USER MOD reduce.3.24.130724 H: found=0, std=0, add=871, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 872 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 116 GLN : amide:sc= 0.634 X(o=1.1,f=0.74) USER MOD Set 1.2: A 120 THR OG1 : rot 120:sc= 0.5 USER MOD Set 2.1: A 56 THR OG1 : rot 141:sc= 1.12 USER MOD Set 2.2: A 92 SER OG : rot 180:sc= 1.06 USER MOD Set 3.1: A 10 SER OG : rot 160:sc= 1.04 USER MOD Set 3.2: A 65 ASN : amide:sc= 0.804 K(o=1.8,f=-1.9) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 43:sc= 0.37 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 HIS : no HE2:sc= 0.105 K(o=0.1,f=-1.3) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 33 THR OG1 : rot -159:sc= -0.109 USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 HIS : no HE2:sc= 0.134 K(o=0.13,f=-1.1) USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 130:sc= -0.163 USER MOD Single : A 55 SER OG : rot -1:sc= 0.419 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 70 TYR OH : rot 130:sc= 0 USER MOD Single : A 74 GLN : amide:sc= 0.549 K(o=0.55,f=-0.0052) USER MOD Single : A 76 GLN : amide:sc= 1.13 K(o=1.1,f=-0.53) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 SER OG : rot 122:sc= 1.23 USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 LYS NZ :NH3+ -120:sc= 1.25 (180deg=-0.246) USER MOD Single : A 111 ASN : amide:sc= 0.796 K(o=0.8,f=0) USER MOD Single : A 112 SER OG : rot 83:sc= 1.26 USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 THR OG1 : rot -30:sc= 0.922 USER MOD Single : A 122 LYS NZ :NH3+ 174:sc= 1.75 (180deg=1.69) USER MOD Single : A 141 SER OG : rot 80:sc= 1.19 USER MOD Single : A 144 ASN : amide:sc= 0.874 K(o=0.87,f=0) USER MOD Single : A 147 LYS NZ :NH3+ -166:sc= 1.23 (180deg=1.05) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.502 -1.152 -1.571 1.00 0.00 N ATOM 2 CA MET A 1 2.916 -1.425 -1.926 1.00 0.00 C ATOM 3 C MET A 1 3.793 -0.213 -1.605 1.00 0.00 C ATOM 4 O MET A 1 3.470 0.918 -1.979 1.00 0.00 O ATOM 5 CB MET A 1 3.094 -1.805 -3.413 1.00 0.00 C ATOM 6 CG MET A 1 2.845 -3.294 -3.687 1.00 0.00 C ATOM 7 SD MET A 1 3.267 -3.802 -5.380 1.00 0.00 S ATOM 8 CE MET A 1 3.028 -5.593 -5.230 1.00 0.00 C ATOM 0 H1 MET A 1 0.921 -1.985 -1.795 1.00 0.00 H new ATOM 0 H2 MET A 1 1.433 -0.945 -0.554 1.00 0.00 H new ATOM 0 H3 MET A 1 1.159 -0.334 -2.114 1.00 0.00 H new ATOM 0 HA MET A 1 3.226 -2.280 -1.325 1.00 0.00 H new ATOM 0 HB2 MET A 1 2.409 -1.211 -4.018 1.00 0.00 H new ATOM 0 HB3 MET A 1 4.105 -1.547 -3.729 1.00 0.00 H new ATOM 0 HG2 MET A 1 3.428 -3.887 -2.983 1.00 0.00 H new ATOM 0 HG3 MET A 1 1.795 -3.519 -3.500 1.00 0.00 H new ATOM 0 HE1 MET A 1 3.245 -6.070 -6.186 1.00 0.00 H new ATOM 0 HE2 MET A 1 3.699 -5.987 -4.467 1.00 0.00 H new ATOM 0 HE3 MET A 1 1.996 -5.800 -4.947 1.00 0.00 H new ATOM 20 N ALA A 2 4.913 -0.457 -0.919 1.00 0.00 N ATOM 21 CA ALA A 2 5.983 0.506 -0.696 1.00 0.00 C ATOM 22 C ALA A 2 6.600 1.005 -2.012 1.00 0.00 C ATOM 23 O ALA A 2 6.342 0.463 -3.089 1.00 0.00 O ATOM 24 CB ALA A 2 7.063 -0.191 0.130 1.00 0.00 C ATOM 0 H ALA A 2 5.101 -1.363 -0.491 1.00 0.00 H new ATOM 0 HA ALA A 2 5.573 1.375 -0.182 1.00 0.00 H new ATOM 0 HB1 ALA A 2 7.883 0.503 0.317 1.00 0.00 H new ATOM 0 HB2 ALA A 2 6.640 -0.517 1.080 1.00 0.00 H new ATOM 0 HB3 ALA A 2 7.437 -1.056 -0.417 1.00 0.00 H new ATOM 30 N ASP A 3 7.489 1.994 -1.908 1.00 0.00 N ATOM 31 CA ASP A 3 8.331 2.452 -3.007 1.00 0.00 C ATOM 32 C ASP A 3 9.601 1.604 -3.111 1.00 0.00 C ATOM 33 O ASP A 3 10.186 1.501 -4.189 1.00 0.00 O ATOM 34 CB ASP A 3 8.725 3.918 -2.786 1.00 0.00 C ATOM 35 CG ASP A 3 9.402 4.509 -4.035 1.00 0.00 C ATOM 36 OD1 ASP A 3 8.747 4.582 -5.099 1.00 0.00 O ATOM 37 OD2 ASP A 3 10.563 4.959 -3.940 1.00 0.00 O ATOM 0 H ASP A 3 7.645 2.507 -1.040 1.00 0.00 H new ATOM 0 HA ASP A 3 7.763 2.354 -3.932 1.00 0.00 H new ATOM 0 HB2 ASP A 3 7.838 4.502 -2.540 1.00 0.00 H new ATOM 0 HB3 ASP A 3 9.401 3.991 -1.934 1.00 0.00 H new ATOM 42 N ILE A 4 10.018 0.987 -1.996 1.00 0.00 N ATOM 43 CA ILE A 4 11.295 0.298 -1.874 1.00 0.00 C ATOM 44 C ILE A 4 11.092 -1.012 -1.102 1.00 0.00 C ATOM 45 O ILE A 4 10.562 -0.984 0.011 1.00 0.00 O ATOM 46 CB ILE A 4 12.303 1.202 -1.115 1.00 0.00 C ATOM 47 CG1 ILE A 4 12.357 2.670 -1.604 1.00 0.00 C ATOM 48 CG2 ILE A 4 13.699 0.575 -1.195 1.00 0.00 C ATOM 49 CD1 ILE A 4 13.386 3.567 -0.903 1.00 0.00 C ATOM 0 H ILE A 4 9.461 0.957 -1.142 1.00 0.00 H new ATOM 0 HA ILE A 4 11.688 0.078 -2.866 1.00 0.00 H new ATOM 0 HB ILE A 4 11.947 1.254 -0.086 1.00 0.00 H new ATOM 0 HG12 ILE A 4 12.571 2.670 -2.673 1.00 0.00 H new ATOM 0 HG13 ILE A 4 11.369 3.113 -1.476 1.00 0.00 H new ATOM 0 HG21 ILE A 4 14.412 1.205 -0.664 1.00 0.00 H new ATOM 0 HG22 ILE A 4 13.680 -0.415 -0.739 1.00 0.00 H new ATOM 0 HG23 ILE A 4 13.999 0.488 -2.239 1.00 0.00 H new ATOM 0 HD11 ILE A 4 13.338 4.572 -1.323 1.00 0.00 H new ATOM 0 HD12 ILE A 4 13.166 3.608 0.164 1.00 0.00 H new ATOM 0 HD13 ILE A 4 14.386 3.159 -1.052 1.00 0.00 H new ATOM 61 N THR A 5 11.512 -2.150 -1.665 1.00 0.00 N ATOM 62 CA THR A 5 11.593 -3.412 -0.935 1.00 0.00 C ATOM 63 C THR A 5 12.967 -3.398 -0.242 1.00 0.00 C ATOM 64 O THR A 5 13.972 -3.056 -0.876 1.00 0.00 O ATOM 65 CB THR A 5 11.389 -4.618 -1.887 1.00 0.00 C ATOM 66 OG1 THR A 5 11.447 -5.818 -1.150 1.00 0.00 O ATOM 67 CG2 THR A 5 12.390 -4.715 -3.038 1.00 0.00 C ATOM 0 H THR A 5 11.805 -2.218 -2.640 1.00 0.00 H new ATOM 0 HA THR A 5 10.803 -3.519 -0.192 1.00 0.00 H new ATOM 0 HB THR A 5 10.411 -4.456 -2.341 1.00 0.00 H new ATOM 0 HG1 THR A 5 11.316 -6.579 -1.753 1.00 0.00 H new ATOM 0 HG21 THR A 5 12.162 -5.591 -3.645 1.00 0.00 H new ATOM 0 HG22 THR A 5 12.323 -3.819 -3.655 1.00 0.00 H new ATOM 0 HG23 THR A 5 13.399 -4.805 -2.636 1.00 0.00 H new ATOM 75 N LEU A 6 13.031 -3.738 1.049 1.00 0.00 N ATOM 76 CA LEU A 6 14.279 -3.887 1.795 1.00 0.00 C ATOM 77 C LEU A 6 14.411 -5.365 2.102 1.00 0.00 C ATOM 78 O LEU A 6 13.783 -5.858 3.042 1.00 0.00 O ATOM 79 CB LEU A 6 14.294 -3.107 3.122 1.00 0.00 C ATOM 80 CG LEU A 6 14.621 -1.608 3.010 1.00 0.00 C ATOM 81 CD1 LEU A 6 13.471 -0.820 2.384 1.00 0.00 C ATOM 82 CD2 LEU A 6 14.921 -1.049 4.405 1.00 0.00 C ATOM 0 H LEU A 6 12.201 -3.920 1.613 1.00 0.00 H new ATOM 0 HA LEU A 6 15.098 -3.490 1.195 1.00 0.00 H new ATOM 0 HB2 LEU A 6 13.318 -3.213 3.596 1.00 0.00 H new ATOM 0 HB3 LEU A 6 15.023 -3.571 3.787 1.00 0.00 H new ATOM 0 HG LEU A 6 15.491 -1.502 2.362 1.00 0.00 H new ATOM 0 HD11 LEU A 6 13.743 0.234 2.323 1.00 0.00 H new ATOM 0 HD12 LEU A 6 13.271 -1.202 1.383 1.00 0.00 H new ATOM 0 HD13 LEU A 6 12.578 -0.929 2.999 1.00 0.00 H new ATOM 0 HD21 LEU A 6 15.153 0.013 4.329 1.00 0.00 H new ATOM 0 HD22 LEU A 6 14.050 -1.185 5.047 1.00 0.00 H new ATOM 0 HD23 LEU A 6 15.773 -1.577 4.833 1.00 0.00 H new ATOM 94 N ILE A 7 15.227 -6.067 1.322 1.00 0.00 N ATOM 95 CA ILE A 7 15.601 -7.439 1.614 1.00 0.00 C ATOM 96 C ILE A 7 16.549 -7.354 2.819 1.00 0.00 C ATOM 97 O ILE A 7 17.737 -7.066 2.689 1.00 0.00 O ATOM 98 CB ILE A 7 16.190 -8.166 0.381 1.00 0.00 C ATOM 99 CG1 ILE A 7 15.443 -7.838 -0.937 1.00 0.00 C ATOM 100 CG2 ILE A 7 16.095 -9.670 0.682 1.00 0.00 C ATOM 101 CD1 ILE A 7 16.019 -8.540 -2.173 1.00 0.00 C ATOM 0 H ILE A 7 15.646 -5.696 0.469 1.00 0.00 H new ATOM 0 HA ILE A 7 14.738 -8.057 1.862 1.00 0.00 H new ATOM 0 HB ILE A 7 17.217 -7.836 0.223 1.00 0.00 H new ATOM 0 HG12 ILE A 7 14.395 -8.118 -0.828 1.00 0.00 H new ATOM 0 HG13 ILE A 7 15.469 -6.760 -1.099 1.00 0.00 H new ATOM 0 HG21 ILE A 7 16.498 -10.235 -0.158 1.00 0.00 H new ATOM 0 HG22 ILE A 7 16.667 -9.898 1.581 1.00 0.00 H new ATOM 0 HG23 ILE A 7 15.052 -9.945 0.837 1.00 0.00 H new ATOM 0 HD11 ILE A 7 15.441 -8.259 -3.053 1.00 0.00 H new ATOM 0 HD12 ILE A 7 17.058 -8.241 -2.310 1.00 0.00 H new ATOM 0 HD13 ILE A 7 15.967 -9.620 -2.035 1.00 0.00 H new ATOM 113 N SER A 8 15.986 -7.559 4.005 1.00 0.00 N ATOM 114 CA SER A 8 16.582 -7.322 5.314 1.00 0.00 C ATOM 115 C SER A 8 17.355 -8.542 5.828 1.00 0.00 C ATOM 116 O SER A 8 17.531 -8.712 7.036 1.00 0.00 O ATOM 117 CB SER A 8 15.442 -6.940 6.268 1.00 0.00 C ATOM 118 OG SER A 8 14.640 -5.902 5.719 1.00 0.00 O ATOM 0 H SER A 8 15.035 -7.920 4.082 1.00 0.00 H new ATOM 0 HA SER A 8 17.315 -6.518 5.247 1.00 0.00 H new ATOM 0 HB2 SER A 8 14.823 -7.815 6.468 1.00 0.00 H new ATOM 0 HB3 SER A 8 15.856 -6.617 7.223 1.00 0.00 H new ATOM 0 HG SER A 8 14.477 -6.082 4.770 1.00 0.00 H new ATOM 124 N GLY A 9 17.763 -9.430 4.925 1.00 0.00 N ATOM 125 CA GLY A 9 18.378 -10.694 5.256 1.00 0.00 C ATOM 126 C GLY A 9 18.998 -11.322 4.027 1.00 0.00 C ATOM 127 O GLY A 9 18.907 -10.778 2.924 1.00 0.00 O ATOM 0 H GLY A 9 17.669 -9.278 3.921 1.00 0.00 H new ATOM 0 HA2 GLY A 9 19.142 -10.544 6.019 1.00 0.00 H new ATOM 0 HA3 GLY A 9 17.633 -11.368 5.679 1.00 0.00 H new ATOM 131 N SER A 10 19.604 -12.485 4.234 1.00 0.00 N ATOM 132 CA SER A 10 20.362 -13.191 3.214 1.00 0.00 C ATOM 133 C SER A 10 20.099 -14.696 3.231 1.00 0.00 C ATOM 134 O SER A 10 20.168 -15.356 2.191 1.00 0.00 O ATOM 135 CB SER A 10 21.847 -12.882 3.422 1.00 0.00 C ATOM 136 OG SER A 10 22.256 -13.025 4.770 1.00 0.00 O ATOM 0 H SER A 10 19.581 -12.970 5.131 1.00 0.00 H new ATOM 0 HA SER A 10 20.042 -12.846 2.231 1.00 0.00 H new ATOM 0 HB2 SER A 10 22.442 -13.545 2.795 1.00 0.00 H new ATOM 0 HB3 SER A 10 22.051 -11.863 3.092 1.00 0.00 H new ATOM 0 HG SER A 10 23.229 -13.133 4.807 1.00 0.00 H new ATOM 142 N THR A 11 19.737 -15.239 4.389 1.00 0.00 N ATOM 143 CA THR A 11 19.508 -16.659 4.602 1.00 0.00 C ATOM 144 C THR A 11 18.061 -16.826 5.102 1.00 0.00 C ATOM 145 O THR A 11 17.804 -17.545 6.068 1.00 0.00 O ATOM 146 CB THR A 11 20.602 -17.188 5.557 1.00 0.00 C ATOM 147 OG1 THR A 11 20.758 -16.347 6.689 1.00 0.00 O ATOM 148 CG2 THR A 11 21.962 -17.252 4.852 1.00 0.00 C ATOM 0 H THR A 11 19.591 -14.682 5.231 1.00 0.00 H new ATOM 0 HA THR A 11 19.593 -17.258 3.695 1.00 0.00 H new ATOM 0 HB THR A 11 20.280 -18.182 5.868 1.00 0.00 H new ATOM 0 HG1 THR A 11 21.456 -16.711 7.273 1.00 0.00 H new ATOM 0 HG21 THR A 11 22.714 -17.627 5.546 1.00 0.00 H new ATOM 0 HG22 THR A 11 21.895 -17.920 3.993 1.00 0.00 H new ATOM 0 HG23 THR A 11 22.245 -16.255 4.515 1.00 0.00 H new ATOM 156 N LEU A 12 17.119 -16.092 4.480 1.00 0.00 N ATOM 157 CA LEU A 12 15.728 -15.931 4.930 1.00 0.00 C ATOM 158 C LEU A 12 15.672 -15.391 6.370 1.00 0.00 C ATOM 159 O LEU A 12 14.848 -15.791 7.191 1.00 0.00 O ATOM 160 CB LEU A 12 14.950 -17.239 4.698 1.00 0.00 C ATOM 161 CG LEU A 12 13.412 -17.105 4.692 1.00 0.00 C ATOM 162 CD1 LEU A 12 12.898 -16.375 3.446 1.00 0.00 C ATOM 163 CD2 LEU A 12 12.778 -18.500 4.733 1.00 0.00 C ATOM 0 H LEU A 12 17.315 -15.578 3.621 1.00 0.00 H new ATOM 0 HA LEU A 12 15.224 -15.172 4.332 1.00 0.00 H new ATOM 0 HB2 LEU A 12 15.264 -17.664 3.745 1.00 0.00 H new ATOM 0 HB3 LEU A 12 15.232 -17.952 5.473 1.00 0.00 H new ATOM 0 HG LEU A 12 13.135 -16.521 5.570 1.00 0.00 H new ATOM 0 HD11 LEU A 12 11.811 -16.306 3.488 1.00 0.00 H new ATOM 0 HD12 LEU A 12 13.325 -15.373 3.410 1.00 0.00 H new ATOM 0 HD13 LEU A 12 13.192 -16.927 2.553 1.00 0.00 H new ATOM 0 HD21 LEU A 12 11.692 -18.406 4.729 1.00 0.00 H new ATOM 0 HD22 LEU A 12 13.096 -19.070 3.860 1.00 0.00 H new ATOM 0 HD23 LEU A 12 13.094 -19.017 5.639 1.00 0.00 H new ATOM 175 N GLY A 13 16.605 -14.490 6.677 1.00 0.00 N ATOM 176 CA GLY A 13 16.800 -13.861 7.974 1.00 0.00 C ATOM 177 C GLY A 13 18.065 -13.008 7.927 1.00 0.00 C ATOM 178 O GLY A 13 18.873 -13.157 7.002 1.00 0.00 O ATOM 0 H GLY A 13 17.280 -14.164 5.985 1.00 0.00 H new ATOM 0 HA2 GLY A 13 15.938 -13.243 8.226 1.00 0.00 H new ATOM 0 HA3 GLY A 13 16.886 -14.620 8.751 1.00 0.00 H new ATOM 182 N GLY A 14 18.220 -12.098 8.890 1.00 0.00 N ATOM 183 CA GLY A 14 19.332 -11.159 8.952 1.00 0.00 C ATOM 184 C GLY A 14 19.042 -10.018 9.924 1.00 0.00 C ATOM 185 O GLY A 14 18.175 -10.138 10.795 1.00 0.00 O ATOM 0 H GLY A 14 17.561 -11.994 9.662 1.00 0.00 H new ATOM 0 HA2 GLY A 14 20.236 -11.683 9.262 1.00 0.00 H new ATOM 0 HA3 GLY A 14 19.524 -10.753 7.959 1.00 0.00 H new ATOM 189 N ALA A 15 19.798 -8.926 9.784 1.00 0.00 N ATOM 190 CA ALA A 15 19.789 -7.749 10.651 1.00 0.00 C ATOM 191 C ALA A 15 18.548 -6.867 10.422 1.00 0.00 C ATOM 192 O ALA A 15 18.665 -5.694 10.058 1.00 0.00 O ATOM 193 CB ALA A 15 21.100 -6.975 10.449 1.00 0.00 C ATOM 0 H ALA A 15 20.469 -8.836 9.021 1.00 0.00 H new ATOM 0 HA ALA A 15 19.725 -8.072 11.690 1.00 0.00 H new ATOM 0 HB1 ALA A 15 21.105 -6.094 11.091 1.00 0.00 H new ATOM 0 HB2 ALA A 15 21.944 -7.616 10.705 1.00 0.00 H new ATOM 0 HB3 ALA A 15 21.183 -6.665 9.407 1.00 0.00 H new ATOM 199 N GLU A 16 17.351 -7.417 10.630 1.00 0.00 N ATOM 200 CA GLU A 16 16.088 -6.710 10.423 1.00 0.00 C ATOM 201 C GLU A 16 16.002 -5.408 11.227 1.00 0.00 C ATOM 202 O GLU A 16 15.395 -4.454 10.750 1.00 0.00 O ATOM 203 CB GLU A 16 14.892 -7.604 10.777 1.00 0.00 C ATOM 204 CG GLU A 16 14.700 -8.777 9.806 1.00 0.00 C ATOM 205 CD GLU A 16 13.501 -9.645 10.231 1.00 0.00 C ATOM 206 OE1 GLU A 16 12.345 -9.295 9.904 1.00 0.00 O ATOM 207 OE2 GLU A 16 13.705 -10.686 10.896 1.00 0.00 O ATOM 0 H GLU A 16 17.231 -8.378 10.951 1.00 0.00 H new ATOM 0 HA GLU A 16 16.055 -6.454 9.364 1.00 0.00 H new ATOM 0 HB2 GLU A 16 15.026 -7.995 11.786 1.00 0.00 H new ATOM 0 HB3 GLU A 16 13.986 -6.999 10.788 1.00 0.00 H new ATOM 0 HG2 GLU A 16 14.541 -8.398 8.797 1.00 0.00 H new ATOM 0 HG3 GLU A 16 15.604 -9.385 9.779 1.00 0.00 H new ATOM 214 N TYR A 17 16.628 -5.326 12.408 1.00 0.00 N ATOM 215 CA TYR A 17 16.668 -4.088 13.187 1.00 0.00 C ATOM 216 C TYR A 17 17.372 -2.971 12.408 1.00 0.00 C ATOM 217 O TYR A 17 16.911 -1.829 12.400 1.00 0.00 O ATOM 218 CB TYR A 17 17.382 -4.346 14.524 1.00 0.00 C ATOM 219 CG TYR A 17 17.543 -3.108 15.394 1.00 0.00 C ATOM 220 CD1 TYR A 17 18.664 -2.269 15.234 1.00 0.00 C ATOM 221 CD2 TYR A 17 16.563 -2.787 16.354 1.00 0.00 C ATOM 222 CE1 TYR A 17 18.810 -1.119 16.029 1.00 0.00 C ATOM 223 CE2 TYR A 17 16.703 -1.638 17.153 1.00 0.00 C ATOM 224 CZ TYR A 17 17.829 -0.796 16.994 1.00 0.00 C ATOM 225 OH TYR A 17 17.980 0.323 17.756 1.00 0.00 O ATOM 0 H TYR A 17 17.115 -6.109 12.844 1.00 0.00 H new ATOM 0 HA TYR A 17 15.646 -3.763 13.382 1.00 0.00 H new ATOM 0 HB2 TYR A 17 16.824 -5.098 15.082 1.00 0.00 H new ATOM 0 HB3 TYR A 17 18.368 -4.765 14.322 1.00 0.00 H new ATOM 0 HD1 TYR A 17 19.415 -2.511 14.497 1.00 0.00 H new ATOM 0 HD2 TYR A 17 15.701 -3.426 16.477 1.00 0.00 H new ATOM 0 HE1 TYR A 17 19.673 -0.482 15.902 1.00 0.00 H new ATOM 0 HE2 TYR A 17 15.950 -1.398 17.889 1.00 0.00 H new ATOM 0 HH TYR A 17 17.221 0.405 18.370 1.00 0.00 H new ATOM 235 N VAL A 18 18.481 -3.290 11.733 1.00 0.00 N ATOM 236 CA VAL A 18 19.242 -2.306 10.974 1.00 0.00 C ATOM 237 C VAL A 18 18.420 -1.910 9.744 1.00 0.00 C ATOM 238 O VAL A 18 18.349 -0.727 9.413 1.00 0.00 O ATOM 239 CB VAL A 18 20.638 -2.868 10.622 1.00 0.00 C ATOM 240 CG1 VAL A 18 21.497 -1.846 9.867 1.00 0.00 C ATOM 241 CG2 VAL A 18 21.412 -3.287 11.888 1.00 0.00 C ATOM 0 H VAL A 18 18.870 -4.232 11.700 1.00 0.00 H new ATOM 0 HA VAL A 18 19.422 -1.406 11.562 1.00 0.00 H new ATOM 0 HB VAL A 18 20.457 -3.734 9.986 1.00 0.00 H new ATOM 0 HG11 VAL A 18 22.469 -2.284 9.640 1.00 0.00 H new ATOM 0 HG12 VAL A 18 20.999 -1.568 8.938 1.00 0.00 H new ATOM 0 HG13 VAL A 18 21.634 -0.959 10.485 1.00 0.00 H new ATOM 0 HG21 VAL A 18 22.389 -3.678 11.604 1.00 0.00 H new ATOM 0 HG22 VAL A 18 21.542 -2.422 12.538 1.00 0.00 H new ATOM 0 HG23 VAL A 18 20.853 -4.058 12.418 1.00 0.00 H new ATOM 251 N ALA A 19 17.743 -2.872 9.109 1.00 0.00 N ATOM 252 CA ALA A 19 16.853 -2.583 7.994 1.00 0.00 C ATOM 253 C ALA A 19 15.677 -1.700 8.426 1.00 0.00 C ATOM 254 O ALA A 19 15.300 -0.797 7.686 1.00 0.00 O ATOM 255 CB ALA A 19 16.366 -3.881 7.362 1.00 0.00 C ATOM 0 H ALA A 19 17.799 -3.860 9.354 1.00 0.00 H new ATOM 0 HA ALA A 19 17.415 -2.023 7.246 1.00 0.00 H new ATOM 0 HB1 ALA A 19 15.701 -3.653 6.529 1.00 0.00 H new ATOM 0 HB2 ALA A 19 17.221 -4.452 6.998 1.00 0.00 H new ATOM 0 HB3 ALA A 19 15.828 -4.468 8.106 1.00 0.00 H new ATOM 261 N GLU A 20 15.119 -1.904 9.620 1.00 0.00 N ATOM 262 CA GLU A 20 14.064 -1.049 10.155 1.00 0.00 C ATOM 263 C GLU A 20 14.593 0.371 10.415 1.00 0.00 C ATOM 264 O GLU A 20 13.906 1.348 10.116 1.00 0.00 O ATOM 265 CB GLU A 20 13.478 -1.691 11.422 1.00 0.00 C ATOM 266 CG GLU A 20 12.203 -0.974 11.879 1.00 0.00 C ATOM 267 CD GLU A 20 11.594 -1.642 13.124 1.00 0.00 C ATOM 268 OE1 GLU A 20 11.964 -1.275 14.262 1.00 0.00 O ATOM 269 OE2 GLU A 20 10.717 -2.526 12.980 1.00 0.00 O ATOM 0 H GLU A 20 15.387 -2.667 10.242 1.00 0.00 H new ATOM 0 HA GLU A 20 13.263 -0.955 9.422 1.00 0.00 H new ATOM 0 HB2 GLU A 20 13.257 -2.741 11.230 1.00 0.00 H new ATOM 0 HB3 GLU A 20 14.219 -1.662 12.221 1.00 0.00 H new ATOM 0 HG2 GLU A 20 12.430 0.069 12.099 1.00 0.00 H new ATOM 0 HG3 GLU A 20 11.473 -0.977 11.070 1.00 0.00 H new ATOM 276 N HIS A 21 15.821 0.513 10.925 1.00 0.00 N ATOM 277 CA HIS A 21 16.427 1.827 11.128 1.00 0.00 C ATOM 278 C HIS A 21 16.660 2.531 9.783 1.00 0.00 C ATOM 279 O HIS A 21 16.472 3.742 9.670 1.00 0.00 O ATOM 280 CB HIS A 21 17.734 1.688 11.915 1.00 0.00 C ATOM 281 CG HIS A 21 18.193 2.989 12.531 1.00 0.00 C ATOM 282 ND1 HIS A 21 18.285 4.215 11.908 1.00 0.00 N ATOM 283 CD2 HIS A 21 18.549 3.177 13.838 1.00 0.00 C ATOM 284 CE1 HIS A 21 18.698 5.114 12.816 1.00 0.00 C ATOM 285 NE2 HIS A 21 18.876 4.529 14.016 1.00 0.00 N ATOM 0 H HIS A 21 16.413 -0.269 11.204 1.00 0.00 H new ATOM 0 HA HIS A 21 15.742 2.444 11.709 1.00 0.00 H new ATOM 0 HB2 HIS A 21 17.600 0.947 12.703 1.00 0.00 H new ATOM 0 HB3 HIS A 21 18.513 1.312 11.252 1.00 0.00 H new ATOM 0 HD1 HIS A 21 18.076 4.406 10.928 1.00 0.00 H new ATOM 0 HD2 HIS A 21 18.574 2.415 14.602 1.00 0.00 H new ATOM 0 HE1 HIS A 21 18.864 6.161 12.612 1.00 0.00 H new ATOM 293 N LEU A 22 17.067 1.786 8.754 1.00 0.00 N ATOM 294 CA LEU A 22 17.249 2.299 7.399 1.00 0.00 C ATOM 295 C LEU A 22 15.913 2.766 6.829 1.00 0.00 C ATOM 296 O LEU A 22 15.809 3.888 6.336 1.00 0.00 O ATOM 297 CB LEU A 22 17.838 1.186 6.521 1.00 0.00 C ATOM 298 CG LEU A 22 19.367 1.071 6.657 1.00 0.00 C ATOM 299 CD1 LEU A 22 19.827 -0.317 6.205 1.00 0.00 C ATOM 300 CD2 LEU A 22 20.086 2.157 5.846 1.00 0.00 C ATOM 0 H LEU A 22 17.282 0.793 8.842 1.00 0.00 H new ATOM 0 HA LEU A 22 17.930 3.150 7.418 1.00 0.00 H new ATOM 0 HB2 LEU A 22 17.380 0.234 6.792 1.00 0.00 H new ATOM 0 HB3 LEU A 22 17.583 1.377 5.479 1.00 0.00 H new ATOM 0 HG LEU A 22 19.625 1.214 7.706 1.00 0.00 H new ATOM 0 HD11 LEU A 22 20.910 -0.391 6.304 1.00 0.00 H new ATOM 0 HD12 LEU A 22 19.353 -1.077 6.826 1.00 0.00 H new ATOM 0 HD13 LEU A 22 19.546 -0.472 5.163 1.00 0.00 H new ATOM 0 HD21 LEU A 22 21.164 2.046 5.965 1.00 0.00 H new ATOM 0 HD22 LEU A 22 19.825 2.057 4.792 1.00 0.00 H new ATOM 0 HD23 LEU A 22 19.781 3.140 6.204 1.00 0.00 H new ATOM 312 N ALA A 23 14.892 1.913 6.926 1.00 0.00 N ATOM 313 CA ALA A 23 13.516 2.229 6.571 1.00 0.00 C ATOM 314 C ALA A 23 13.061 3.532 7.233 1.00 0.00 C ATOM 315 O ALA A 23 12.454 4.355 6.557 1.00 0.00 O ATOM 316 CB ALA A 23 12.586 1.072 6.951 1.00 0.00 C ATOM 0 H ALA A 23 15.007 0.957 7.264 1.00 0.00 H new ATOM 0 HA ALA A 23 13.468 2.370 5.491 1.00 0.00 H new ATOM 0 HB1 ALA A 23 11.561 1.325 6.679 1.00 0.00 H new ATOM 0 HB2 ALA A 23 12.891 0.170 6.420 1.00 0.00 H new ATOM 0 HB3 ALA A 23 12.643 0.897 8.025 1.00 0.00 H new ATOM 322 N GLU A 24 13.385 3.759 8.511 1.00 0.00 N ATOM 323 CA GLU A 24 13.025 4.992 9.207 1.00 0.00 C ATOM 324 C GLU A 24 13.540 6.207 8.429 1.00 0.00 C ATOM 325 O GLU A 24 12.766 7.087 8.052 1.00 0.00 O ATOM 326 CB GLU A 24 13.601 4.981 10.634 1.00 0.00 C ATOM 327 CG GLU A 24 12.912 5.980 11.574 1.00 0.00 C ATOM 328 CD GLU A 24 11.479 5.554 11.944 1.00 0.00 C ATOM 329 OE1 GLU A 24 11.300 4.782 12.912 1.00 0.00 O ATOM 330 OE2 GLU A 24 10.514 6.010 11.290 1.00 0.00 O ATOM 0 H GLU A 24 13.902 3.094 9.087 1.00 0.00 H new ATOM 0 HA GLU A 24 11.939 5.058 9.272 1.00 0.00 H new ATOM 0 HB2 GLU A 24 13.506 3.978 11.049 1.00 0.00 H new ATOM 0 HB3 GLU A 24 14.666 5.209 10.590 1.00 0.00 H new ATOM 0 HG2 GLU A 24 13.503 6.083 12.484 1.00 0.00 H new ATOM 0 HG3 GLU A 24 12.884 6.961 11.099 1.00 0.00 H new ATOM 337 N LYS A 25 14.843 6.230 8.133 1.00 0.00 N ATOM 338 CA LYS A 25 15.467 7.321 7.390 1.00 0.00 C ATOM 339 C LYS A 25 14.879 7.483 5.990 1.00 0.00 C ATOM 340 O LYS A 25 14.661 8.603 5.538 1.00 0.00 O ATOM 341 CB LYS A 25 16.969 7.045 7.287 1.00 0.00 C ATOM 342 CG LYS A 25 17.679 6.970 8.649 1.00 0.00 C ATOM 343 CD LYS A 25 17.517 8.167 9.593 1.00 0.00 C ATOM 344 CE LYS A 25 17.712 9.555 8.969 1.00 0.00 C ATOM 345 NZ LYS A 25 19.088 9.784 8.457 1.00 0.00 N ATOM 0 H LYS A 25 15.492 5.491 8.403 1.00 0.00 H new ATOM 0 HA LYS A 25 15.276 8.250 7.927 1.00 0.00 H new ATOM 0 HB2 LYS A 25 17.121 6.105 6.756 1.00 0.00 H new ATOM 0 HB3 LYS A 25 17.433 7.829 6.688 1.00 0.00 H new ATOM 0 HG2 LYS A 25 17.321 6.081 9.168 1.00 0.00 H new ATOM 0 HG3 LYS A 25 18.744 6.826 8.467 1.00 0.00 H new ATOM 0 HD2 LYS A 25 16.519 8.125 10.030 1.00 0.00 H new ATOM 0 HD3 LYS A 25 18.229 8.056 10.411 1.00 0.00 H new ATOM 0 HE2 LYS A 25 17.002 9.680 8.151 1.00 0.00 H new ATOM 0 HE3 LYS A 25 17.478 10.316 9.713 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 19.152 10.739 8.049 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 19.768 9.695 9.238 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 19.308 9.079 7.725 1.00 0.00 H new ATOM 359 N LEU A 26 14.643 6.377 5.292 1.00 0.00 N ATOM 360 CA LEU A 26 14.090 6.381 3.940 1.00 0.00 C ATOM 361 C LEU A 26 12.670 6.950 3.927 1.00 0.00 C ATOM 362 O LEU A 26 12.314 7.704 3.022 1.00 0.00 O ATOM 363 CB LEU A 26 14.089 4.952 3.379 1.00 0.00 C ATOM 364 CG LEU A 26 15.491 4.420 3.029 1.00 0.00 C ATOM 365 CD1 LEU A 26 15.474 2.891 2.949 1.00 0.00 C ATOM 366 CD2 LEU A 26 15.988 4.987 1.695 1.00 0.00 C ATOM 0 H LEU A 26 14.832 5.442 5.652 1.00 0.00 H new ATOM 0 HA LEU A 26 14.714 7.018 3.314 1.00 0.00 H new ATOM 0 HB2 LEU A 26 13.630 4.286 4.109 1.00 0.00 H new ATOM 0 HB3 LEU A 26 13.466 4.923 2.485 1.00 0.00 H new ATOM 0 HG LEU A 26 16.169 4.742 3.819 1.00 0.00 H new ATOM 0 HD11 LEU A 26 16.472 2.529 2.701 1.00 0.00 H new ATOM 0 HD12 LEU A 26 15.167 2.480 3.911 1.00 0.00 H new ATOM 0 HD13 LEU A 26 14.771 2.575 2.178 1.00 0.00 H new ATOM 0 HD21 LEU A 26 16.980 4.591 1.478 1.00 0.00 H new ATOM 0 HD22 LEU A 26 15.301 4.700 0.899 1.00 0.00 H new ATOM 0 HD23 LEU A 26 16.037 6.074 1.757 1.00 0.00 H new ATOM 378 N GLU A 27 11.843 6.625 4.919 1.00 0.00 N ATOM 379 CA GLU A 27 10.494 7.147 4.996 1.00 0.00 C ATOM 380 C GLU A 27 10.515 8.613 5.446 1.00 0.00 C ATOM 381 O GLU A 27 9.723 9.408 4.940 1.00 0.00 O ATOM 382 CB GLU A 27 9.641 6.240 5.890 1.00 0.00 C ATOM 383 CG GLU A 27 9.415 4.876 5.209 1.00 0.00 C ATOM 384 CD GLU A 27 8.284 4.033 5.828 1.00 0.00 C ATOM 385 OE1 GLU A 27 8.190 3.925 7.073 1.00 0.00 O ATOM 386 OE2 GLU A 27 7.470 3.473 5.057 1.00 0.00 O ATOM 0 H GLU A 27 12.093 5.997 5.683 1.00 0.00 H new ATOM 0 HA GLU A 27 10.029 7.142 4.010 1.00 0.00 H new ATOM 0 HB2 GLU A 27 10.135 6.097 6.851 1.00 0.00 H new ATOM 0 HB3 GLU A 27 8.682 6.716 6.093 1.00 0.00 H new ATOM 0 HG2 GLU A 27 9.192 5.043 4.155 1.00 0.00 H new ATOM 0 HG3 GLU A 27 10.342 4.305 5.252 1.00 0.00 H new ATOM 393 N GLU A 28 11.465 9.016 6.299 1.00 0.00 N ATOM 394 CA GLU A 28 11.711 10.416 6.627 1.00 0.00 C ATOM 395 C GLU A 28 12.142 11.207 5.381 1.00 0.00 C ATOM 396 O GLU A 28 11.807 12.388 5.267 1.00 0.00 O ATOM 397 CB GLU A 28 12.793 10.512 7.716 1.00 0.00 C ATOM 398 CG GLU A 28 12.308 10.207 9.140 1.00 0.00 C ATOM 399 CD GLU A 28 11.408 11.323 9.703 1.00 0.00 C ATOM 400 OE1 GLU A 28 11.934 12.306 10.271 1.00 0.00 O ATOM 401 OE2 GLU A 28 10.164 11.223 9.605 1.00 0.00 O ATOM 0 H GLU A 28 12.088 8.369 6.783 1.00 0.00 H new ATOM 0 HA GLU A 28 10.784 10.851 6.999 1.00 0.00 H new ATOM 0 HB2 GLU A 28 13.600 9.822 7.467 1.00 0.00 H new ATOM 0 HB3 GLU A 28 13.216 11.516 7.700 1.00 0.00 H new ATOM 0 HG2 GLU A 28 11.759 9.266 9.140 1.00 0.00 H new ATOM 0 HG3 GLU A 28 13.170 10.074 9.794 1.00 0.00 H new ATOM 408 N ALA A 29 12.850 10.574 4.432 1.00 0.00 N ATOM 409 CA ALA A 29 13.237 11.201 3.172 1.00 0.00 C ATOM 410 C ALA A 29 12.024 11.434 2.264 1.00 0.00 C ATOM 411 O ALA A 29 12.096 12.284 1.374 1.00 0.00 O ATOM 412 CB ALA A 29 14.301 10.363 2.454 1.00 0.00 C ATOM 0 H ALA A 29 13.168 9.609 4.524 1.00 0.00 H new ATOM 0 HA ALA A 29 13.665 12.176 3.405 1.00 0.00 H new ATOM 0 HB1 ALA A 29 14.575 10.848 1.517 1.00 0.00 H new ATOM 0 HB2 ALA A 29 15.183 10.274 3.088 1.00 0.00 H new ATOM 0 HB3 ALA A 29 13.902 9.370 2.245 1.00 0.00 H new ATOM 418 N GLY A 30 10.919 10.714 2.486 1.00 0.00 N ATOM 419 CA GLY A 30 9.631 10.970 1.855 1.00 0.00 C ATOM 420 C GLY A 30 9.022 9.739 1.188 1.00 0.00 C ATOM 421 O GLY A 30 7.906 9.839 0.672 1.00 0.00 O ATOM 0 H GLY A 30 10.901 9.920 3.125 1.00 0.00 H new ATOM 0 HA2 GLY A 30 8.937 11.347 2.606 1.00 0.00 H new ATOM 0 HA3 GLY A 30 9.751 11.755 1.109 1.00 0.00 H new ATOM 425 N PHE A 31 9.726 8.601 1.150 1.00 0.00 N ATOM 426 CA PHE A 31 9.243 7.413 0.445 1.00 0.00 C ATOM 427 C PHE A 31 8.399 6.549 1.393 1.00 0.00 C ATOM 428 O PHE A 31 8.089 6.949 2.517 1.00 0.00 O ATOM 429 CB PHE A 31 10.424 6.614 -0.143 1.00 0.00 C ATOM 430 CG PHE A 31 11.592 7.428 -0.678 1.00 0.00 C ATOM 431 CD1 PHE A 31 11.396 8.374 -1.704 1.00 0.00 C ATOM 432 CD2 PHE A 31 12.886 7.226 -0.159 1.00 0.00 C ATOM 433 CE1 PHE A 31 12.485 9.116 -2.200 1.00 0.00 C ATOM 434 CE2 PHE A 31 13.974 7.954 -0.665 1.00 0.00 C ATOM 435 CZ PHE A 31 13.774 8.905 -1.683 1.00 0.00 C ATOM 0 H PHE A 31 10.633 8.480 1.601 1.00 0.00 H new ATOM 0 HA PHE A 31 8.611 7.724 -0.386 1.00 0.00 H new ATOM 0 HB2 PHE A 31 10.801 5.943 0.629 1.00 0.00 H new ATOM 0 HB3 PHE A 31 10.045 5.989 -0.951 1.00 0.00 H new ATOM 0 HD1 PHE A 31 10.408 8.530 -2.111 1.00 0.00 H new ATOM 0 HD2 PHE A 31 13.042 6.507 0.632 1.00 0.00 H new ATOM 0 HE1 PHE A 31 12.329 9.848 -2.979 1.00 0.00 H new ATOM 0 HE2 PHE A 31 14.966 7.784 -0.273 1.00 0.00 H new ATOM 0 HZ PHE A 31 14.610 9.471 -2.066 1.00 0.00 H new ATOM 445 N THR A 32 8.050 5.343 0.947 1.00 0.00 N ATOM 446 CA THR A 32 7.462 4.302 1.777 1.00 0.00 C ATOM 447 C THR A 32 8.291 3.053 1.527 1.00 0.00 C ATOM 448 O THR A 32 8.813 2.869 0.422 1.00 0.00 O ATOM 449 CB THR A 32 5.977 4.066 1.477 1.00 0.00 C ATOM 450 OG1 THR A 32 5.707 4.091 0.086 1.00 0.00 O ATOM 451 CG2 THR A 32 5.104 5.095 2.193 1.00 0.00 C ATOM 0 H THR A 32 8.173 5.060 -0.025 1.00 0.00 H new ATOM 0 HA THR A 32 7.483 4.596 2.826 1.00 0.00 H new ATOM 0 HB THR A 32 5.734 3.071 1.850 1.00 0.00 H new ATOM 0 HG1 THR A 32 4.751 3.935 -0.065 1.00 0.00 H new ATOM 0 HG21 THR A 32 4.055 4.905 1.963 1.00 0.00 H new ATOM 0 HG22 THR A 32 5.260 5.018 3.269 1.00 0.00 H new ATOM 0 HG23 THR A 32 5.373 6.097 1.858 1.00 0.00 H new ATOM 459 N THR A 33 8.432 2.198 2.532 1.00 0.00 N ATOM 460 CA THR A 33 9.383 1.099 2.456 1.00 0.00 C ATOM 461 C THR A 33 8.814 -0.193 3.053 1.00 0.00 C ATOM 462 O THR A 33 7.988 -0.163 3.968 1.00 0.00 O ATOM 463 CB THR A 33 10.699 1.533 3.110 1.00 0.00 C ATOM 464 OG1 THR A 33 10.538 1.783 4.488 1.00 0.00 O ATOM 465 CG2 THR A 33 11.290 2.812 2.507 1.00 0.00 C ATOM 0 H THR A 33 7.903 2.244 3.403 1.00 0.00 H new ATOM 0 HA THR A 33 9.583 0.864 1.411 1.00 0.00 H new ATOM 0 HB THR A 33 11.374 0.696 2.929 1.00 0.00 H new ATOM 0 HG1 THR A 33 11.266 2.358 4.803 1.00 0.00 H new ATOM 0 HG21 THR A 33 12.220 3.059 3.019 1.00 0.00 H new ATOM 0 HG22 THR A 33 11.489 2.656 1.447 1.00 0.00 H new ATOM 0 HG23 THR A 33 10.581 3.632 2.626 1.00 0.00 H new ATOM 473 N GLU A 34 9.271 -1.336 2.538 1.00 0.00 N ATOM 474 CA GLU A 34 8.828 -2.664 2.897 1.00 0.00 C ATOM 475 C GLU A 34 10.005 -3.365 3.581 1.00 0.00 C ATOM 476 O GLU A 34 10.859 -3.949 2.911 1.00 0.00 O ATOM 477 CB GLU A 34 8.359 -3.366 1.613 1.00 0.00 C ATOM 478 CG GLU A 34 7.008 -4.040 1.795 1.00 0.00 C ATOM 479 CD GLU A 34 5.803 -3.079 1.786 1.00 0.00 C ATOM 480 OE1 GLU A 34 5.253 -2.797 0.697 1.00 0.00 O ATOM 481 OE2 GLU A 34 5.371 -2.644 2.879 1.00 0.00 O ATOM 0 H GLU A 34 9.998 -1.349 1.823 1.00 0.00 H new ATOM 0 HA GLU A 34 7.988 -2.669 3.592 1.00 0.00 H new ATOM 0 HB2 GLU A 34 8.295 -2.638 0.804 1.00 0.00 H new ATOM 0 HB3 GLU A 34 9.098 -4.110 1.315 1.00 0.00 H new ATOM 0 HG2 GLU A 34 6.875 -4.776 1.002 1.00 0.00 H new ATOM 0 HG3 GLU A 34 7.013 -4.586 2.739 1.00 0.00 H new ATOM 488 N THR A 35 10.109 -3.257 4.905 1.00 0.00 N ATOM 489 CA THR A 35 11.095 -4.015 5.668 1.00 0.00 C ATOM 490 C THR A 35 10.663 -5.485 5.657 1.00 0.00 C ATOM 491 O THR A 35 9.556 -5.808 6.101 1.00 0.00 O ATOM 492 CB THR A 35 11.231 -3.471 7.100 1.00 0.00 C ATOM 493 OG1 THR A 35 11.169 -2.055 7.108 1.00 0.00 O ATOM 494 CG2 THR A 35 12.576 -3.916 7.680 1.00 0.00 C ATOM 0 H THR A 35 9.519 -2.648 5.472 1.00 0.00 H new ATOM 0 HA THR A 35 12.081 -3.917 5.213 1.00 0.00 H new ATOM 0 HB THR A 35 10.410 -3.861 7.701 1.00 0.00 H new ATOM 0 HG1 THR A 35 11.256 -1.729 8.028 1.00 0.00 H new ATOM 0 HG21 THR A 35 12.679 -3.533 8.695 1.00 0.00 H new ATOM 0 HG22 THR A 35 12.623 -5.005 7.696 1.00 0.00 H new ATOM 0 HG23 THR A 35 13.385 -3.527 7.062 1.00 0.00 H new ATOM 502 N LEU A 36 11.507 -6.371 5.125 1.00 0.00 N ATOM 503 CA LEU A 36 11.155 -7.764 4.845 1.00 0.00 C ATOM 504 C LEU A 36 12.365 -8.667 5.007 1.00 0.00 C ATOM 505 O LEU A 36 13.407 -8.371 4.436 1.00 0.00 O ATOM 506 CB LEU A 36 10.766 -7.882 3.364 1.00 0.00 C ATOM 507 CG LEU A 36 9.484 -7.163 2.939 1.00 0.00 C ATOM 508 CD1 LEU A 36 9.464 -7.133 1.413 1.00 0.00 C ATOM 509 CD2 LEU A 36 8.225 -7.855 3.469 1.00 0.00 C ATOM 0 H LEU A 36 12.467 -6.138 4.873 1.00 0.00 H new ATOM 0 HA LEU A 36 10.354 -8.050 5.526 1.00 0.00 H new ATOM 0 HB2 LEU A 36 11.589 -7.497 2.763 1.00 0.00 H new ATOM 0 HB3 LEU A 36 10.661 -8.939 3.121 1.00 0.00 H new ATOM 0 HG LEU A 36 9.481 -6.157 3.358 1.00 0.00 H new ATOM 0 HD11 LEU A 36 8.562 -6.626 1.071 1.00 0.00 H new ATOM 0 HD12 LEU A 36 10.341 -6.598 1.048 1.00 0.00 H new ATOM 0 HD13 LEU A 36 9.475 -8.153 1.029 1.00 0.00 H new ATOM 0 HD21 LEU A 36 7.342 -7.306 3.140 1.00 0.00 H new ATOM 0 HD22 LEU A 36 8.182 -8.875 3.086 1.00 0.00 H new ATOM 0 HD23 LEU A 36 8.253 -7.877 4.558 1.00 0.00 H new ATOM 521 N HIS A 37 12.237 -9.845 5.614 1.00 0.00 N ATOM 522 CA HIS A 37 13.311 -10.848 5.605 1.00 0.00 C ATOM 523 C HIS A 37 13.336 -11.636 4.275 1.00 0.00 C ATOM 524 O HIS A 37 13.558 -12.847 4.265 1.00 0.00 O ATOM 525 CB HIS A 37 13.205 -11.739 6.856 1.00 0.00 C ATOM 526 CG HIS A 37 11.932 -12.549 6.969 1.00 0.00 C ATOM 527 ND1 HIS A 37 11.580 -13.618 6.177 1.00 0.00 N ATOM 528 CD2 HIS A 37 10.945 -12.403 7.907 1.00 0.00 C ATOM 529 CE1 HIS A 37 10.412 -14.105 6.622 1.00 0.00 C ATOM 530 NE2 HIS A 37 9.977 -13.392 7.679 1.00 0.00 N ATOM 0 H HIS A 37 11.400 -10.133 6.121 1.00 0.00 H new ATOM 0 HA HIS A 37 14.278 -10.347 5.656 1.00 0.00 H new ATOM 0 HB2 HIS A 37 14.053 -12.423 6.867 1.00 0.00 H new ATOM 0 HB3 HIS A 37 13.294 -11.107 7.740 1.00 0.00 H new ATOM 0 HD1 HIS A 37 12.115 -13.978 5.387 1.00 0.00 H new ATOM 0 HD2 HIS A 37 10.917 -11.656 8.687 1.00 0.00 H new ATOM 0 HE1 HIS A 37 9.893 -14.950 6.193 1.00 0.00 H new ATOM 538 N GLY A 38 13.054 -10.962 3.154 1.00 0.00 N ATOM 539 CA GLY A 38 12.907 -11.541 1.818 1.00 0.00 C ATOM 540 C GLY A 38 11.974 -12.758 1.741 1.00 0.00 C ATOM 541 O GLY A 38 12.377 -13.758 1.148 1.00 0.00 O ATOM 0 H GLY A 38 12.916 -9.951 3.156 1.00 0.00 H new ATOM 0 HA2 GLY A 38 12.533 -10.771 1.143 1.00 0.00 H new ATOM 0 HA3 GLY A 38 13.892 -11.833 1.454 1.00 0.00 H new ATOM 545 N PRO A 39 10.741 -12.723 2.290 1.00 0.00 N ATOM 546 CA PRO A 39 9.883 -13.903 2.398 1.00 0.00 C ATOM 547 C PRO A 39 9.463 -14.491 1.046 1.00 0.00 C ATOM 548 O PRO A 39 9.120 -15.673 0.973 1.00 0.00 O ATOM 549 CB PRO A 39 8.670 -13.460 3.222 1.00 0.00 C ATOM 550 CG PRO A 39 8.575 -11.963 2.942 1.00 0.00 C ATOM 551 CD PRO A 39 10.038 -11.550 2.785 1.00 0.00 C ATOM 0 HA PRO A 39 10.430 -14.716 2.875 1.00 0.00 H new ATOM 0 HB2 PRO A 39 7.764 -13.984 2.916 1.00 0.00 H new ATOM 0 HB3 PRO A 39 8.811 -13.661 4.284 1.00 0.00 H new ATOM 0 HG2 PRO A 39 7.998 -11.757 2.040 1.00 0.00 H new ATOM 0 HG3 PRO A 39 8.090 -11.429 3.760 1.00 0.00 H new ATOM 0 HD2 PRO A 39 10.134 -10.716 2.089 1.00 0.00 H new ATOM 0 HD3 PRO A 39 10.454 -11.220 3.737 1.00 0.00 H new ATOM 559 N LEU A 40 9.501 -13.689 -0.024 1.00 0.00 N ATOM 560 CA LEU A 40 9.139 -14.056 -1.376 1.00 0.00 C ATOM 561 C LEU A 40 10.274 -13.663 -2.333 1.00 0.00 C ATOM 562 O LEU A 40 10.051 -13.634 -3.541 1.00 0.00 O ATOM 563 CB LEU A 40 7.842 -13.295 -1.711 1.00 0.00 C ATOM 564 CG LEU A 40 6.568 -13.805 -1.008 1.00 0.00 C ATOM 565 CD1 LEU A 40 5.390 -12.891 -1.364 1.00 0.00 C ATOM 566 CD2 LEU A 40 6.216 -15.248 -1.393 1.00 0.00 C ATOM 0 H LEU A 40 9.803 -12.717 0.046 1.00 0.00 H new ATOM 0 HA LEU A 40 8.981 -15.130 -1.476 1.00 0.00 H new ATOM 0 HB2 LEU A 40 7.982 -12.245 -1.454 1.00 0.00 H new ATOM 0 HB3 LEU A 40 7.683 -13.341 -2.788 1.00 0.00 H new ATOM 0 HG LEU A 40 6.764 -13.790 0.064 1.00 0.00 H new ATOM 0 HD11 LEU A 40 4.488 -13.250 -0.868 1.00 0.00 H new ATOM 0 HD12 LEU A 40 5.605 -11.875 -1.034 1.00 0.00 H new ATOM 0 HD13 LEU A 40 5.238 -12.898 -2.443 1.00 0.00 H new ATOM 0 HD21 LEU A 40 5.311 -15.554 -0.868 1.00 0.00 H new ATOM 0 HD22 LEU A 40 6.050 -15.307 -2.469 1.00 0.00 H new ATOM 0 HD23 LEU A 40 7.037 -15.909 -1.116 1.00 0.00 H new ATOM 578 N LEU A 41 11.459 -13.305 -1.806 1.00 0.00 N ATOM 579 CA LEU A 41 12.609 -12.696 -2.493 1.00 0.00 C ATOM 580 C LEU A 41 12.317 -11.314 -3.107 1.00 0.00 C ATOM 581 O LEU A 41 13.228 -10.497 -3.225 1.00 0.00 O ATOM 582 CB LEU A 41 13.180 -13.675 -3.541 1.00 0.00 C ATOM 583 CG LEU A 41 14.574 -13.280 -4.065 1.00 0.00 C ATOM 584 CD1 LEU A 41 15.675 -13.523 -3.030 1.00 0.00 C ATOM 585 CD2 LEU A 41 14.902 -14.083 -5.328 1.00 0.00 C ATOM 0 H LEU A 41 11.650 -13.445 -0.814 1.00 0.00 H new ATOM 0 HA LEU A 41 13.362 -12.507 -1.728 1.00 0.00 H new ATOM 0 HB2 LEU A 41 13.236 -14.671 -3.102 1.00 0.00 H new ATOM 0 HB3 LEU A 41 12.490 -13.736 -4.382 1.00 0.00 H new ATOM 0 HG LEU A 41 14.541 -12.213 -4.283 1.00 0.00 H new ATOM 0 HD11 LEU A 41 16.638 -13.229 -3.447 1.00 0.00 H new ATOM 0 HD12 LEU A 41 15.471 -12.933 -2.137 1.00 0.00 H new ATOM 0 HD13 LEU A 41 15.701 -14.581 -2.768 1.00 0.00 H new ATOM 0 HD21 LEU A 41 15.889 -13.799 -5.694 1.00 0.00 H new ATOM 0 HD22 LEU A 41 14.894 -15.148 -5.095 1.00 0.00 H new ATOM 0 HD23 LEU A 41 14.157 -13.874 -6.096 1.00 0.00 H new ATOM 597 N GLU A 42 11.063 -11.007 -3.433 1.00 0.00 N ATOM 598 CA GLU A 42 10.680 -9.851 -4.229 1.00 0.00 C ATOM 599 C GLU A 42 9.199 -9.552 -3.989 1.00 0.00 C ATOM 600 O GLU A 42 8.328 -9.944 -4.767 1.00 0.00 O ATOM 601 CB GLU A 42 11.043 -10.109 -5.712 1.00 0.00 C ATOM 602 CG GLU A 42 10.594 -11.451 -6.326 1.00 0.00 C ATOM 603 CD GLU A 42 11.148 -11.637 -7.747 1.00 0.00 C ATOM 604 OE1 GLU A 42 10.547 -11.108 -8.712 1.00 0.00 O ATOM 605 OE2 GLU A 42 12.165 -12.350 -7.907 1.00 0.00 O ATOM 0 H GLU A 42 10.266 -11.573 -3.141 1.00 0.00 H new ATOM 0 HA GLU A 42 11.229 -8.957 -3.933 1.00 0.00 H new ATOM 0 HB2 GLU A 42 10.614 -9.304 -6.309 1.00 0.00 H new ATOM 0 HB3 GLU A 42 12.126 -10.038 -5.812 1.00 0.00 H new ATOM 0 HG2 GLU A 42 10.931 -12.272 -5.693 1.00 0.00 H new ATOM 0 HG3 GLU A 42 9.505 -11.494 -6.351 1.00 0.00 H new ATOM 612 N ASP A 43 8.891 -8.912 -2.854 1.00 0.00 N ATOM 613 CA ASP A 43 7.528 -8.440 -2.607 1.00 0.00 C ATOM 614 C ASP A 43 7.151 -7.369 -3.631 1.00 0.00 C ATOM 615 O ASP A 43 6.072 -7.455 -4.223 1.00 0.00 O ATOM 616 CB ASP A 43 7.362 -7.890 -1.194 1.00 0.00 C ATOM 617 CG ASP A 43 5.898 -7.481 -0.962 1.00 0.00 C ATOM 618 OD1 ASP A 43 5.073 -8.360 -0.629 1.00 0.00 O ATOM 619 OD2 ASP A 43 5.570 -6.284 -1.105 1.00 0.00 O ATOM 0 H ASP A 43 9.555 -8.713 -2.106 1.00 0.00 H new ATOM 0 HA ASP A 43 6.861 -9.296 -2.709 1.00 0.00 H new ATOM 0 HB2 ASP A 43 7.659 -8.643 -0.464 1.00 0.00 H new ATOM 0 HB3 ASP A 43 8.016 -7.030 -1.049 1.00 0.00 H new ATOM 624 N LEU A 44 8.039 -6.390 -3.886 1.00 0.00 N ATOM 625 CA LEU A 44 7.837 -5.476 -5.013 1.00 0.00 C ATOM 626 C LEU A 44 8.326 -6.168 -6.298 1.00 0.00 C ATOM 627 O LEU A 44 9.202 -7.034 -6.221 1.00 0.00 O ATOM 628 CB LEU A 44 8.564 -4.131 -4.817 1.00 0.00 C ATOM 629 CG LEU A 44 8.113 -3.308 -3.595 1.00 0.00 C ATOM 630 CD1 LEU A 44 8.797 -1.938 -3.640 1.00 0.00 C ATOM 631 CD2 LEU A 44 6.597 -3.097 -3.530 1.00 0.00 C ATOM 0 H LEU A 44 8.882 -6.218 -3.339 1.00 0.00 H new ATOM 0 HA LEU A 44 6.774 -5.246 -5.084 1.00 0.00 H new ATOM 0 HB2 LEU A 44 9.633 -4.325 -4.729 1.00 0.00 H new ATOM 0 HB3 LEU A 44 8.422 -3.527 -5.713 1.00 0.00 H new ATOM 0 HG LEU A 44 8.398 -3.874 -2.708 1.00 0.00 H new ATOM 0 HD11 LEU A 44 8.485 -1.347 -2.779 1.00 0.00 H new ATOM 0 HD12 LEU A 44 9.879 -2.070 -3.616 1.00 0.00 H new ATOM 0 HD13 LEU A 44 8.515 -1.421 -4.557 1.00 0.00 H new ATOM 0 HD21 LEU A 44 6.349 -2.510 -2.646 1.00 0.00 H new ATOM 0 HD22 LEU A 44 6.265 -2.566 -4.422 1.00 0.00 H new ATOM 0 HD23 LEU A 44 6.097 -4.064 -3.476 1.00 0.00 H new ATOM 643 N PRO A 45 7.794 -5.792 -7.475 1.00 0.00 N ATOM 644 CA PRO A 45 8.168 -6.375 -8.759 1.00 0.00 C ATOM 645 C PRO A 45 9.624 -6.117 -9.147 1.00 0.00 C ATOM 646 O PRO A 45 10.370 -5.397 -8.478 1.00 0.00 O ATOM 647 CB PRO A 45 7.207 -5.779 -9.797 1.00 0.00 C ATOM 648 CG PRO A 45 6.666 -4.511 -9.138 1.00 0.00 C ATOM 649 CD PRO A 45 6.741 -4.805 -7.645 1.00 0.00 C ATOM 0 HA PRO A 45 8.089 -7.461 -8.702 1.00 0.00 H new ATOM 0 HB2 PRO A 45 7.723 -5.552 -10.730 1.00 0.00 H new ATOM 0 HB3 PRO A 45 6.403 -6.474 -10.038 1.00 0.00 H new ATOM 0 HG2 PRO A 45 7.263 -3.639 -9.403 1.00 0.00 H new ATOM 0 HG3 PRO A 45 5.643 -4.304 -9.452 1.00 0.00 H new ATOM 0 HD2 PRO A 45 6.963 -3.899 -7.081 1.00 0.00 H new ATOM 0 HD3 PRO A 45 5.789 -5.185 -7.275 1.00 0.00 H new ATOM 657 N ALA A 46 9.990 -6.655 -10.312 1.00 0.00 N ATOM 658 CA ALA A 46 11.263 -6.437 -11.001 1.00 0.00 C ATOM 659 C ALA A 46 11.384 -5.011 -11.589 1.00 0.00 C ATOM 660 O ALA A 46 12.003 -4.811 -12.635 1.00 0.00 O ATOM 661 CB ALA A 46 11.421 -7.520 -12.079 1.00 0.00 C ATOM 0 H ALA A 46 9.375 -7.286 -10.826 1.00 0.00 H new ATOM 0 HA ALA A 46 12.076 -6.517 -10.279 1.00 0.00 H new ATOM 0 HB1 ALA A 46 12.365 -7.375 -12.605 1.00 0.00 H new ATOM 0 HB2 ALA A 46 11.414 -8.504 -11.610 1.00 0.00 H new ATOM 0 HB3 ALA A 46 10.596 -7.450 -12.788 1.00 0.00 H new ATOM 667 N SER A 47 10.779 -4.028 -10.927 1.00 0.00 N ATOM 668 CA SER A 47 10.612 -2.649 -11.342 1.00 0.00 C ATOM 669 C SER A 47 10.481 -1.822 -10.062 1.00 0.00 C ATOM 670 O SER A 47 9.736 -2.221 -9.164 1.00 0.00 O ATOM 671 CB SER A 47 9.345 -2.484 -12.192 1.00 0.00 C ATOM 672 OG SER A 47 9.269 -3.409 -13.266 1.00 0.00 O ATOM 0 H SER A 47 10.361 -4.196 -10.012 1.00 0.00 H new ATOM 0 HA SER A 47 11.459 -2.327 -11.948 1.00 0.00 H new ATOM 0 HB2 SER A 47 8.469 -2.604 -11.554 1.00 0.00 H new ATOM 0 HB3 SER A 47 9.312 -1.470 -12.591 1.00 0.00 H new ATOM 0 HG SER A 47 8.442 -3.258 -13.770 1.00 0.00 H new ATOM 678 N GLY A 48 11.191 -0.696 -9.959 1.00 0.00 N ATOM 679 CA GLY A 48 11.125 0.176 -8.788 1.00 0.00 C ATOM 680 C GLY A 48 12.507 0.383 -8.196 1.00 0.00 C ATOM 681 O GLY A 48 13.491 0.533 -8.924 1.00 0.00 O ATOM 0 H GLY A 48 11.826 -0.365 -10.685 1.00 0.00 H new ATOM 0 HA2 GLY A 48 10.696 1.138 -9.068 1.00 0.00 H new ATOM 0 HA3 GLY A 48 10.465 -0.261 -8.039 1.00 0.00 H new ATOM 685 N ILE A 49 12.569 0.362 -6.868 1.00 0.00 N ATOM 686 CA ILE A 49 13.791 0.468 -6.084 1.00 0.00 C ATOM 687 C ILE A 49 13.869 -0.805 -5.236 1.00 0.00 C ATOM 688 O ILE A 49 12.874 -1.215 -4.629 1.00 0.00 O ATOM 689 CB ILE A 49 13.753 1.723 -5.181 1.00 0.00 C ATOM 690 CG1 ILE A 49 13.165 3.007 -5.817 1.00 0.00 C ATOM 691 CG2 ILE A 49 15.145 2.014 -4.589 1.00 0.00 C ATOM 692 CD1 ILE A 49 13.958 3.600 -6.985 1.00 0.00 C ATOM 0 H ILE A 49 11.736 0.267 -6.288 1.00 0.00 H new ATOM 0 HA ILE A 49 14.665 0.567 -6.728 1.00 0.00 H new ATOM 0 HB ILE A 49 13.046 1.457 -4.395 1.00 0.00 H new ATOM 0 HG12 ILE A 49 12.155 2.788 -6.163 1.00 0.00 H new ATOM 0 HG13 ILE A 49 13.078 3.766 -5.040 1.00 0.00 H new ATOM 0 HG21 ILE A 49 15.094 2.901 -3.958 1.00 0.00 H new ATOM 0 HG22 ILE A 49 15.472 1.162 -3.993 1.00 0.00 H new ATOM 0 HG23 ILE A 49 15.856 2.185 -5.398 1.00 0.00 H new ATOM 0 HD11 ILE A 49 13.454 4.495 -7.350 1.00 0.00 H new ATOM 0 HD12 ILE A 49 14.961 3.861 -6.648 1.00 0.00 H new ATOM 0 HD13 ILE A 49 14.024 2.867 -7.789 1.00 0.00 H new ATOM 704 N TRP A 50 15.047 -1.417 -5.169 1.00 0.00 N ATOM 705 CA TRP A 50 15.330 -2.579 -4.345 1.00 0.00 C ATOM 706 C TRP A 50 16.537 -2.208 -3.492 1.00 0.00 C ATOM 707 O TRP A 50 17.491 -1.608 -3.991 1.00 0.00 O ATOM 708 CB TRP A 50 15.650 -3.789 -5.243 1.00 0.00 C ATOM 709 CG TRP A 50 14.509 -4.648 -5.739 1.00 0.00 C ATOM 710 CD1 TRP A 50 13.289 -4.228 -6.151 1.00 0.00 C ATOM 711 CD2 TRP A 50 14.508 -6.088 -6.004 1.00 0.00 C ATOM 712 NE1 TRP A 50 12.586 -5.269 -6.720 1.00 0.00 N ATOM 713 CE2 TRP A 50 13.321 -6.430 -6.716 1.00 0.00 C ATOM 714 CE3 TRP A 50 15.411 -7.138 -5.747 1.00 0.00 C ATOM 715 CZ2 TRP A 50 13.097 -7.712 -7.241 1.00 0.00 C ATOM 716 CZ3 TRP A 50 15.200 -8.434 -6.257 1.00 0.00 C ATOM 717 CH2 TRP A 50 14.058 -8.715 -7.027 1.00 0.00 C ATOM 0 H TRP A 50 15.856 -1.104 -5.706 1.00 0.00 H new ATOM 0 HA TRP A 50 14.479 -2.852 -3.721 1.00 0.00 H new ATOM 0 HB2 TRP A 50 16.189 -3.420 -6.116 1.00 0.00 H new ATOM 0 HB3 TRP A 50 16.336 -4.435 -4.695 1.00 0.00 H new ATOM 0 HD1 TRP A 50 12.919 -3.219 -6.048 1.00 0.00 H new ATOM 0 HE1 TRP A 50 11.641 -5.188 -7.096 1.00 0.00 H new ATOM 0 HE3 TRP A 50 16.286 -6.945 -5.144 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 12.199 -7.925 -7.802 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 15.918 -9.215 -6.056 1.00 0.00 H new ATOM 0 HH2 TRP A 50 13.920 -9.698 -7.453 1.00 0.00 H new ATOM 728 N LEU A 51 16.522 -2.589 -2.218 1.00 0.00 N ATOM 729 CA LEU A 51 17.657 -2.440 -1.318 1.00 0.00 C ATOM 730 C LEU A 51 17.902 -3.797 -0.679 1.00 0.00 C ATOM 731 O LEU A 51 16.954 -4.543 -0.420 1.00 0.00 O ATOM 732 CB LEU A 51 17.382 -1.384 -0.233 1.00 0.00 C ATOM 733 CG LEU A 51 17.233 0.071 -0.722 1.00 0.00 C ATOM 734 CD1 LEU A 51 16.959 0.972 0.487 1.00 0.00 C ATOM 735 CD2 LEU A 51 18.472 0.603 -1.448 1.00 0.00 C ATOM 0 H LEU A 51 15.708 -3.016 -1.777 1.00 0.00 H new ATOM 0 HA LEU A 51 18.531 -2.101 -1.874 1.00 0.00 H new ATOM 0 HB2 LEU A 51 16.470 -1.664 0.294 1.00 0.00 H new ATOM 0 HB3 LEU A 51 18.194 -1.420 0.494 1.00 0.00 H new ATOM 0 HG LEU A 51 16.410 0.080 -1.437 1.00 0.00 H new ATOM 0 HD11 LEU A 51 16.852 2.004 0.154 1.00 0.00 H new ATOM 0 HD12 LEU A 51 16.040 0.652 0.979 1.00 0.00 H new ATOM 0 HD13 LEU A 51 17.790 0.902 1.189 1.00 0.00 H new ATOM 0 HD21 LEU A 51 18.295 1.631 -1.763 1.00 0.00 H new ATOM 0 HD22 LEU A 51 19.329 0.572 -0.775 1.00 0.00 H new ATOM 0 HD23 LEU A 51 18.675 -0.015 -2.323 1.00 0.00 H new ATOM 747 N VAL A 52 19.164 -4.110 -0.399 1.00 0.00 N ATOM 748 CA VAL A 52 19.550 -5.384 0.199 1.00 0.00 C ATOM 749 C VAL A 52 20.539 -5.109 1.330 1.00 0.00 C ATOM 750 O VAL A 52 21.461 -4.307 1.169 1.00 0.00 O ATOM 751 CB VAL A 52 20.043 -6.353 -0.901 1.00 0.00 C ATOM 752 CG1 VAL A 52 21.199 -5.797 -1.751 1.00 0.00 C ATOM 753 CG2 VAL A 52 20.438 -7.720 -0.322 1.00 0.00 C ATOM 0 H VAL A 52 19.950 -3.485 -0.581 1.00 0.00 H new ATOM 0 HA VAL A 52 18.705 -5.898 0.657 1.00 0.00 H new ATOM 0 HB VAL A 52 19.188 -6.475 -1.566 1.00 0.00 H new ATOM 0 HG11 VAL A 52 21.488 -6.535 -2.499 1.00 0.00 H new ATOM 0 HG12 VAL A 52 20.877 -4.882 -2.249 1.00 0.00 H new ATOM 0 HG13 VAL A 52 22.052 -5.580 -1.108 1.00 0.00 H new ATOM 0 HG21 VAL A 52 20.779 -8.371 -1.127 1.00 0.00 H new ATOM 0 HG22 VAL A 52 21.241 -7.590 0.404 1.00 0.00 H new ATOM 0 HG23 VAL A 52 19.575 -8.170 0.169 1.00 0.00 H new ATOM 763 N ILE A 53 20.323 -5.747 2.480 1.00 0.00 N ATOM 764 CA ILE A 53 21.015 -5.478 3.730 1.00 0.00 C ATOM 765 C ILE A 53 21.581 -6.826 4.180 1.00 0.00 C ATOM 766 O ILE A 53 20.823 -7.736 4.526 1.00 0.00 O ATOM 767 CB ILE A 53 20.063 -4.837 4.779 1.00 0.00 C ATOM 768 CG1 ILE A 53 19.284 -3.590 4.283 1.00 0.00 C ATOM 769 CG2 ILE A 53 20.888 -4.416 6.011 1.00 0.00 C ATOM 770 CD1 ILE A 53 17.962 -3.871 3.554 1.00 0.00 C ATOM 0 H ILE A 53 19.633 -6.494 2.564 1.00 0.00 H new ATOM 0 HA ILE A 53 21.816 -4.749 3.608 1.00 0.00 H new ATOM 0 HB ILE A 53 19.320 -5.602 5.004 1.00 0.00 H new ATOM 0 HG12 ILE A 53 19.075 -2.951 5.141 1.00 0.00 H new ATOM 0 HG13 ILE A 53 19.932 -3.023 3.614 1.00 0.00 H new ATOM 0 HG21 ILE A 53 20.229 -3.965 6.753 1.00 0.00 H new ATOM 0 HG22 ILE A 53 21.373 -5.292 6.441 1.00 0.00 H new ATOM 0 HG23 ILE A 53 21.646 -3.692 5.711 1.00 0.00 H new ATOM 0 HD11 ILE A 53 17.505 -2.928 3.253 1.00 0.00 H new ATOM 0 HD12 ILE A 53 18.156 -4.479 2.670 1.00 0.00 H new ATOM 0 HD13 ILE A 53 17.285 -4.406 4.221 1.00 0.00 H new ATOM 782 N SER A 54 22.902 -7.000 4.099 1.00 0.00 N ATOM 783 CA SER A 54 23.595 -8.251 4.415 1.00 0.00 C ATOM 784 C SER A 54 25.058 -7.926 4.772 1.00 0.00 C ATOM 785 O SER A 54 25.380 -6.777 5.070 1.00 0.00 O ATOM 786 CB SER A 54 23.493 -9.226 3.222 1.00 0.00 C ATOM 787 OG SER A 54 22.168 -9.351 2.737 1.00 0.00 O ATOM 0 H SER A 54 23.535 -6.256 3.805 1.00 0.00 H new ATOM 0 HA SER A 54 23.131 -8.741 5.271 1.00 0.00 H new ATOM 0 HB2 SER A 54 24.140 -8.879 2.417 1.00 0.00 H new ATOM 0 HB3 SER A 54 23.860 -10.207 3.526 1.00 0.00 H new ATOM 0 HG SER A 54 22.162 -9.226 1.765 1.00 0.00 H new ATOM 793 N SER A 55 25.960 -8.909 4.763 1.00 0.00 N ATOM 794 CA SER A 55 27.409 -8.726 4.867 1.00 0.00 C ATOM 795 C SER A 55 28.047 -9.885 4.089 1.00 0.00 C ATOM 796 O SER A 55 27.483 -10.980 4.093 1.00 0.00 O ATOM 797 CB SER A 55 27.840 -8.712 6.341 1.00 0.00 C ATOM 798 OG SER A 55 27.190 -7.661 7.038 1.00 0.00 O ATOM 0 H SER A 55 25.692 -9.890 4.680 1.00 0.00 H new ATOM 0 HA SER A 55 27.730 -7.772 4.449 1.00 0.00 H new ATOM 0 HB2 SER A 55 27.599 -9.668 6.806 1.00 0.00 H new ATOM 0 HB3 SER A 55 28.921 -8.588 6.409 1.00 0.00 H new ATOM 0 HG SER A 55 26.622 -7.159 6.417 1.00 0.00 H new ATOM 804 N THR A 56 29.172 -9.668 3.396 1.00 0.00 N ATOM 805 CA THR A 56 29.732 -10.673 2.491 1.00 0.00 C ATOM 806 C THR A 56 31.211 -10.910 2.795 1.00 0.00 C ATOM 807 O THR A 56 31.537 -11.855 3.513 1.00 0.00 O ATOM 808 CB THR A 56 29.458 -10.267 1.031 1.00 0.00 C ATOM 809 OG1 THR A 56 29.888 -8.933 0.807 1.00 0.00 O ATOM 810 CG2 THR A 56 27.969 -10.352 0.692 1.00 0.00 C ATOM 0 H THR A 56 29.711 -8.804 3.447 1.00 0.00 H new ATOM 0 HA THR A 56 29.240 -11.633 2.649 1.00 0.00 H new ATOM 0 HB THR A 56 30.009 -10.961 0.396 1.00 0.00 H new ATOM 0 HG1 THR A 56 30.294 -8.865 -0.082 1.00 0.00 H new ATOM 0 HG21 THR A 56 27.815 -10.058 -0.346 1.00 0.00 H new ATOM 0 HG22 THR A 56 27.621 -11.375 0.835 1.00 0.00 H new ATOM 0 HG23 THR A 56 27.408 -9.683 1.345 1.00 0.00 H new ATOM 916 N ASN A 65 27.099 -15.552 0.839 1.00 0.00 N ATOM 917 CA ASN A 65 26.549 -15.294 2.171 1.00 0.00 C ATOM 918 C ASN A 65 25.057 -15.569 2.051 1.00 0.00 C ATOM 919 O ASN A 65 24.506 -16.376 2.799 1.00 0.00 O ATOM 920 CB ASN A 65 26.769 -13.858 2.660 1.00 0.00 C ATOM 921 CG ASN A 65 26.055 -13.640 3.983 1.00 0.00 C ATOM 922 OD1 ASN A 65 24.878 -13.297 4.018 1.00 0.00 O ATOM 923 ND2 ASN A 65 26.717 -13.857 5.100 1.00 0.00 N ATOM 0 HA ASN A 65 27.052 -15.927 2.902 1.00 0.00 H new ATOM 0 HB2 ASN A 65 27.835 -13.665 2.778 1.00 0.00 H new ATOM 0 HB3 ASN A 65 26.398 -13.152 1.917 1.00 0.00 H new ATOM 0 HD21 ASN A 65 26.251 -13.740 6.000 1.00 0.00 H new ATOM 0 HD22 ASN A 65 27.696 -14.142 5.066 1.00 0.00 H new ATOM 930 N LEU A 66 24.430 -14.939 1.046 1.00 0.00 N ATOM 931 CA LEU A 66 23.074 -15.262 0.634 1.00 0.00 C ATOM 932 C LEU A 66 23.112 -16.731 0.227 1.00 0.00 C ATOM 933 O LEU A 66 24.055 -17.108 -0.473 1.00 0.00 O ATOM 934 CB LEU A 66 22.624 -14.384 -0.557 1.00 0.00 C ATOM 935 CG LEU A 66 22.069 -13.004 -0.159 1.00 0.00 C ATOM 936 CD1 LEU A 66 23.148 -12.039 0.344 1.00 0.00 C ATOM 937 CD2 LEU A 66 21.342 -12.316 -1.316 1.00 0.00 C ATOM 0 H LEU A 66 24.858 -14.191 0.501 1.00 0.00 H new ATOM 0 HA LEU A 66 22.362 -15.077 1.438 1.00 0.00 H new ATOM 0 HB2 LEU A 66 23.472 -14.241 -1.227 1.00 0.00 H new ATOM 0 HB3 LEU A 66 21.860 -14.921 -1.119 1.00 0.00 H new ATOM 0 HG LEU A 66 21.373 -13.220 0.652 1.00 0.00 H new ATOM 0 HD11 LEU A 66 22.690 -11.086 0.607 1.00 0.00 H new ATOM 0 HD12 LEU A 66 23.634 -12.463 1.223 1.00 0.00 H new ATOM 0 HD13 LEU A 66 23.889 -11.881 -0.440 1.00 0.00 H new ATOM 0 HD21 LEU A 66 20.969 -11.346 -0.986 1.00 0.00 H new ATOM 0 HD22 LEU A 66 22.033 -12.175 -2.147 1.00 0.00 H new ATOM 0 HD23 LEU A 66 20.506 -12.936 -1.640 1.00 0.00 H new ATOM 949 N SER A 67 22.128 -17.546 0.632 1.00 0.00 N ATOM 950 CA SER A 67 22.147 -18.967 0.280 1.00 0.00 C ATOM 951 C SER A 67 20.879 -19.371 -0.483 1.00 0.00 C ATOM 952 O SER A 67 21.001 -19.637 -1.679 1.00 0.00 O ATOM 953 CB SER A 67 22.486 -19.821 1.512 1.00 0.00 C ATOM 954 OG SER A 67 23.739 -19.432 2.055 1.00 0.00 O ATOM 0 H SER A 67 21.327 -17.252 1.191 1.00 0.00 H new ATOM 0 HA SER A 67 22.952 -19.164 -0.428 1.00 0.00 H new ATOM 0 HB2 SER A 67 21.706 -19.710 2.265 1.00 0.00 H new ATOM 0 HB3 SER A 67 22.514 -20.875 1.235 1.00 0.00 H new ATOM 0 HG SER A 67 23.941 -19.983 2.840 1.00 0.00 H new ATOM 960 N PRO A 68 19.656 -19.323 0.084 1.00 0.00 N ATOM 961 CA PRO A 68 18.463 -19.684 -0.680 1.00 0.00 C ATOM 962 C PRO A 68 18.200 -18.642 -1.767 1.00 0.00 C ATOM 963 O PRO A 68 17.864 -18.981 -2.901 1.00 0.00 O ATOM 964 CB PRO A 68 17.334 -19.752 0.352 1.00 0.00 C ATOM 965 CG PRO A 68 17.771 -18.803 1.470 1.00 0.00 C ATOM 966 CD PRO A 68 19.300 -18.844 1.413 1.00 0.00 C ATOM 0 HA PRO A 68 18.563 -20.635 -1.202 1.00 0.00 H new ATOM 0 HB2 PRO A 68 16.383 -19.442 -0.081 1.00 0.00 H new ATOM 0 HB3 PRO A 68 17.199 -20.767 0.725 1.00 0.00 H new ATOM 0 HG2 PRO A 68 17.392 -17.794 1.308 1.00 0.00 H new ATOM 0 HG3 PRO A 68 17.399 -19.131 2.440 1.00 0.00 H new ATOM 0 HD2 PRO A 68 19.721 -17.855 1.594 1.00 0.00 H new ATOM 0 HD3 PRO A 68 19.699 -19.505 2.182 1.00 0.00 H new ATOM 974 N PHE A 69 18.417 -17.373 -1.421 1.00 0.00 N ATOM 975 CA PHE A 69 18.297 -16.237 -2.316 1.00 0.00 C ATOM 976 C PHE A 69 19.289 -16.372 -3.472 1.00 0.00 C ATOM 977 O PHE A 69 18.901 -16.216 -4.623 1.00 0.00 O ATOM 978 CB PHE A 69 18.538 -14.962 -1.488 1.00 0.00 C ATOM 979 CG PHE A 69 17.537 -14.640 -0.381 1.00 0.00 C ATOM 980 CD1 PHE A 69 16.359 -15.395 -0.175 1.00 0.00 C ATOM 981 CD2 PHE A 69 17.796 -13.539 0.458 1.00 0.00 C ATOM 982 CE1 PHE A 69 15.471 -15.060 0.861 1.00 0.00 C ATOM 983 CE2 PHE A 69 16.904 -13.205 1.491 1.00 0.00 C ATOM 984 CZ PHE A 69 15.746 -13.968 1.695 1.00 0.00 C ATOM 0 H PHE A 69 18.690 -17.105 -0.475 1.00 0.00 H new ATOM 0 HA PHE A 69 17.304 -16.189 -2.762 1.00 0.00 H new ATOM 0 HB2 PHE A 69 19.527 -15.037 -1.036 1.00 0.00 H new ATOM 0 HB3 PHE A 69 18.564 -14.115 -2.174 1.00 0.00 H new ATOM 0 HD1 PHE A 69 16.141 -16.235 -0.818 1.00 0.00 H new ATOM 0 HD2 PHE A 69 18.687 -12.947 0.306 1.00 0.00 H new ATOM 0 HE1 PHE A 69 14.576 -15.644 1.015 1.00 0.00 H new ATOM 0 HE2 PHE A 69 17.111 -12.359 2.129 1.00 0.00 H new ATOM 0 HZ PHE A 69 15.066 -13.714 2.495 1.00 0.00 H new ATOM 994 N TYR A 70 20.547 -16.710 -3.179 1.00 0.00 N ATOM 995 CA TYR A 70 21.602 -16.896 -4.172 1.00 0.00 C ATOM 996 C TYR A 70 21.186 -17.948 -5.201 1.00 0.00 C ATOM 997 O TYR A 70 21.220 -17.663 -6.396 1.00 0.00 O ATOM 998 CB TYR A 70 22.913 -17.248 -3.461 1.00 0.00 C ATOM 999 CG TYR A 70 24.170 -17.298 -4.313 1.00 0.00 C ATOM 1000 CD1 TYR A 70 24.434 -18.407 -5.141 1.00 0.00 C ATOM 1001 CD2 TYR A 70 25.123 -16.263 -4.219 1.00 0.00 C ATOM 1002 CE1 TYR A 70 25.627 -18.471 -5.885 1.00 0.00 C ATOM 1003 CE2 TYR A 70 26.307 -16.311 -4.975 1.00 0.00 C ATOM 1004 CZ TYR A 70 26.568 -17.417 -5.813 1.00 0.00 C ATOM 1005 OH TYR A 70 27.727 -17.458 -6.529 1.00 0.00 O ATOM 0 H TYR A 70 20.865 -16.865 -2.222 1.00 0.00 H new ATOM 0 HA TYR A 70 21.765 -15.970 -4.724 1.00 0.00 H new ATOM 0 HB2 TYR A 70 23.072 -16.520 -2.665 1.00 0.00 H new ATOM 0 HB3 TYR A 70 22.789 -18.220 -2.984 1.00 0.00 H new ATOM 0 HD1 TYR A 70 23.717 -19.212 -5.205 1.00 0.00 H new ATOM 0 HD2 TYR A 70 24.942 -15.426 -3.561 1.00 0.00 H new ATOM 0 HE1 TYR A 70 25.825 -19.327 -6.513 1.00 0.00 H new ATOM 0 HE2 TYR A 70 27.018 -15.501 -4.915 1.00 0.00 H new ATOM 0 HH TYR A 70 27.839 -16.616 -7.018 1.00 0.00 H new ATOM 1015 N GLU A 71 20.743 -19.135 -4.768 1.00 0.00 N ATOM 1016 CA GLU A 71 20.307 -20.170 -5.697 1.00 0.00 C ATOM 1017 C GLU A 71 19.079 -19.712 -6.492 1.00 0.00 C ATOM 1018 O GLU A 71 19.057 -19.859 -7.716 1.00 0.00 O ATOM 1019 CB GLU A 71 20.023 -21.486 -4.954 1.00 0.00 C ATOM 1020 CG GLU A 71 21.271 -22.018 -4.243 1.00 0.00 C ATOM 1021 CD GLU A 71 21.160 -23.521 -3.927 1.00 0.00 C ATOM 1022 OE1 GLU A 71 20.529 -23.896 -2.913 1.00 0.00 O ATOM 1023 OE2 GLU A 71 21.719 -24.348 -4.684 1.00 0.00 O ATOM 0 H GLU A 71 20.679 -19.396 -3.784 1.00 0.00 H new ATOM 0 HA GLU A 71 21.115 -20.350 -6.406 1.00 0.00 H new ATOM 0 HB2 GLU A 71 19.229 -21.328 -4.225 1.00 0.00 H new ATOM 0 HB3 GLU A 71 19.662 -22.232 -5.662 1.00 0.00 H new ATOM 0 HG2 GLU A 71 22.146 -21.843 -4.868 1.00 0.00 H new ATOM 0 HG3 GLU A 71 21.425 -21.464 -3.317 1.00 0.00 H new ATOM 1030 N ALA A 72 18.083 -19.117 -5.823 1.00 0.00 N ATOM 1031 CA ALA A 72 16.868 -18.643 -6.481 1.00 0.00 C ATOM 1032 C ALA A 72 17.169 -17.593 -7.553 1.00 0.00 C ATOM 1033 O ALA A 72 16.549 -17.615 -8.613 1.00 0.00 O ATOM 1034 CB ALA A 72 15.891 -18.073 -5.448 1.00 0.00 C ATOM 0 H ALA A 72 18.100 -18.953 -4.816 1.00 0.00 H new ATOM 0 HA ALA A 72 16.412 -19.500 -6.977 1.00 0.00 H new ATOM 0 HB1 ALA A 72 14.990 -17.724 -5.953 1.00 0.00 H new ATOM 0 HB2 ALA A 72 15.627 -18.849 -4.730 1.00 0.00 H new ATOM 0 HB3 ALA A 72 16.360 -17.240 -4.925 1.00 0.00 H new ATOM 1040 N LEU A 73 18.124 -16.691 -7.309 1.00 0.00 N ATOM 1041 CA LEU A 73 18.495 -15.648 -8.251 1.00 0.00 C ATOM 1042 C LEU A 73 18.922 -16.263 -9.568 1.00 0.00 C ATOM 1043 O LEU A 73 18.335 -15.953 -10.601 1.00 0.00 O ATOM 1044 CB LEU A 73 19.632 -14.796 -7.666 1.00 0.00 C ATOM 1045 CG LEU A 73 19.138 -13.707 -6.699 1.00 0.00 C ATOM 1046 CD1 LEU A 73 20.343 -13.028 -6.054 1.00 0.00 C ATOM 1047 CD2 LEU A 73 18.260 -12.648 -7.376 1.00 0.00 C ATOM 0 H LEU A 73 18.662 -16.670 -6.443 1.00 0.00 H new ATOM 0 HA LEU A 73 17.632 -15.007 -8.431 1.00 0.00 H new ATOM 0 HB2 LEU A 73 20.332 -15.447 -7.143 1.00 0.00 H new ATOM 0 HB3 LEU A 73 20.182 -14.326 -8.482 1.00 0.00 H new ATOM 0 HG LEU A 73 18.517 -14.200 -5.951 1.00 0.00 H new ATOM 0 HD11 LEU A 73 20.000 -12.254 -5.367 1.00 0.00 H new ATOM 0 HD12 LEU A 73 20.927 -13.767 -5.506 1.00 0.00 H new ATOM 0 HD13 LEU A 73 20.964 -12.577 -6.828 1.00 0.00 H new ATOM 0 HD21 LEU A 73 17.946 -11.910 -6.638 1.00 0.00 H new ATOM 0 HD22 LEU A 73 18.828 -12.154 -8.164 1.00 0.00 H new ATOM 0 HD23 LEU A 73 17.381 -13.126 -7.808 1.00 0.00 H new ATOM 1059 N GLN A 74 19.903 -17.163 -9.536 1.00 0.00 N ATOM 1060 CA GLN A 74 20.415 -17.775 -10.764 1.00 0.00 C ATOM 1061 C GLN A 74 19.390 -18.702 -11.422 1.00 0.00 C ATOM 1062 O GLN A 74 19.513 -18.999 -12.611 1.00 0.00 O ATOM 1063 CB GLN A 74 21.769 -18.479 -10.572 1.00 0.00 C ATOM 1064 CG GLN A 74 22.679 -17.806 -9.547 1.00 0.00 C ATOM 1065 CD GLN A 74 24.075 -18.394 -9.642 1.00 0.00 C ATOM 1066 OE1 GLN A 74 24.480 -19.252 -8.863 1.00 0.00 O ATOM 1067 NE2 GLN A 74 24.818 -17.981 -10.648 1.00 0.00 N ATOM 0 H GLN A 74 20.357 -17.484 -8.681 1.00 0.00 H new ATOM 0 HA GLN A 74 20.593 -16.946 -11.449 1.00 0.00 H new ATOM 0 HB2 GLN A 74 21.591 -19.509 -10.263 1.00 0.00 H new ATOM 0 HB3 GLN A 74 22.286 -18.518 -11.531 1.00 0.00 H new ATOM 0 HG2 GLN A 74 22.713 -16.731 -9.726 1.00 0.00 H new ATOM 0 HG3 GLN A 74 22.281 -17.949 -8.543 1.00 0.00 H new ATOM 0 HE21 GLN A 74 24.463 -17.267 -11.284 1.00 0.00 H new ATOM 0 HE22 GLN A 74 25.748 -18.375 -10.791 1.00 0.00 H new ATOM 1076 N GLU A 75 18.378 -19.151 -10.675 1.00 0.00 N ATOM 1077 CA GLU A 75 17.348 -20.035 -11.199 1.00 0.00 C ATOM 1078 C GLU A 75 16.397 -19.288 -12.146 1.00 0.00 C ATOM 1079 O GLU A 75 15.933 -19.880 -13.123 1.00 0.00 O ATOM 1080 CB GLU A 75 16.597 -20.708 -10.042 1.00 0.00 C ATOM 1081 CG GLU A 75 15.691 -21.857 -10.505 1.00 0.00 C ATOM 1082 CD GLU A 75 15.054 -22.592 -9.313 1.00 0.00 C ATOM 1083 OE1 GLU A 75 13.993 -22.153 -8.814 1.00 0.00 O ATOM 1084 OE2 GLU A 75 15.591 -23.638 -8.877 1.00 0.00 O ATOM 0 H GLU A 75 18.255 -18.909 -9.692 1.00 0.00 H new ATOM 0 HA GLU A 75 17.825 -20.816 -11.792 1.00 0.00 H new ATOM 0 HB2 GLU A 75 17.319 -21.090 -9.320 1.00 0.00 H new ATOM 0 HB3 GLU A 75 15.993 -19.962 -9.525 1.00 0.00 H new ATOM 0 HG2 GLU A 75 14.907 -21.464 -11.152 1.00 0.00 H new ATOM 0 HG3 GLU A 75 16.272 -22.562 -11.100 1.00 0.00 H new ATOM 1091 N GLN A 76 16.137 -17.995 -11.898 1.00 0.00 N ATOM 1092 CA GLN A 76 15.155 -17.215 -12.662 1.00 0.00 C ATOM 1093 C GLN A 76 15.730 -15.983 -13.375 1.00 0.00 C ATOM 1094 O GLN A 76 15.159 -15.583 -14.390 1.00 0.00 O ATOM 1095 CB GLN A 76 13.938 -16.835 -11.794 1.00 0.00 C ATOM 1096 CG GLN A 76 14.280 -16.284 -10.396 1.00 0.00 C ATOM 1097 CD GLN A 76 13.257 -15.294 -9.826 1.00 0.00 C ATOM 1098 OE1 GLN A 76 12.136 -15.149 -10.309 1.00 0.00 O ATOM 1099 NE2 GLN A 76 13.638 -14.572 -8.786 1.00 0.00 N ATOM 0 H GLN A 76 16.602 -17.463 -11.163 1.00 0.00 H new ATOM 0 HA GLN A 76 14.827 -17.882 -13.459 1.00 0.00 H new ATOM 0 HB2 GLN A 76 13.349 -16.089 -12.328 1.00 0.00 H new ATOM 0 HB3 GLN A 76 13.306 -17.715 -11.676 1.00 0.00 H new ATOM 0 HG2 GLN A 76 14.378 -17.121 -9.705 1.00 0.00 H new ATOM 0 HG3 GLN A 76 15.252 -15.793 -10.442 1.00 0.00 H new ATOM 0 HE21 GLN A 76 14.570 -14.699 -8.391 1.00 0.00 H new ATOM 0 HE22 GLN A 76 13.000 -13.888 -8.378 1.00 0.00 H new ATOM 1108 N LYS A 77 16.843 -15.407 -12.894 1.00 0.00 N ATOM 1109 CA LYS A 77 17.505 -14.197 -13.418 1.00 0.00 C ATOM 1110 C LYS A 77 16.511 -13.180 -14.022 1.00 0.00 C ATOM 1111 O LYS A 77 16.529 -12.964 -15.240 1.00 0.00 O ATOM 1112 CB LYS A 77 18.635 -14.592 -14.385 1.00 0.00 C ATOM 1113 CG LYS A 77 19.748 -15.376 -13.681 1.00 0.00 C ATOM 1114 CD LYS A 77 20.860 -15.854 -14.623 1.00 0.00 C ATOM 1115 CE LYS A 77 20.380 -16.993 -15.528 1.00 0.00 C ATOM 1116 NZ LYS A 77 21.459 -17.517 -16.403 1.00 0.00 N ATOM 0 H LYS A 77 17.333 -15.792 -12.086 1.00 0.00 H new ATOM 0 HA LYS A 77 17.957 -13.668 -12.579 1.00 0.00 H new ATOM 0 HB2 LYS A 77 18.224 -15.195 -15.195 1.00 0.00 H new ATOM 0 HB3 LYS A 77 19.055 -13.694 -14.837 1.00 0.00 H new ATOM 0 HG2 LYS A 77 20.187 -14.748 -12.905 1.00 0.00 H new ATOM 0 HG3 LYS A 77 19.311 -16.241 -13.182 1.00 0.00 H new ATOM 0 HD2 LYS A 77 21.202 -15.020 -15.236 1.00 0.00 H new ATOM 0 HD3 LYS A 77 21.715 -16.190 -14.037 1.00 0.00 H new ATOM 0 HE2 LYS A 77 19.991 -17.803 -14.911 1.00 0.00 H new ATOM 0 HE3 LYS A 77 19.555 -16.639 -16.146 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 21.084 -18.285 -16.995 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 21.814 -16.752 -17.012 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 22.236 -17.881 -15.816 1.00 0.00 H new ATOM 1130 N PRO A 78 15.588 -12.621 -13.211 1.00 0.00 N ATOM 1131 CA PRO A 78 14.475 -11.821 -13.707 1.00 0.00 C ATOM 1132 C PRO A 78 14.916 -10.533 -14.403 1.00 0.00 C ATOM 1133 O PRO A 78 16.062 -10.096 -14.303 1.00 0.00 O ATOM 1134 CB PRO A 78 13.568 -11.541 -12.504 1.00 0.00 C ATOM 1135 CG PRO A 78 14.458 -11.776 -11.286 1.00 0.00 C ATOM 1136 CD PRO A 78 15.504 -12.778 -11.767 1.00 0.00 C ATOM 0 HA PRO A 78 13.943 -12.372 -14.482 1.00 0.00 H new ATOM 0 HB2 PRO A 78 13.186 -10.520 -12.525 1.00 0.00 H new ATOM 0 HB3 PRO A 78 12.703 -12.205 -12.497 1.00 0.00 H new ATOM 0 HG2 PRO A 78 14.922 -10.849 -10.948 1.00 0.00 H new ATOM 0 HG3 PRO A 78 13.886 -12.171 -10.446 1.00 0.00 H new ATOM 0 HD2 PRO A 78 16.469 -12.587 -11.299 1.00 0.00 H new ATOM 0 HD3 PRO A 78 15.217 -13.796 -11.503 1.00 0.00 H new ATOM 1144 N ASP A 79 13.964 -9.905 -15.094 1.00 0.00 N ATOM 1145 CA ASP A 79 14.166 -8.708 -15.912 1.00 0.00 C ATOM 1146 C ASP A 79 14.233 -7.446 -15.050 1.00 0.00 C ATOM 1147 O ASP A 79 13.381 -6.562 -15.124 1.00 0.00 O ATOM 1148 CB ASP A 79 13.088 -8.629 -17.005 1.00 0.00 C ATOM 1149 CG ASP A 79 13.291 -7.420 -17.934 1.00 0.00 C ATOM 1150 OD1 ASP A 79 14.455 -7.084 -18.249 1.00 0.00 O ATOM 1151 OD2 ASP A 79 12.286 -6.835 -18.397 1.00 0.00 O ATOM 0 H ASP A 79 12.996 -10.227 -15.100 1.00 0.00 H new ATOM 0 HA ASP A 79 15.132 -8.779 -16.412 1.00 0.00 H new ATOM 0 HB2 ASP A 79 13.103 -9.545 -17.595 1.00 0.00 H new ATOM 0 HB3 ASP A 79 12.105 -8.566 -16.539 1.00 0.00 H new ATOM 1156 N LEU A 80 15.255 -7.378 -14.195 1.00 0.00 N ATOM 1157 CA LEU A 80 15.492 -6.273 -13.263 1.00 0.00 C ATOM 1158 C LEU A 80 15.925 -4.975 -13.975 1.00 0.00 C ATOM 1159 O LEU A 80 16.319 -4.009 -13.331 1.00 0.00 O ATOM 1160 CB LEU A 80 16.564 -6.661 -12.231 1.00 0.00 C ATOM 1161 CG LEU A 80 16.235 -7.594 -11.040 1.00 0.00 C ATOM 1162 CD1 LEU A 80 14.753 -7.919 -10.856 1.00 0.00 C ATOM 1163 CD2 LEU A 80 17.056 -8.883 -11.106 1.00 0.00 C ATOM 0 H LEU A 80 15.961 -8.111 -14.130 1.00 0.00 H new ATOM 0 HA LEU A 80 14.541 -6.081 -12.766 1.00 0.00 H new ATOM 0 HB2 LEU A 80 17.382 -7.126 -12.782 1.00 0.00 H new ATOM 0 HB3 LEU A 80 16.950 -5.733 -11.810 1.00 0.00 H new ATOM 0 HG LEU A 80 16.516 -7.017 -10.159 1.00 0.00 H new ATOM 0 HD11 LEU A 80 14.629 -8.578 -9.997 1.00 0.00 H new ATOM 0 HD12 LEU A 80 14.196 -6.997 -10.690 1.00 0.00 H new ATOM 0 HD13 LEU A 80 14.375 -8.414 -11.750 1.00 0.00 H new ATOM 0 HD21 LEU A 80 16.804 -9.519 -10.257 1.00 0.00 H new ATOM 0 HD22 LEU A 80 16.832 -9.410 -12.033 1.00 0.00 H new ATOM 0 HD23 LEU A 80 18.118 -8.640 -11.075 1.00 0.00 H new ATOM 1175 N SER A 81 15.872 -4.908 -15.298 1.00 0.00 N ATOM 1176 CA SER A 81 16.236 -3.812 -16.158 1.00 0.00 C ATOM 1177 C SER A 81 15.385 -2.558 -15.920 1.00 0.00 C ATOM 1178 O SER A 81 15.665 -1.501 -16.490 1.00 0.00 O ATOM 1179 CB SER A 81 16.033 -4.354 -17.574 1.00 0.00 C ATOM 1180 OG SER A 81 16.543 -5.669 -17.733 1.00 0.00 O ATOM 0 H SER A 81 15.538 -5.704 -15.841 1.00 0.00 H new ATOM 0 HA SER A 81 17.259 -3.488 -15.969 1.00 0.00 H new ATOM 0 HB2 SER A 81 14.969 -4.350 -17.812 1.00 0.00 H new ATOM 0 HB3 SER A 81 16.522 -3.690 -18.287 1.00 0.00 H new ATOM 0 HG SER A 81 15.823 -6.266 -18.027 1.00 0.00 H new ATOM 1186 N ALA A 82 14.354 -2.678 -15.078 1.00 0.00 N ATOM 1187 CA ALA A 82 13.459 -1.598 -14.685 1.00 0.00 C ATOM 1188 C ALA A 82 13.634 -1.247 -13.201 1.00 0.00 C ATOM 1189 O ALA A 82 12.832 -0.479 -12.661 1.00 0.00 O ATOM 1190 CB ALA A 82 12.017 -1.992 -15.029 1.00 0.00 C ATOM 0 H ALA A 82 14.115 -3.566 -14.637 1.00 0.00 H new ATOM 0 HA ALA A 82 13.708 -0.694 -15.240 1.00 0.00 H new ATOM 0 HB1 ALA A 82 11.341 -1.188 -14.738 1.00 0.00 H new ATOM 0 HB2 ALA A 82 11.933 -2.166 -16.102 1.00 0.00 H new ATOM 0 HB3 ALA A 82 11.751 -2.903 -14.492 1.00 0.00 H new ATOM 1196 N VAL A 83 14.655 -1.790 -12.525 1.00 0.00 N ATOM 1197 CA VAL A 83 14.916 -1.485 -11.115 1.00 0.00 C ATOM 1198 C VAL A 83 16.384 -1.125 -10.857 1.00 0.00 C ATOM 1199 O VAL A 83 17.287 -1.534 -11.589 1.00 0.00 O ATOM 1200 CB VAL A 83 14.340 -2.604 -10.214 1.00 0.00 C ATOM 1201 CG1 VAL A 83 14.660 -4.026 -10.678 1.00 0.00 C ATOM 1202 CG2 VAL A 83 14.781 -2.555 -8.751 1.00 0.00 C ATOM 0 H VAL A 83 15.317 -2.447 -12.937 1.00 0.00 H new ATOM 0 HA VAL A 83 14.384 -0.575 -10.839 1.00 0.00 H new ATOM 0 HB VAL A 83 13.275 -2.390 -10.302 1.00 0.00 H new ATOM 0 HG11 VAL A 83 14.217 -4.743 -9.987 1.00 0.00 H new ATOM 0 HG12 VAL A 83 14.251 -4.184 -11.676 1.00 0.00 H new ATOM 0 HG13 VAL A 83 15.741 -4.166 -10.702 1.00 0.00 H new ATOM 0 HG21 VAL A 83 14.323 -3.380 -8.205 1.00 0.00 H new ATOM 0 HG22 VAL A 83 15.866 -2.640 -8.695 1.00 0.00 H new ATOM 0 HG23 VAL A 83 14.468 -1.609 -8.308 1.00 0.00 H new ATOM 1212 N ARG A 84 16.617 -0.351 -9.790 1.00 0.00 N ATOM 1213 CA ARG A 84 17.945 -0.042 -9.266 1.00 0.00 C ATOM 1214 C ARG A 84 18.130 -0.771 -7.937 1.00 0.00 C ATOM 1215 O ARG A 84 17.160 -0.961 -7.202 1.00 0.00 O ATOM 1216 CB ARG A 84 18.125 1.483 -9.139 1.00 0.00 C ATOM 1217 CG ARG A 84 17.470 2.109 -7.888 1.00 0.00 C ATOM 1218 CD ARG A 84 17.403 3.642 -7.933 1.00 0.00 C ATOM 1219 NE ARG A 84 18.694 4.239 -8.307 1.00 0.00 N ATOM 1220 CZ ARG A 84 18.879 5.126 -9.297 1.00 0.00 C ATOM 1221 NH1 ARG A 84 17.868 5.848 -9.776 1.00 0.00 N ATOM 1222 NH2 ARG A 84 20.094 5.266 -9.810 1.00 0.00 N ATOM 0 H ARG A 84 15.866 0.087 -9.257 1.00 0.00 H new ATOM 0 HA ARG A 84 18.719 -0.389 -9.951 1.00 0.00 H new ATOM 0 HB2 ARG A 84 19.191 1.709 -9.126 1.00 0.00 H new ATOM 0 HB3 ARG A 84 17.709 1.959 -10.027 1.00 0.00 H new ATOM 0 HG2 ARG A 84 16.461 1.712 -7.779 1.00 0.00 H new ATOM 0 HG3 ARG A 84 18.029 1.804 -7.004 1.00 0.00 H new ATOM 0 HD2 ARG A 84 16.640 3.951 -8.648 1.00 0.00 H new ATOM 0 HD3 ARG A 84 17.098 4.020 -6.957 1.00 0.00 H new ATOM 0 HE ARG A 84 19.514 3.956 -7.771 1.00 0.00 H new ATOM 0 HH11 ARG A 84 16.931 5.732 -9.390 1.00 0.00 H new ATOM 0 HH12 ARG A 84 18.031 6.517 -10.529 1.00 0.00 H new ATOM 0 HH21 ARG A 84 20.867 4.705 -9.451 1.00 0.00 H new ATOM 0 HH22 ARG A 84 20.256 5.935 -10.563 1.00 0.00 H new ATOM 1236 N PHE A 85 19.367 -1.140 -7.626 1.00 0.00 N ATOM 1237 CA PHE A 85 19.751 -1.827 -6.399 1.00 0.00 C ATOM 1238 C PHE A 85 20.552 -0.851 -5.541 1.00 0.00 C ATOM 1239 O PHE A 85 21.251 0.023 -6.070 1.00 0.00 O ATOM 1240 CB PHE A 85 20.622 -3.047 -6.750 1.00 0.00 C ATOM 1241 CG PHE A 85 19.949 -4.367 -6.448 1.00 0.00 C ATOM 1242 CD1 PHE A 85 18.884 -4.812 -7.254 1.00 0.00 C ATOM 1243 CD2 PHE A 85 20.381 -5.151 -5.362 1.00 0.00 C ATOM 1244 CE1 PHE A 85 18.290 -6.060 -7.008 1.00 0.00 C ATOM 1245 CE2 PHE A 85 19.768 -6.388 -5.101 1.00 0.00 C ATOM 1246 CZ PHE A 85 18.743 -6.853 -5.941 1.00 0.00 C ATOM 0 H PHE A 85 20.159 -0.962 -8.244 1.00 0.00 H new ATOM 0 HA PHE A 85 18.868 -2.167 -5.857 1.00 0.00 H new ATOM 0 HB2 PHE A 85 20.877 -3.011 -7.809 1.00 0.00 H new ATOM 0 HB3 PHE A 85 21.558 -2.989 -6.195 1.00 0.00 H new ATOM 0 HD1 PHE A 85 18.524 -4.193 -8.062 1.00 0.00 H new ATOM 0 HD2 PHE A 85 21.184 -4.802 -4.729 1.00 0.00 H new ATOM 0 HE1 PHE A 85 17.486 -6.410 -7.638 1.00 0.00 H new ATOM 0 HE2 PHE A 85 20.085 -6.981 -4.255 1.00 0.00 H new ATOM 0 HZ PHE A 85 18.302 -7.823 -5.766 1.00 0.00 H new ATOM 1256 N GLY A 86 20.534 -1.062 -4.227 1.00 0.00 N ATOM 1257 CA GLY A 86 21.400 -0.374 -3.288 1.00 0.00 C ATOM 1258 C GLY A 86 21.787 -1.406 -2.240 1.00 0.00 C ATOM 1259 O GLY A 86 20.937 -1.852 -1.466 1.00 0.00 O ATOM 0 H GLY A 86 19.904 -1.729 -3.782 1.00 0.00 H new ATOM 0 HA2 GLY A 86 22.283 0.022 -3.790 1.00 0.00 H new ATOM 0 HA3 GLY A 86 20.886 0.472 -2.831 1.00 0.00 H new ATOM 1263 N ALA A 87 23.036 -1.873 -2.286 1.00 0.00 N ATOM 1264 CA ALA A 87 23.548 -2.851 -1.338 1.00 0.00 C ATOM 1265 C ALA A 87 24.042 -2.121 -0.092 1.00 0.00 C ATOM 1266 O ALA A 87 24.633 -1.046 -0.199 1.00 0.00 O ATOM 1267 CB ALA A 87 24.676 -3.648 -1.999 1.00 0.00 C ATOM 0 H ALA A 87 23.719 -1.580 -2.985 1.00 0.00 H new ATOM 0 HA ALA A 87 22.764 -3.548 -1.043 1.00 0.00 H new ATOM 0 HB1 ALA A 87 25.064 -4.383 -1.294 1.00 0.00 H new ATOM 0 HB2 ALA A 87 24.291 -4.160 -2.881 1.00 0.00 H new ATOM 0 HB3 ALA A 87 25.477 -2.970 -2.293 1.00 0.00 H new ATOM 1273 N ILE A 88 23.819 -2.709 1.083 1.00 0.00 N ATOM 1274 CA ILE A 88 24.030 -2.066 2.372 1.00 0.00 C ATOM 1275 C ILE A 88 24.643 -3.109 3.308 1.00 0.00 C ATOM 1276 O ILE A 88 24.176 -4.248 3.358 1.00 0.00 O ATOM 1277 CB ILE A 88 22.682 -1.522 2.918 1.00 0.00 C ATOM 1278 CG1 ILE A 88 21.939 -0.638 1.881 1.00 0.00 C ATOM 1279 CG2 ILE A 88 22.935 -0.815 4.264 1.00 0.00 C ATOM 1280 CD1 ILE A 88 20.619 -0.010 2.339 1.00 0.00 C ATOM 0 H ILE A 88 23.479 -3.667 1.163 1.00 0.00 H new ATOM 0 HA ILE A 88 24.705 -1.214 2.286 1.00 0.00 H new ATOM 0 HB ILE A 88 22.002 -2.355 3.098 1.00 0.00 H new ATOM 0 HG12 ILE A 88 22.610 0.164 1.574 1.00 0.00 H new ATOM 0 HG13 ILE A 88 21.740 -1.244 0.997 1.00 0.00 H new ATOM 0 HG21 ILE A 88 21.993 -0.430 4.655 1.00 0.00 H new ATOM 0 HG22 ILE A 88 23.359 -1.525 4.974 1.00 0.00 H new ATOM 0 HG23 ILE A 88 23.631 0.010 4.116 1.00 0.00 H new ATOM 0 HD11 ILE A 88 20.197 0.583 1.527 1.00 0.00 H new ATOM 0 HD12 ILE A 88 19.918 -0.798 2.615 1.00 0.00 H new ATOM 0 HD13 ILE A 88 20.801 0.632 3.201 1.00 0.00 H new ATOM 1292 N GLY A 89 25.709 -2.740 4.025 1.00 0.00 N ATOM 1293 CA GLY A 89 26.400 -3.598 4.991 1.00 0.00 C ATOM 1294 C GLY A 89 27.307 -4.642 4.325 1.00 0.00 C ATOM 1295 O GLY A 89 28.326 -5.034 4.896 1.00 0.00 O ATOM 0 H GLY A 89 26.125 -1.812 3.947 1.00 0.00 H new ATOM 0 HA2 GLY A 89 26.999 -2.977 5.657 1.00 0.00 H new ATOM 0 HA3 GLY A 89 25.661 -4.108 5.609 1.00 0.00 H new ATOM 1299 N ILE A 90 26.952 -5.051 3.105 1.00 0.00 N ATOM 1300 CA ILE A 90 27.726 -5.876 2.193 1.00 0.00 C ATOM 1301 C ILE A 90 29.151 -5.298 2.089 1.00 0.00 C ATOM 1302 O ILE A 90 29.346 -4.081 2.115 1.00 0.00 O ATOM 1303 CB ILE A 90 26.915 -5.987 0.875 1.00 0.00 C ATOM 1304 CG1 ILE A 90 25.619 -6.791 1.154 1.00 0.00 C ATOM 1305 CG2 ILE A 90 27.712 -6.583 -0.290 1.00 0.00 C ATOM 1306 CD1 ILE A 90 24.789 -7.229 -0.060 1.00 0.00 C ATOM 0 H ILE A 90 26.050 -4.792 2.706 1.00 0.00 H new ATOM 0 HA ILE A 90 27.880 -6.900 2.533 1.00 0.00 H new ATOM 0 HB ILE A 90 26.665 -4.977 0.550 1.00 0.00 H new ATOM 0 HG12 ILE A 90 25.890 -7.684 1.717 1.00 0.00 H new ATOM 0 HG13 ILE A 90 24.980 -6.188 1.800 1.00 0.00 H new ATOM 0 HG21 ILE A 90 27.080 -6.629 -1.177 1.00 0.00 H new ATOM 0 HG22 ILE A 90 28.580 -5.957 -0.495 1.00 0.00 H new ATOM 0 HG23 ILE A 90 28.044 -7.588 -0.028 1.00 0.00 H new ATOM 0 HD11 ILE A 90 23.912 -7.781 0.279 1.00 0.00 H new ATOM 0 HD12 ILE A 90 24.470 -6.349 -0.619 1.00 0.00 H new ATOM 0 HD13 ILE A 90 25.394 -7.868 -0.703 1.00 0.00 H new ATOM 1318 N GLY A 91 30.152 -6.179 2.008 1.00 0.00 N ATOM 1319 CA GLY A 91 31.554 -5.774 1.906 1.00 0.00 C ATOM 1320 C GLY A 91 31.938 -5.578 0.443 1.00 0.00 C ATOM 1321 O GLY A 91 32.669 -4.649 0.100 1.00 0.00 O ATOM 0 H GLY A 91 30.013 -7.189 2.011 1.00 0.00 H new ATOM 0 HA2 GLY A 91 31.714 -4.849 2.459 1.00 0.00 H new ATOM 0 HA3 GLY A 91 32.193 -6.531 2.360 1.00 0.00 H new ATOM 1325 N SER A 92 31.380 -6.435 -0.410 1.00 0.00 N ATOM 1326 CA SER A 92 31.485 -6.395 -1.856 1.00 0.00 C ATOM 1327 C SER A 92 31.123 -5.006 -2.395 1.00 0.00 C ATOM 1328 O SER A 92 30.207 -4.344 -1.900 1.00 0.00 O ATOM 1329 CB SER A 92 30.586 -7.491 -2.429 1.00 0.00 C ATOM 1330 OG SER A 92 30.804 -8.722 -1.757 1.00 0.00 O ATOM 0 H SER A 92 30.812 -7.218 -0.086 1.00 0.00 H new ATOM 0 HA SER A 92 32.513 -6.580 -2.166 1.00 0.00 H new ATOM 0 HB2 SER A 92 29.541 -7.198 -2.332 1.00 0.00 H new ATOM 0 HB3 SER A 92 30.786 -7.612 -3.494 1.00 0.00 H new ATOM 0 HG SER A 92 30.219 -9.410 -2.137 1.00 0.00 H new ATOM 1501 N LYS A 104 30.222 -11.993 -6.632 1.00 0.00 N ATOM 1502 CA LYS A 104 29.486 -12.973 -7.453 1.00 0.00 C ATOM 1503 C LYS A 104 27.967 -12.796 -7.379 1.00 0.00 C ATOM 1504 O LYS A 104 27.283 -12.855 -8.401 1.00 0.00 O ATOM 1505 CB LYS A 104 29.800 -14.415 -7.014 1.00 0.00 C ATOM 1506 CG LYS A 104 31.283 -14.794 -7.012 1.00 0.00 C ATOM 1507 CD LYS A 104 31.509 -16.286 -6.713 1.00 0.00 C ATOM 1508 CE LYS A 104 30.910 -16.690 -5.356 1.00 0.00 C ATOM 1509 NZ LYS A 104 31.113 -18.121 -5.035 1.00 0.00 N ATOM 0 HA LYS A 104 29.818 -12.793 -8.475 1.00 0.00 H new ATOM 0 HB2 LYS A 104 29.403 -14.565 -6.010 1.00 0.00 H new ATOM 0 HB3 LYS A 104 29.268 -15.101 -7.673 1.00 0.00 H new ATOM 0 HG2 LYS A 104 31.718 -14.551 -7.981 1.00 0.00 H new ATOM 0 HG3 LYS A 104 31.807 -14.194 -6.268 1.00 0.00 H new ATOM 0 HD2 LYS A 104 31.060 -16.888 -7.503 1.00 0.00 H new ATOM 0 HD3 LYS A 104 32.578 -16.500 -6.718 1.00 0.00 H new ATOM 0 HE2 LYS A 104 31.359 -16.081 -4.572 1.00 0.00 H new ATOM 0 HE3 LYS A 104 29.842 -16.472 -5.358 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 30.688 -18.333 -4.110 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 30.662 -18.708 -5.766 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 32.132 -18.329 -5.004 1.00 0.00 H new ATOM 1523 N LEU A 105 27.451 -12.593 -6.164 1.00 0.00 N ATOM 1524 CA LEU A 105 26.028 -12.412 -5.908 1.00 0.00 C ATOM 1525 C LEU A 105 25.519 -11.201 -6.684 1.00 0.00 C ATOM 1526 O LEU A 105 24.549 -11.294 -7.436 1.00 0.00 O ATOM 1527 CB LEU A 105 25.836 -12.260 -4.386 1.00 0.00 C ATOM 1528 CG LEU A 105 24.407 -11.994 -3.871 1.00 0.00 C ATOM 1529 CD1 LEU A 105 24.007 -10.514 -3.956 1.00 0.00 C ATOM 1530 CD2 LEU A 105 23.355 -12.861 -4.568 1.00 0.00 C ATOM 0 H LEU A 105 28.023 -12.550 -5.320 1.00 0.00 H new ATOM 0 HA LEU A 105 25.448 -13.271 -6.247 1.00 0.00 H new ATOM 0 HB2 LEU A 105 26.202 -13.169 -3.909 1.00 0.00 H new ATOM 0 HB3 LEU A 105 26.473 -11.443 -4.047 1.00 0.00 H new ATOM 0 HG LEU A 105 24.433 -12.275 -2.818 1.00 0.00 H new ATOM 0 HD11 LEU A 105 22.992 -10.389 -3.580 1.00 0.00 H new ATOM 0 HD12 LEU A 105 24.693 -9.917 -3.355 1.00 0.00 H new ATOM 0 HD13 LEU A 105 24.052 -10.184 -4.994 1.00 0.00 H new ATOM 0 HD21 LEU A 105 22.369 -12.631 -4.165 1.00 0.00 H new ATOM 0 HD22 LEU A 105 23.366 -12.657 -5.639 1.00 0.00 H new ATOM 0 HD23 LEU A 105 23.580 -13.914 -4.397 1.00 0.00 H new ATOM 1542 N GLU A 106 26.183 -10.059 -6.508 1.00 0.00 N ATOM 1543 CA GLU A 106 25.788 -8.824 -7.161 1.00 0.00 C ATOM 1544 C GLU A 106 25.960 -8.960 -8.671 1.00 0.00 C ATOM 1545 O GLU A 106 25.114 -8.485 -9.417 1.00 0.00 O ATOM 1546 CB GLU A 106 26.617 -7.633 -6.676 1.00 0.00 C ATOM 1547 CG GLU A 106 26.704 -7.442 -5.158 1.00 0.00 C ATOM 1548 CD GLU A 106 27.331 -6.079 -4.800 1.00 0.00 C ATOM 1549 OE1 GLU A 106 28.217 -5.589 -5.541 1.00 0.00 O ATOM 1550 OE2 GLU A 106 26.915 -5.496 -3.776 1.00 0.00 O ATOM 0 H GLU A 106 27.005 -9.970 -5.911 1.00 0.00 H new ATOM 0 HA GLU A 106 24.743 -8.642 -6.910 1.00 0.00 H new ATOM 0 HB2 GLU A 106 27.629 -7.739 -7.066 1.00 0.00 H new ATOM 0 HB3 GLU A 106 26.200 -6.725 -7.112 1.00 0.00 H new ATOM 0 HG2 GLU A 106 25.707 -7.512 -4.723 1.00 0.00 H new ATOM 0 HG3 GLU A 106 27.299 -8.244 -4.722 1.00 0.00 H new ATOM 1557 N ALA A 107 27.030 -9.606 -9.134 1.00 0.00 N ATOM 1558 CA ALA A 107 27.346 -9.772 -10.538 1.00 0.00 C ATOM 1559 C ALA A 107 26.185 -10.437 -11.264 1.00 0.00 C ATOM 1560 O ALA A 107 25.826 -9.969 -12.340 1.00 0.00 O ATOM 1561 CB ALA A 107 28.642 -10.571 -10.703 1.00 0.00 C ATOM 0 H ALA A 107 27.717 -10.039 -8.517 1.00 0.00 H new ATOM 0 HA ALA A 107 27.502 -8.790 -10.985 1.00 0.00 H new ATOM 0 HB1 ALA A 107 28.865 -10.687 -11.764 1.00 0.00 H new ATOM 0 HB2 ALA A 107 29.461 -10.041 -10.216 1.00 0.00 H new ATOM 0 HB3 ALA A 107 28.524 -11.554 -10.248 1.00 0.00 H new ATOM 1567 N GLU A 108 25.550 -11.457 -10.674 1.00 0.00 N ATOM 1568 CA GLU A 108 24.376 -12.090 -11.261 1.00 0.00 C ATOM 1569 C GLU A 108 23.218 -11.103 -11.365 1.00 0.00 C ATOM 1570 O GLU A 108 22.520 -11.105 -12.376 1.00 0.00 O ATOM 1571 CB GLU A 108 23.956 -13.291 -10.413 1.00 0.00 C ATOM 1572 CG GLU A 108 24.805 -14.554 -10.595 1.00 0.00 C ATOM 1573 CD GLU A 108 24.782 -15.081 -12.039 1.00 0.00 C ATOM 1574 OE1 GLU A 108 25.633 -14.671 -12.861 1.00 0.00 O ATOM 1575 OE2 GLU A 108 23.936 -15.952 -12.337 1.00 0.00 O ATOM 0 H GLU A 108 25.838 -11.860 -9.782 1.00 0.00 H new ATOM 0 HA GLU A 108 24.634 -12.425 -12.266 1.00 0.00 H new ATOM 0 HB2 GLU A 108 23.987 -13.001 -9.363 1.00 0.00 H new ATOM 0 HB3 GLU A 108 22.919 -13.534 -10.646 1.00 0.00 H new ATOM 0 HG2 GLU A 108 25.834 -14.340 -10.307 1.00 0.00 H new ATOM 0 HG3 GLU A 108 24.441 -15.331 -9.923 1.00 0.00 H new ATOM 1582 N LEU A 109 23.015 -10.243 -10.370 1.00 0.00 N ATOM 1583 CA LEU A 109 21.938 -9.254 -10.363 1.00 0.00 C ATOM 1584 C LEU A 109 22.184 -8.148 -11.392 1.00 0.00 C ATOM 1585 O LEU A 109 21.267 -7.769 -12.125 1.00 0.00 O ATOM 1586 CB LEU A 109 21.821 -8.676 -8.943 1.00 0.00 C ATOM 1587 CG LEU A 109 20.962 -9.573 -8.038 1.00 0.00 C ATOM 1588 CD1 LEU A 109 21.263 -9.253 -6.575 1.00 0.00 C ATOM 1589 CD2 LEU A 109 19.470 -9.385 -8.344 1.00 0.00 C ATOM 0 H LEU A 109 23.600 -10.212 -9.535 1.00 0.00 H new ATOM 0 HA LEU A 109 21.001 -9.736 -10.644 1.00 0.00 H new ATOM 0 HB2 LEU A 109 22.816 -8.567 -8.510 1.00 0.00 H new ATOM 0 HB3 LEU A 109 21.383 -7.679 -8.990 1.00 0.00 H new ATOM 0 HG LEU A 109 21.208 -10.617 -8.231 1.00 0.00 H new ATOM 0 HD11 LEU A 109 20.655 -9.888 -5.931 1.00 0.00 H new ATOM 0 HD12 LEU A 109 22.318 -9.435 -6.372 1.00 0.00 H new ATOM 0 HD13 LEU A 109 21.031 -8.207 -6.376 1.00 0.00 H new ATOM 0 HD21 LEU A 109 18.881 -10.030 -7.692 1.00 0.00 H new ATOM 0 HD22 LEU A 109 19.192 -8.345 -8.174 1.00 0.00 H new ATOM 0 HD23 LEU A 109 19.276 -9.647 -9.384 1.00 0.00 H new ATOM 1601 N LYS A 110 23.426 -7.673 -11.499 1.00 0.00 N ATOM 1602 CA LYS A 110 23.872 -6.688 -12.472 1.00 0.00 C ATOM 1603 C LYS A 110 23.680 -7.250 -13.882 1.00 0.00 C ATOM 1604 O LYS A 110 23.262 -6.532 -14.790 1.00 0.00 O ATOM 1605 CB LYS A 110 25.344 -6.343 -12.156 1.00 0.00 C ATOM 1606 CG LYS A 110 25.513 -5.678 -10.771 1.00 0.00 C ATOM 1607 CD LYS A 110 26.932 -5.786 -10.188 1.00 0.00 C ATOM 1608 CE LYS A 110 27.086 -4.893 -8.945 1.00 0.00 C ATOM 1609 NZ LYS A 110 28.388 -5.076 -8.265 1.00 0.00 N ATOM 0 H LYS A 110 24.177 -7.981 -10.881 1.00 0.00 H new ATOM 0 HA LYS A 110 23.289 -5.769 -12.418 1.00 0.00 H new ATOM 0 HB2 LYS A 110 25.943 -7.253 -12.194 1.00 0.00 H new ATOM 0 HB3 LYS A 110 25.730 -5.675 -12.926 1.00 0.00 H new ATOM 0 HG2 LYS A 110 25.245 -4.625 -10.851 1.00 0.00 H new ATOM 0 HG3 LYS A 110 24.810 -6.134 -10.074 1.00 0.00 H new ATOM 0 HD2 LYS A 110 27.143 -6.822 -9.924 1.00 0.00 H new ATOM 0 HD3 LYS A 110 27.662 -5.494 -10.943 1.00 0.00 H new ATOM 0 HE2 LYS A 110 26.978 -3.849 -9.238 1.00 0.00 H new ATOM 0 HE3 LYS A 110 26.281 -5.112 -8.244 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 28.228 -5.397 -7.289 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 28.949 -5.787 -8.776 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 28.903 -4.173 -8.252 1.00 0.00 H new ATOM 1623 N ASN A 111 23.928 -8.551 -14.052 1.00 0.00 N ATOM 1624 CA ASN A 111 23.693 -9.296 -15.286 1.00 0.00 C ATOM 1625 C ASN A 111 22.199 -9.490 -15.561 1.00 0.00 C ATOM 1626 O ASN A 111 21.784 -9.436 -16.718 1.00 0.00 O ATOM 1627 CB ASN A 111 24.436 -10.638 -15.187 1.00 0.00 C ATOM 1628 CG ASN A 111 23.693 -11.855 -15.717 1.00 0.00 C ATOM 1629 OD1 ASN A 111 23.788 -12.216 -16.886 1.00 0.00 O ATOM 1630 ND2 ASN A 111 22.983 -12.532 -14.826 1.00 0.00 N ATOM 0 H ASN A 111 24.311 -9.133 -13.307 1.00 0.00 H new ATOM 0 HA ASN A 111 24.077 -8.728 -16.133 1.00 0.00 H new ATOM 0 HB2 ASN A 111 25.378 -10.549 -15.728 1.00 0.00 H new ATOM 0 HB3 ASN A 111 24.684 -10.816 -14.141 1.00 0.00 H new ATOM 0 HD21 ASN A 111 22.493 -13.383 -15.104 1.00 0.00 H new ATOM 0 HD22 ASN A 111 22.926 -12.202 -13.862 1.00 0.00 H new ATOM 1637 N SER A 112 21.396 -9.710 -14.518 1.00 0.00 N ATOM 1638 CA SER A 112 19.964 -9.950 -14.652 1.00 0.00 C ATOM 1639 C SER A 112 19.250 -8.688 -15.154 1.00 0.00 C ATOM 1640 O SER A 112 18.336 -8.791 -15.974 1.00 0.00 O ATOM 1641 CB SER A 112 19.376 -10.443 -13.329 1.00 0.00 C ATOM 1642 OG SER A 112 19.959 -11.671 -12.930 1.00 0.00 O ATOM 0 H SER A 112 21.726 -9.726 -13.553 1.00 0.00 H new ATOM 0 HA SER A 112 19.808 -10.733 -15.394 1.00 0.00 H new ATOM 0 HB2 SER A 112 19.538 -9.693 -12.555 1.00 0.00 H new ATOM 0 HB3 SER A 112 18.298 -10.567 -13.432 1.00 0.00 H new ATOM 0 HG SER A 112 20.810 -11.497 -12.477 1.00 0.00 H new ATOM 1648 N GLY A 113 19.696 -7.497 -14.730 1.00 0.00 N ATOM 1649 CA GLY A 113 19.228 -6.248 -15.322 1.00 0.00 C ATOM 1650 C GLY A 113 19.433 -5.007 -14.457 1.00 0.00 C ATOM 1651 O GLY A 113 19.562 -3.914 -15.012 1.00 0.00 O ATOM 0 H GLY A 113 20.378 -7.378 -13.981 1.00 0.00 H new ATOM 0 HA2 GLY A 113 19.741 -6.099 -16.272 1.00 0.00 H new ATOM 0 HA3 GLY A 113 18.166 -6.345 -15.546 1.00 0.00 H new ATOM 1655 N ALA A 114 19.447 -5.145 -13.125 1.00 0.00 N ATOM 1656 CA ALA A 114 19.562 -3.998 -12.231 1.00 0.00 C ATOM 1657 C ALA A 114 20.950 -3.359 -12.347 1.00 0.00 C ATOM 1658 O ALA A 114 21.879 -3.937 -12.918 1.00 0.00 O ATOM 1659 CB ALA A 114 19.261 -4.393 -10.775 1.00 0.00 C ATOM 0 H ALA A 114 19.380 -6.044 -12.647 1.00 0.00 H new ATOM 0 HA ALA A 114 18.819 -3.261 -12.535 1.00 0.00 H new ATOM 0 HB1 ALA A 114 19.355 -3.517 -10.133 1.00 0.00 H new ATOM 0 HB2 ALA A 114 18.246 -4.786 -10.707 1.00 0.00 H new ATOM 0 HB3 ALA A 114 19.968 -5.157 -10.452 1.00 0.00 H new ATOM 1665 N LYS A 115 21.114 -2.189 -11.731 1.00 0.00 N ATOM 1666 CA LYS A 115 22.405 -1.540 -11.550 1.00 0.00 C ATOM 1667 C LYS A 115 22.511 -1.153 -10.085 1.00 0.00 C ATOM 1668 O LYS A 115 21.528 -0.691 -9.499 1.00 0.00 O ATOM 1669 CB LYS A 115 22.559 -0.339 -12.504 1.00 0.00 C ATOM 1670 CG LYS A 115 21.438 0.717 -12.403 1.00 0.00 C ATOM 1671 CD LYS A 115 21.692 1.949 -13.285 1.00 0.00 C ATOM 1672 CE LYS A 115 21.688 1.604 -14.783 1.00 0.00 C ATOM 1673 NZ LYS A 115 21.882 2.802 -15.636 1.00 0.00 N ATOM 0 H LYS A 115 20.337 -1.658 -11.338 1.00 0.00 H new ATOM 0 HA LYS A 115 23.225 -2.213 -11.803 1.00 0.00 H new ATOM 0 HB2 LYS A 115 23.514 0.146 -12.304 1.00 0.00 H new ATOM 0 HB3 LYS A 115 22.598 -0.710 -13.528 1.00 0.00 H new ATOM 0 HG2 LYS A 115 20.490 0.261 -12.690 1.00 0.00 H new ATOM 0 HG3 LYS A 115 21.338 1.035 -11.365 1.00 0.00 H new ATOM 0 HD2 LYS A 115 20.928 2.700 -13.085 1.00 0.00 H new ATOM 0 HD3 LYS A 115 22.652 2.392 -13.019 1.00 0.00 H new ATOM 0 HE2 LYS A 115 22.478 0.882 -14.990 1.00 0.00 H new ATOM 0 HE3 LYS A 115 20.743 1.126 -15.041 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 21.872 2.521 -16.637 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 21.115 3.482 -15.460 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 22.795 3.245 -15.410 1.00 0.00 H new ATOM 1687 N GLN A 116 23.679 -1.374 -9.484 1.00 0.00 N ATOM 1688 CA GLN A 116 23.959 -0.841 -8.161 1.00 0.00 C ATOM 1689 C GLN A 116 24.147 0.667 -8.338 1.00 0.00 C ATOM 1690 O GLN A 116 24.985 1.092 -9.136 1.00 0.00 O ATOM 1691 CB GLN A 116 25.198 -1.514 -7.561 1.00 0.00 C ATOM 1692 CG GLN A 116 25.511 -0.961 -6.161 1.00 0.00 C ATOM 1693 CD GLN A 116 26.714 -1.618 -5.483 1.00 0.00 C ATOM 1694 OE1 GLN A 116 27.513 -2.319 -6.098 1.00 0.00 O ATOM 1695 NE2 GLN A 116 26.861 -1.373 -4.191 1.00 0.00 N ATOM 0 H GLN A 116 24.440 -1.916 -9.893 1.00 0.00 H new ATOM 0 HA GLN A 116 23.146 -1.039 -7.463 1.00 0.00 H new ATOM 0 HB2 GLN A 116 25.037 -2.590 -7.502 1.00 0.00 H new ATOM 0 HB3 GLN A 116 26.054 -1.356 -8.217 1.00 0.00 H new ATOM 0 HG2 GLN A 116 25.692 0.111 -6.238 1.00 0.00 H new ATOM 0 HG3 GLN A 116 24.634 -1.091 -5.527 1.00 0.00 H new ATOM 0 HE21 GLN A 116 26.184 -0.787 -3.703 1.00 0.00 H new ATOM 0 HE22 GLN A 116 27.652 -1.770 -3.683 1.00 0.00 H new ATOM 1704 N THR A 117 23.381 1.470 -7.603 1.00 0.00 N ATOM 1705 CA THR A 117 23.573 2.915 -7.579 1.00 0.00 C ATOM 1706 C THR A 117 24.617 3.276 -6.515 1.00 0.00 C ATOM 1707 O THR A 117 24.775 2.555 -5.526 1.00 0.00 O ATOM 1708 CB THR A 117 22.222 3.585 -7.315 1.00 0.00 C ATOM 1709 OG1 THR A 117 21.307 3.149 -8.299 1.00 0.00 O ATOM 1710 CG2 THR A 117 22.289 5.109 -7.417 1.00 0.00 C ATOM 0 H THR A 117 22.617 1.140 -7.013 1.00 0.00 H new ATOM 0 HA THR A 117 23.949 3.274 -8.537 1.00 0.00 H new ATOM 0 HB THR A 117 21.921 3.314 -6.303 1.00 0.00 H new ATOM 0 HG1 THR A 117 21.789 2.952 -9.129 1.00 0.00 H new ATOM 0 HG21 THR A 117 21.303 5.530 -7.221 1.00 0.00 H new ATOM 0 HG22 THR A 117 23.000 5.492 -6.685 1.00 0.00 H new ATOM 0 HG23 THR A 117 22.612 5.393 -8.419 1.00 0.00 H new ATOM 1718 N GLY A 118 25.291 4.418 -6.697 1.00 0.00 N ATOM 1719 CA GLY A 118 26.215 4.970 -5.721 1.00 0.00 C ATOM 1720 C GLY A 118 27.385 4.007 -5.545 1.00 0.00 C ATOM 1721 O GLY A 118 28.119 3.719 -6.493 1.00 0.00 O ATOM 0 H GLY A 118 25.203 4.986 -7.540 1.00 0.00 H new ATOM 0 HA2 GLY A 118 26.575 5.944 -6.052 1.00 0.00 H new ATOM 0 HA3 GLY A 118 25.708 5.125 -4.768 1.00 0.00 H new ATOM 1725 N GLU A 119 27.517 3.491 -4.330 1.00 0.00 N ATOM 1726 CA GLU A 119 28.408 2.396 -3.957 1.00 0.00 C ATOM 1727 C GLU A 119 27.774 1.693 -2.755 1.00 0.00 C ATOM 1728 O GLU A 119 26.750 2.148 -2.254 1.00 0.00 O ATOM 1729 CB GLU A 119 29.831 2.899 -3.653 1.00 0.00 C ATOM 1730 CG GLU A 119 29.944 3.796 -2.410 1.00 0.00 C ATOM 1731 CD GLU A 119 31.418 4.049 -2.059 1.00 0.00 C ATOM 1732 OE1 GLU A 119 32.014 3.199 -1.355 1.00 0.00 O ATOM 1733 OE2 GLU A 119 31.980 5.091 -2.466 1.00 0.00 O ATOM 0 H GLU A 119 26.979 3.841 -3.537 1.00 0.00 H new ATOM 0 HA GLU A 119 28.522 1.695 -4.784 1.00 0.00 H new ATOM 0 HB2 GLU A 119 30.486 2.038 -3.523 1.00 0.00 H new ATOM 0 HB3 GLU A 119 30.199 3.452 -4.518 1.00 0.00 H new ATOM 0 HG2 GLU A 119 29.440 4.745 -2.592 1.00 0.00 H new ATOM 0 HG3 GLU A 119 29.439 3.324 -1.567 1.00 0.00 H new ATOM 1740 N THR A 120 28.356 0.602 -2.274 1.00 0.00 N ATOM 1741 CA THR A 120 27.810 -0.134 -1.140 1.00 0.00 C ATOM 1742 C THR A 120 27.743 0.777 0.100 1.00 0.00 C ATOM 1743 O THR A 120 28.722 1.446 0.445 1.00 0.00 O ATOM 1744 CB THR A 120 28.636 -1.414 -0.941 1.00 0.00 C ATOM 1745 OG1 THR A 120 28.930 -1.982 -2.210 1.00 0.00 O ATOM 1746 CG2 THR A 120 27.856 -2.440 -0.124 1.00 0.00 C ATOM 0 H THR A 120 29.214 0.204 -2.656 1.00 0.00 H new ATOM 0 HA THR A 120 26.782 -0.445 -1.326 1.00 0.00 H new ATOM 0 HB THR A 120 29.552 -1.154 -0.411 1.00 0.00 H new ATOM 0 HG1 THR A 120 29.901 -2.025 -2.332 1.00 0.00 H new ATOM 0 HG21 THR A 120 28.460 -3.338 0.004 1.00 0.00 H new ATOM 0 HG22 THR A 120 27.617 -2.021 0.853 1.00 0.00 H new ATOM 0 HG23 THR A 120 26.933 -2.695 -0.645 1.00 0.00 H new ATOM 1754 N LEU A 121 26.572 0.846 0.737 1.00 0.00 N ATOM 1755 CA LEU A 121 26.310 1.658 1.925 1.00 0.00 C ATOM 1756 C LEU A 121 26.861 0.900 3.144 1.00 0.00 C ATOM 1757 O LEU A 121 26.960 -0.328 3.109 1.00 0.00 O ATOM 1758 CB LEU A 121 24.785 1.886 2.020 1.00 0.00 C ATOM 1759 CG LEU A 121 24.317 3.220 2.633 1.00 0.00 C ATOM 1760 CD1 LEU A 121 22.811 3.408 2.447 1.00 0.00 C ATOM 1761 CD2 LEU A 121 24.642 3.438 4.112 1.00 0.00 C ATOM 0 H LEU A 121 25.754 0.320 0.429 1.00 0.00 H new ATOM 0 HA LEU A 121 26.796 2.632 1.879 1.00 0.00 H new ATOM 0 HB2 LEU A 121 24.367 1.809 1.016 1.00 0.00 H new ATOM 0 HB3 LEU A 121 24.356 1.074 2.607 1.00 0.00 H new ATOM 0 HG LEU A 121 24.896 3.961 2.081 1.00 0.00 H new ATOM 0 HD11 LEU A 121 22.506 4.357 2.888 1.00 0.00 H new ATOM 0 HD12 LEU A 121 22.573 3.409 1.383 1.00 0.00 H new ATOM 0 HD13 LEU A 121 22.279 2.592 2.937 1.00 0.00 H new ATOM 0 HD21 LEU A 121 24.263 4.410 4.428 1.00 0.00 H new ATOM 0 HD22 LEU A 121 24.173 2.654 4.707 1.00 0.00 H new ATOM 0 HD23 LEU A 121 25.722 3.405 4.256 1.00 0.00 H new ATOM 1773 N LYS A 122 27.178 1.590 4.241 1.00 0.00 N ATOM 1774 CA LYS A 122 27.761 1.008 5.449 1.00 0.00 C ATOM 1775 C LYS A 122 26.900 1.420 6.635 1.00 0.00 C ATOM 1776 O LYS A 122 26.454 2.568 6.703 1.00 0.00 O ATOM 1777 CB LYS A 122 29.208 1.492 5.672 1.00 0.00 C ATOM 1778 CG LYS A 122 30.214 1.196 4.541 1.00 0.00 C ATOM 1779 CD LYS A 122 30.250 2.298 3.470 1.00 0.00 C ATOM 1780 CE LYS A 122 31.270 1.994 2.363 1.00 0.00 C ATOM 1781 NZ LYS A 122 31.027 2.855 1.182 1.00 0.00 N ATOM 0 H LYS A 122 27.032 2.597 4.315 1.00 0.00 H new ATOM 0 HA LYS A 122 27.790 -0.076 5.341 1.00 0.00 H new ATOM 0 HB2 LYS A 122 29.186 2.569 5.836 1.00 0.00 H new ATOM 0 HB3 LYS A 122 29.582 1.038 6.589 1.00 0.00 H new ATOM 0 HG2 LYS A 122 31.210 1.079 4.969 1.00 0.00 H new ATOM 0 HG3 LYS A 122 29.956 0.247 4.071 1.00 0.00 H new ATOM 0 HD2 LYS A 122 29.259 2.407 3.029 1.00 0.00 H new ATOM 0 HD3 LYS A 122 30.497 3.251 3.939 1.00 0.00 H new ATOM 0 HE2 LYS A 122 32.281 2.157 2.737 1.00 0.00 H new ATOM 0 HE3 LYS A 122 31.202 0.945 2.076 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 31.785 2.709 0.484 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 30.111 2.608 0.755 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 31.014 3.852 1.476 1.00 0.00 H new ATOM 1795 N ILE A 123 26.678 0.505 7.573 1.00 0.00 N ATOM 1796 CA ILE A 123 25.810 0.686 8.726 1.00 0.00 C ATOM 1797 C ILE A 123 26.486 0.085 9.957 1.00 0.00 C ATOM 1798 O ILE A 123 27.317 -0.820 9.837 1.00 0.00 O ATOM 1799 CB ILE A 123 24.426 0.051 8.443 1.00 0.00 C ATOM 1800 CG1 ILE A 123 24.440 -1.277 7.641 1.00 0.00 C ATOM 1801 CG2 ILE A 123 23.550 1.056 7.676 1.00 0.00 C ATOM 1802 CD1 ILE A 123 25.152 -2.464 8.299 1.00 0.00 C ATOM 0 H ILE A 123 27.115 -0.416 7.548 1.00 0.00 H new ATOM 0 HA ILE A 123 25.644 1.746 8.920 1.00 0.00 H new ATOM 0 HB ILE A 123 24.032 -0.195 9.429 1.00 0.00 H new ATOM 0 HG12 ILE A 123 23.408 -1.566 7.441 1.00 0.00 H new ATOM 0 HG13 ILE A 123 24.911 -1.088 6.676 1.00 0.00 H new ATOM 0 HG21 ILE A 123 22.575 0.611 7.476 1.00 0.00 H new ATOM 0 HG22 ILE A 123 23.421 1.957 8.275 1.00 0.00 H new ATOM 0 HG23 ILE A 123 24.032 1.313 6.733 1.00 0.00 H new ATOM 0 HD11 ILE A 123 25.094 -3.332 7.643 1.00 0.00 H new ATOM 0 HD12 ILE A 123 26.198 -2.210 8.473 1.00 0.00 H new ATOM 0 HD13 ILE A 123 24.671 -2.695 9.250 1.00 0.00 H new ATOM 2006 N GLU A 137 25.185 9.504 5.723 1.00 0.00 N ATOM 2007 CA GLU A 137 25.403 10.587 4.762 1.00 0.00 C ATOM 2008 C GLU A 137 25.204 10.102 3.317 1.00 0.00 C ATOM 2009 O GLU A 137 24.811 10.896 2.462 1.00 0.00 O ATOM 2010 CB GLU A 137 26.816 11.170 4.937 1.00 0.00 C ATOM 2011 CG GLU A 137 27.046 11.856 6.293 1.00 0.00 C ATOM 2012 CD GLU A 137 26.158 13.101 6.487 1.00 0.00 C ATOM 2013 OE1 GLU A 137 26.457 14.164 5.896 1.00 0.00 O ATOM 2014 OE2 GLU A 137 25.169 13.041 7.250 1.00 0.00 O ATOM 0 HA GLU A 137 24.666 11.366 4.958 1.00 0.00 H new ATOM 0 HB2 GLU A 137 27.546 10.369 4.818 1.00 0.00 H new ATOM 0 HB3 GLU A 137 27.002 11.891 4.141 1.00 0.00 H new ATOM 0 HG2 GLU A 137 26.847 11.144 7.094 1.00 0.00 H new ATOM 0 HG3 GLU A 137 28.094 12.145 6.376 1.00 0.00 H new ATOM 2021 N TRP A 138 25.422 8.810 3.043 1.00 0.00 N ATOM 2022 CA TRP A 138 25.110 8.168 1.769 1.00 0.00 C ATOM 2023 C TRP A 138 23.642 8.332 1.450 1.00 0.00 C ATOM 2024 O TRP A 138 23.285 8.783 0.370 1.00 0.00 O ATOM 2025 CB TRP A 138 25.396 6.675 1.878 1.00 0.00 C ATOM 2026 CG TRP A 138 25.476 5.904 0.595 1.00 0.00 C ATOM 2027 CD1 TRP A 138 26.612 5.412 0.056 1.00 0.00 C ATOM 2028 CD2 TRP A 138 24.386 5.377 -0.234 1.00 0.00 C ATOM 2029 NE1 TRP A 138 26.304 4.615 -1.024 1.00 0.00 N ATOM 2030 CE2 TRP A 138 24.948 4.570 -1.264 1.00 0.00 C ATOM 2031 CE3 TRP A 138 22.975 5.432 -0.182 1.00 0.00 C ATOM 2032 CZ2 TRP A 138 24.159 3.887 -2.205 1.00 0.00 C ATOM 2033 CZ3 TRP A 138 22.174 4.731 -1.100 1.00 0.00 C ATOM 2034 CH2 TRP A 138 22.762 3.970 -2.123 1.00 0.00 C ATOM 0 H TRP A 138 25.831 8.169 3.722 1.00 0.00 H new ATOM 0 HA TRP A 138 25.717 8.627 0.989 1.00 0.00 H new ATOM 0 HB2 TRP A 138 26.339 6.548 2.409 1.00 0.00 H new ATOM 0 HB3 TRP A 138 24.619 6.225 2.496 1.00 0.00 H new ATOM 0 HD1 TRP A 138 27.610 5.613 0.417 1.00 0.00 H new ATOM 0 HE1 TRP A 138 26.998 4.117 -1.581 1.00 0.00 H new ATOM 0 HE3 TRP A 138 22.500 6.028 0.583 1.00 0.00 H new ATOM 0 HZ2 TRP A 138 24.625 3.303 -2.985 1.00 0.00 H new ATOM 0 HZ3 TRP A 138 21.098 4.778 -1.018 1.00 0.00 H new ATOM 0 HH2 TRP A 138 22.143 3.453 -2.841 1.00 0.00 H new ATOM 2045 N LEU A 139 22.811 7.951 2.417 1.00 0.00 N ATOM 2046 CA LEU A 139 21.358 8.022 2.365 1.00 0.00 C ATOM 2047 C LEU A 139 20.957 9.429 1.932 1.00 0.00 C ATOM 2048 O LEU A 139 20.304 9.596 0.906 1.00 0.00 O ATOM 2049 CB LEU A 139 20.793 7.658 3.758 1.00 0.00 C ATOM 2050 CG LEU A 139 19.462 6.892 3.769 1.00 0.00 C ATOM 2051 CD1 LEU A 139 18.411 7.647 2.962 1.00 0.00 C ATOM 2052 CD2 LEU A 139 19.609 5.456 3.254 1.00 0.00 C ATOM 0 H LEU A 139 23.151 7.567 3.298 1.00 0.00 H new ATOM 0 HA LEU A 139 20.948 7.316 1.643 1.00 0.00 H new ATOM 0 HB2 LEU A 139 21.537 7.060 4.284 1.00 0.00 H new ATOM 0 HB3 LEU A 139 20.663 8.579 4.327 1.00 0.00 H new ATOM 0 HG LEU A 139 19.137 6.824 4.807 1.00 0.00 H new ATOM 0 HD11 LEU A 139 17.473 7.093 2.978 1.00 0.00 H new ATOM 0 HD12 LEU A 139 18.257 8.634 3.398 1.00 0.00 H new ATOM 0 HD13 LEU A 139 18.751 7.755 1.932 1.00 0.00 H new ATOM 0 HD21 LEU A 139 18.640 4.958 3.282 1.00 0.00 H new ATOM 0 HD22 LEU A 139 19.978 5.473 2.229 1.00 0.00 H new ATOM 0 HD23 LEU A 139 20.314 4.914 3.884 1.00 0.00 H new ATOM 2064 N GLY A 140 21.422 10.434 2.676 1.00 0.00 N ATOM 2065 CA GLY A 140 21.130 11.838 2.404 1.00 0.00 C ATOM 2066 C GLY A 140 21.582 12.275 1.006 1.00 0.00 C ATOM 2067 O GLY A 140 20.822 12.918 0.278 1.00 0.00 O ATOM 0 H GLY A 140 22.018 10.292 3.492 1.00 0.00 H new ATOM 0 HA2 GLY A 140 20.058 12.008 2.505 1.00 0.00 H new ATOM 0 HA3 GLY A 140 21.623 12.459 3.152 1.00 0.00 H new ATOM 2071 N SER A 141 22.798 11.901 0.604 1.00 0.00 N ATOM 2072 CA SER A 141 23.381 12.213 -0.668 1.00 0.00 C ATOM 2073 C SER A 141 22.557 11.597 -1.799 1.00 0.00 C ATOM 2074 O SER A 141 21.994 12.320 -2.618 1.00 0.00 O ATOM 2075 CB SER A 141 24.790 11.630 -0.594 1.00 0.00 C ATOM 2076 OG SER A 141 25.606 12.342 0.319 1.00 0.00 O ATOM 0 H SER A 141 23.418 11.348 1.196 1.00 0.00 H new ATOM 0 HA SER A 141 23.405 13.282 -0.877 1.00 0.00 H new ATOM 0 HB2 SER A 141 24.735 10.584 -0.293 1.00 0.00 H new ATOM 0 HB3 SER A 141 25.246 11.654 -1.584 1.00 0.00 H new ATOM 0 HG SER A 141 25.401 12.056 1.233 1.00 0.00 H new ATOM 2082 N TRP A 142 22.429 10.276 -1.805 1.00 0.00 N ATOM 2083 CA TRP A 142 21.685 9.491 -2.778 1.00 0.00 C ATOM 2084 C TRP A 142 20.245 9.995 -2.926 1.00 0.00 C ATOM 2085 O TRP A 142 19.774 10.141 -4.053 1.00 0.00 O ATOM 2086 CB TRP A 142 21.766 8.027 -2.336 1.00 0.00 C ATOM 2087 CG TRP A 142 20.974 7.032 -3.122 1.00 0.00 C ATOM 2088 CD1 TRP A 142 21.332 6.460 -4.293 1.00 0.00 C ATOM 2089 CD2 TRP A 142 19.703 6.426 -2.752 1.00 0.00 C ATOM 2090 NE1 TRP A 142 20.327 5.604 -4.712 1.00 0.00 N ATOM 2091 CE2 TRP A 142 19.303 5.532 -3.789 1.00 0.00 C ATOM 2092 CE3 TRP A 142 18.869 6.521 -1.617 1.00 0.00 C ATOM 2093 CZ2 TRP A 142 18.107 4.801 -3.725 1.00 0.00 C ATOM 2094 CZ3 TRP A 142 17.662 5.802 -1.548 1.00 0.00 C ATOM 2095 CH2 TRP A 142 17.278 4.947 -2.599 1.00 0.00 C ATOM 0 H TRP A 142 22.866 9.693 -1.091 1.00 0.00 H new ATOM 0 HA TRP A 142 22.119 9.592 -3.773 1.00 0.00 H new ATOM 0 HB2 TRP A 142 22.812 7.723 -2.363 1.00 0.00 H new ATOM 0 HB3 TRP A 142 21.444 7.970 -1.296 1.00 0.00 H new ATOM 0 HD1 TRP A 142 22.257 6.642 -4.820 1.00 0.00 H new ATOM 0 HE1 TRP A 142 20.342 5.091 -5.593 1.00 0.00 H new ATOM 0 HE3 TRP A 142 19.161 7.153 -0.792 1.00 0.00 H new ATOM 0 HZ2 TRP A 142 17.827 4.136 -4.529 1.00 0.00 H new ATOM 0 HZ3 TRP A 142 17.025 5.906 -0.682 1.00 0.00 H new ATOM 0 HH2 TRP A 142 16.347 4.403 -2.540 1.00 0.00 H new ATOM 2106 N VAL A 143 19.575 10.342 -1.821 1.00 0.00 N ATOM 2107 CA VAL A 143 18.253 10.959 -1.834 1.00 0.00 C ATOM 2108 C VAL A 143 18.288 12.251 -2.653 1.00 0.00 C ATOM 2109 O VAL A 143 17.548 12.377 -3.626 1.00 0.00 O ATOM 2110 CB VAL A 143 17.779 11.173 -0.377 1.00 0.00 C ATOM 2111 CG1 VAL A 143 16.686 12.240 -0.217 1.00 0.00 C ATOM 2112 CG2 VAL A 143 17.245 9.853 0.193 1.00 0.00 C ATOM 0 H VAL A 143 19.945 10.198 -0.882 1.00 0.00 H new ATOM 0 HA VAL A 143 17.527 10.306 -2.318 1.00 0.00 H new ATOM 0 HB VAL A 143 18.656 11.527 0.165 1.00 0.00 H new ATOM 0 HG11 VAL A 143 16.412 12.326 0.835 1.00 0.00 H new ATOM 0 HG12 VAL A 143 17.059 13.200 -0.574 1.00 0.00 H new ATOM 0 HG13 VAL A 143 15.809 11.953 -0.798 1.00 0.00 H new ATOM 0 HG21 VAL A 143 16.912 10.008 1.219 1.00 0.00 H new ATOM 0 HG22 VAL A 143 16.407 9.508 -0.412 1.00 0.00 H new ATOM 0 HG23 VAL A 143 18.036 9.103 0.177 1.00 0.00 H new ATOM 2122 N ASN A 144 19.143 13.215 -2.297 1.00 0.00 N ATOM 2123 CA ASN A 144 19.137 14.511 -2.975 1.00 0.00 C ATOM 2124 C ASN A 144 19.673 14.422 -4.415 1.00 0.00 C ATOM 2125 O ASN A 144 19.474 15.354 -5.192 1.00 0.00 O ATOM 2126 CB ASN A 144 19.808 15.611 -2.129 1.00 0.00 C ATOM 2127 CG ASN A 144 21.190 16.026 -2.618 1.00 0.00 C ATOM 2128 OD1 ASN A 144 21.413 17.170 -3.002 1.00 0.00 O ATOM 2129 ND2 ASN A 144 22.144 15.116 -2.603 1.00 0.00 N ATOM 0 H ASN A 144 19.837 13.124 -1.555 1.00 0.00 H new ATOM 0 HA ASN A 144 18.095 14.816 -3.077 1.00 0.00 H new ATOM 0 HB2 ASN A 144 19.161 16.488 -2.117 1.00 0.00 H new ATOM 0 HB3 ASN A 144 19.890 15.262 -1.100 1.00 0.00 H new ATOM 0 HD21 ASN A 144 23.085 15.358 -2.914 1.00 0.00 H new ATOM 0 HD22 ASN A 144 21.941 14.170 -2.281 1.00 0.00 H new ATOM 2136 N LEU A 145 20.335 13.315 -4.777 1.00 0.00 N ATOM 2137 CA LEU A 145 20.772 13.024 -6.139 1.00 0.00 C ATOM 2138 C LEU A 145 19.618 12.464 -6.971 1.00 0.00 C ATOM 2139 O LEU A 145 19.407 12.929 -8.092 1.00 0.00 O ATOM 2140 CB LEU A 145 21.948 12.023 -6.135 1.00 0.00 C ATOM 2141 CG LEU A 145 23.323 12.678 -6.361 1.00 0.00 C ATOM 2142 CD1 LEU A 145 23.677 13.710 -5.285 1.00 0.00 C ATOM 2143 CD2 LEU A 145 24.408 11.595 -6.389 1.00 0.00 C ATOM 0 H LEU A 145 20.585 12.583 -4.112 1.00 0.00 H new ATOM 0 HA LEU A 145 21.108 13.959 -6.588 1.00 0.00 H new ATOM 0 HB2 LEU A 145 21.960 11.495 -5.182 1.00 0.00 H new ATOM 0 HB3 LEU A 145 21.780 11.276 -6.911 1.00 0.00 H new ATOM 0 HG LEU A 145 23.271 13.204 -7.314 1.00 0.00 H new ATOM 0 HD11 LEU A 145 24.657 14.137 -5.499 1.00 0.00 H new ATOM 0 HD12 LEU A 145 22.929 14.503 -5.281 1.00 0.00 H new ATOM 0 HD13 LEU A 145 23.697 13.225 -4.309 1.00 0.00 H new ATOM 0 HD21 LEU A 145 25.381 12.059 -6.549 1.00 0.00 H new ATOM 0 HD22 LEU A 145 24.413 11.060 -5.439 1.00 0.00 H new ATOM 0 HD23 LEU A 145 24.202 10.895 -7.199 1.00 0.00 H new ATOM 2155 N LEU A 146 18.888 11.460 -6.464 1.00 0.00 N ATOM 2156 CA LEU A 146 17.816 10.816 -7.208 1.00 0.00 C ATOM 2157 C LEU A 146 16.603 11.734 -7.355 1.00 0.00 C ATOM 2158 O LEU A 146 15.915 11.687 -8.376 1.00 0.00 O ATOM 2159 CB LEU A 146 17.470 9.460 -6.569 1.00 0.00 C ATOM 2160 CG LEU A 146 16.595 9.429 -5.294 1.00 0.00 C ATOM 2161 CD1 LEU A 146 15.086 9.421 -5.589 1.00 0.00 C ATOM 2162 CD2 LEU A 146 16.906 8.166 -4.482 1.00 0.00 C ATOM 0 H LEU A 146 19.030 11.078 -5.529 1.00 0.00 H new ATOM 0 HA LEU A 146 18.161 10.618 -8.223 1.00 0.00 H new ATOM 0 HB2 LEU A 146 16.967 8.859 -7.327 1.00 0.00 H new ATOM 0 HB3 LEU A 146 18.409 8.958 -6.335 1.00 0.00 H new ATOM 0 HG LEU A 146 16.835 10.340 -4.746 1.00 0.00 H new ATOM 0 HD11 LEU A 146 14.532 9.399 -4.651 1.00 0.00 H new ATOM 0 HD12 LEU A 146 14.820 10.319 -6.147 1.00 0.00 H new ATOM 0 HD13 LEU A 146 14.835 8.540 -6.179 1.00 0.00 H new ATOM 0 HD21 LEU A 146 16.287 8.149 -3.585 1.00 0.00 H new ATOM 0 HD22 LEU A 146 16.694 7.284 -5.086 1.00 0.00 H new ATOM 0 HD23 LEU A 146 17.958 8.167 -4.197 1.00 0.00 H new ATOM 2174 N LYS A 147 16.351 12.566 -6.343 1.00 0.00 N ATOM 2175 CA LYS A 147 15.324 13.593 -6.358 1.00 0.00 C ATOM 2176 C LYS A 147 15.594 14.572 -7.497 1.00 0.00 C ATOM 2177 O LYS A 147 14.662 14.837 -8.282 1.00 0.00 O ATOM 2178 CB LYS A 147 15.273 14.298 -4.994 1.00 0.00 C ATOM 2179 CG LYS A 147 14.437 13.495 -3.983 1.00 0.00 C ATOM 2180 CD LYS A 147 14.309 14.243 -2.650 1.00 0.00 C ATOM 2181 CE LYS A 147 13.404 13.467 -1.693 1.00 0.00 C ATOM 2182 NZ LYS A 147 13.189 14.178 -0.409 1.00 0.00 N ATOM 2183 OXT LYS A 147 16.722 15.095 -7.601 1.00 0.00 O ATOM 0 H LYS A 147 16.874 12.538 -5.468 1.00 0.00 H new ATOM 0 HA LYS A 147 14.347 13.141 -6.532 1.00 0.00 H new ATOM 0 HB2 LYS A 147 16.285 14.428 -4.611 1.00 0.00 H new ATOM 0 HB3 LYS A 147 14.847 15.294 -5.112 1.00 0.00 H new ATOM 0 HG2 LYS A 147 13.445 13.308 -4.395 1.00 0.00 H new ATOM 0 HG3 LYS A 147 14.901 12.523 -3.814 1.00 0.00 H new ATOM 0 HD2 LYS A 147 15.294 14.375 -2.203 1.00 0.00 H new ATOM 0 HD3 LYS A 147 13.900 15.239 -2.821 1.00 0.00 H new ATOM 0 HE2 LYS A 147 12.441 13.291 -2.172 1.00 0.00 H new ATOM 0 HE3 LYS A 147 13.845 12.490 -1.494 1.00 0.00 H new ATOM 0 HZ1 LYS A 147 12.776 13.523 0.286 1.00 0.00 H new ATOM 0 HZ2 LYS A 147 14.099 14.533 -0.052 1.00 0.00 H new ATOM 0 HZ3 LYS A 147 12.541 14.977 -0.559 1.00 0.00 H new