228 0.978 1.031 1.00 0.00 H new ATOM 0 HD2 PRO A 128 28.651 -1.860 0.121 1.00 0.00 H new ATOM 0 HD3 PRO A 128 27.295 -0.794 -0.189 1.00 0.00 H new ATOM 1965 N GLU A 129 32.043 0.892 -2.407 1.00 0.00 N ATOM 1966 CA GLU A 129 33.217 0.504 -3.118 1.00 0.00 C ATOM 1967 C GLU A 129 34.445 0.534 -2.247 1.00 0.00 C ATOM 1968 O GLU A 129 35.050 1.592 -2.027 1.00 0.00 O ATOM 1969 CB GLU A 129 33.406 1.301 -4.401 1.00 0.00 C ATOM 1970 CG GLU A 129 32.304 1.067 -5.416 1.00 0.00 C ATOM 1971 CD GLU A 129 32.670 1.557 -6.784 1.00 0.00 C ATOM 1972 OE1 GLU A 129 33.424 0.840 -7.496 1.00 0.00 O ATOM 1973 OE2 GLU A 129 32.230 2.655 -7.185 1.00 0.00 O ATOM 0 H GLU A 129 31.799 1.879 -2.493 1.00 0.00 H new ATOM 0 HA GLU A 129 33.069 -0.534 -3.416 1.00 0.00 H new ATOM 0 HB2 GLU A 129 33.449 2.363 -4.159 1.00 0.00 H new ATOM 0 HB3 GLU A 129 34.365 1.037 -4.847 1.00 0.00 H new ATOM 0 HG2 GLU A 129 32.079 0.002 -5.464 1.00 0.00 H new ATOM 0 HG3 GLU A 129 31.396 1.570 -5.084 1.00 0.00 H new ATOM 1980 N LYS A 130 34.763 -0.642 -1.721 1.00 0.00 N ATOM 1981 CA LYS A 130 35.922 -0.902 -0.883 1.00 0.00 C ATOM 1982 C LYS A 130 35.806 -0.230 0.468 1.00 0.00 C ATOM 1983 O LYS A 130 35.872 0.996 0.594 1.00 0.00 O ATOM 1984 CB LYS A 130 37.246 -0.578 -1.599 1.00 0.00 C ATOM 1985 CG LYS A 130 37.448 -1.361 -2.900 1.00 0.00 C ATOM 1986 CD LYS A 130 37.311 -2.857 -2.663 1.00 0.00 C ATOM 1987 CE LYS A 130 37.487 -3.668 -3.926 1.00 0.00 C ATOM 1988 NZ LYS A 130 37.228 -5.109 -3.687 1.00 0.00 N ATOM 0 H LYS A 130 34.195 -1.475 -1.875 1.00 0.00 H new ATOM 0 HA LYS A 130 35.940 -1.975 -0.691 1.00 0.00 H new ATOM 0 HB2 LYS A 130 37.279 0.489 -1.818 1.00 0.00 H new ATOM 0 HB3 LYS A 130 38.075 -0.790 -0.924 1.00 0.00 H new ATOM 0 HG2 LYS A 130 36.716 -1.038 -3.640 1.00 0.00 H new ATOM 0 HG3 LYS A 130 38.434 -1.143 -3.310 1.00 0.00 H new ATOM 0 HD2 LYS A 130 38.051 -3.173 -1.928 1.00 0.00 H new ATOM 0 HD3 LYS A 130 36.329 -3.064 -2.237 1.00 0.00 H new ATOM 0 HE2 LYS A 130 36.809 -3.298 -4.695 1.00 0.00 H new ATOM 0 HE3 LYS A 130 38.500 -3.537 -4.305 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 37.357 -5.637 -4.574 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 37.892 -5.467 -2.971 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 36.253 -5.235 -3.348 1.00 0.00 H new ATOM 2002 N GLN A 131 35.600 -1.037 1.457 1.00 0.00 N ATOM 2003 CA GLN A 131 35.410 -0.592 2.806 1.00 0.00 C ATOM 2004 C GLN A 131 36.129 -1.577 3.703 1.00 0.00 C ATOM 2005 O GLN A 131 36.532 -2.645 3.242 1.00 0.00 O ATOM 2006 CB GLN A 131 33.916 -0.631 3.123 1.00 0.00 C ATOM 2007 CG GLN A 131 33.506 -0.006 4.439 1.00 0.00 C ATOM 2008 CD GLN A 131 32.117 -0.414 4.833 1.00 0.00 C ATOM 2009 OE1 GLN A 131 31.133 0.227 4.465 1.00 0.00 O ATOM 2010 NE2 GLN A 131 32.024 -1.485 5.576 1.00 0.00 N ATOM 0 H GLN A 131 35.557 -2.051 1.350 1.00 0.00 H new ATOM 0 HA GLN A 131 35.790 0.419 2.951 1.00 0.00 H new ATOM 0 HB2 GLN A 131 33.380 -0.126 2.320 1.00 0.00 H new ATOM 0 HB3 GLN A 131 33.590 -1.671 3.119 1.00 0.00 H new ATOM 0 HG2 GLN A 131 34.208 -0.303 5.218 1.00 0.00 H new ATOM 0 HG3 GLN A 131 33.558 1.080 4.359 1.00 0.00 H new ATOM 0 HE21 GLN A 131 32.867 -1.985 5.858 1.00 0.00 H new ATOM 0 HE22 GLN A 131 31.108 -1.821 5.874 1.00 0.00 H new ATOM 2019 N GLU A 132 36.276 -1.242 4.941 1.00 0.00 N ATOM 2020 CA GLU A 132 36.871 -2.124 5.917 1.00 0.00 C ATOM 2021 C GLU A 132 35.822 -3.162 6.321 1.00 0.00 C ATOM 2022 O GLU A 132 34.608 -2.914 6.175 1.00 0.00 O ATOM 2023 CB GLU A 132 37.361 -1.329 7.151 1.00 0.00 C ATOM 2024 CG GLU A 132 38.490 -0.307 6.879 1.00 0.00 C ATOM 2025 CD GLU A 132 38.109 0.772 5.884 1.00 0.00 C ATOM 2026 OE1 GLU A 132 37.240 1.604 6.197 1.00 0.00 O ATOM 2027 OE2 GLU A 132 38.616 0.755 4.750 1.00 0.00 O ATOM 0 H GLU A 132 35.986 -0.340 5.319 1.00 0.00 H new ATOM 0 HA GLU A 132 37.741 -2.621 5.488 1.00 0.00 H new ATOM 0 HB2 GLU A 132 36.511 -0.799 7.581 1.00 0.00 H new ATOM 0 HB3 GLU A 132 37.709 -2.037 7.903 1.00 0.00 H new ATOM 0 HG2 GLU A 132 38.777 0.163 7.820 1.00 0.00 H new ATOM 0 HG3 GLU A 132 39.367 -0.838 6.508 1.00 0.00 H new ATOM 2034 N GLY A 133 36.260 -4.310 6.772 1.00 0.00 N ATOM 2035 CA GLY A 133 35.332 -5.342 7.126 1.00 0.00 C ATOM 2036 C GLY A 133 35.255 -5.497 8.608 1.00 0.00 C ATOM 2037 O GLY A 133 36.271 -5.275 9.286 1.00 0.00 O ATOM 2038 OXT GLY A 133 34.168 -5.798 9.139 1.00 0.00 O ATOM 0 H GLY A 133 37.244 -4.548 6.900 1.00 0.00 H new ATOM 0 HA2 GLY A 133 34.346 -5.103 6.729 1.00 0.00 H new ATOM 0 HA3 GLY A 133 35.638 -6.285 6.672 1.00 0.00 H new TER 2042 GLY A 133