USER MOD reduce.3.24.130724 H: found=0, std=0, add=808, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 806 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 18 CYS SG : rot 180:sc= 0 USER MOD Set 1.2: A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 1 ALA N :NH3+ -104:sc= 0.0898 (180deg=0) USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 SER OG : rot -31:sc= 0.852 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 19 GLN : amide:sc= -0.286 K(o=-0.29,f=-1.3) USER MOD Single : A 23 SER OG : rot -170:sc= -0.872 USER MOD Single : A 25 ASN : amide:sc= -1.7 K(o=-1.7,f=-0.24) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ -132:sc= 0 (180deg=-0.0293) USER MOD Single : A 31 SER OG : rot -51:sc= 0.115 USER MOD Single : A 32 THR OG1 : rot 112:sc= -0.501 USER MOD Single : A 36 SER OG : rot -140:sc= -0.0392 USER MOD Single : A 37 SER OG : rot -48:sc= 0.625 USER MOD Single : A 38 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.048) USER MOD Single : A 39 THR OG1 : rot 180:sc= -1.15 USER MOD Single : A 42 GLN : amide:sc= -0.355 K(o=-0.36,f=-1.4) USER MOD Single : A 44 LYS NZ :NH3+ -144:sc= 0.139 (180deg=0) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 GLN : amide:sc= -1.14 K(o=-1.1,f=-0.052) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 64 GLN : amide:sc= -0.0473 K(o=-0.047,f=-0.9) USER MOD Single : A 68 LYS NZ :NH3+ 176:sc= 0.213 (180deg=0.188) USER MOD Single : A 69 ASN : amide:sc= -2.63 K(o=-2.6,f=-7.9!) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 72 SER OG : rot -48:sc= 0.0661 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 78 THR OG1 : rot 180:sc= 0.381 USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 82 THR OG1 : rot 77:sc= -0.744 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 GLN : amide:sc= 0 X(o=0,f=-0.32) USER MOD Single : A 104 SER OG : rot -2:sc= 0.645! USER MOD Single : A 107 LYS NZ :NH3+ -162:sc= -0.0665 (180deg=-0.435) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 0.858 0.739 -0.945 1.00 33.32 N ATOM 2 CA ALA A 1 1.148 0.022 -2.181 1.00 11.25 C ATOM 3 C ALA A 1 2.185 -1.072 -1.950 1.00 40.32 C ATOM 4 O ALA A 1 2.755 -1.181 -0.864 1.00 52.11 O ATOM 5 CB ALA A 1 1.628 0.990 -3.252 1.00 10.34 C ATOM 0 H1 ALA A 1 -0.062 0.429 -0.571 1.00 33.32 H new ATOM 0 H2 ALA A 1 1.601 0.540 -0.245 1.00 33.32 H new ATOM 0 H3 ALA A 1 0.827 1.761 -1.136 1.00 33.32 H new ATOM 0 HA ALA A 1 0.228 -0.452 -2.522 1.00 11.25 H new ATOM 0 HB1 ALA A 1 1.841 0.441 -4.169 1.00 10.34 H new ATOM 0 HB2 ALA A 1 0.854 1.733 -3.445 1.00 10.34 H new ATOM 0 HB3 ALA A 1 2.534 1.491 -2.910 1.00 10.34 H new ATOM 11 N ILE A 2 2.424 -1.879 -2.978 1.00 25.22 N ATOM 12 CA ILE A 2 3.394 -2.964 -2.886 1.00 75.25 C ATOM 13 C ILE A 2 4.646 -2.653 -3.699 1.00 55.04 C ATOM 14 O ILE A 2 5.708 -3.232 -3.471 1.00 4.43 O ATOM 15 CB ILE A 2 2.795 -4.296 -3.376 1.00 61.20 C ATOM 16 CG1 ILE A 2 3.770 -5.446 -3.114 1.00 4.43 C ATOM 17 CG2 ILE A 2 2.454 -4.211 -4.856 1.00 71.32 C ATOM 18 CD1 ILE A 2 4.144 -5.601 -1.656 1.00 55.30 C ATOM 0 H ILE A 2 1.960 -1.803 -3.883 1.00 25.22 H new ATOM 0 HA ILE A 2 3.662 -3.060 -1.834 1.00 75.25 H new ATOM 0 HB ILE A 2 1.877 -4.490 -2.822 1.00 61.20 H new ATOM 0 HG12 ILE A 2 3.325 -6.376 -3.468 1.00 4.43 H new ATOM 0 HG13 ILE A 2 4.676 -5.284 -3.698 1.00 4.43 H new ATOM 0 HG21 ILE A 2 2.032 -5.160 -5.187 1.00 71.32 H new ATOM 0 HG22 ILE A 2 1.727 -3.415 -5.017 1.00 71.32 H new ATOM 0 HG23 ILE A 2 3.358 -3.998 -5.426 1.00 71.32 H new ATOM 0 HD11 ILE A 2 4.837 -6.435 -1.545 1.00 55.30 H new ATOM 0 HD12 ILE A 2 4.618 -4.685 -1.303 1.00 55.30 H new ATOM 0 HD13 ILE A 2 3.246 -5.795 -1.069 1.00 55.30 H new ATOM 30 N THR A 3 4.514 -1.733 -4.650 1.00 52.11 N ATOM 31 CA THR A 3 5.634 -1.343 -5.497 1.00 70.42 C ATOM 32 C THR A 3 6.825 -0.890 -4.660 1.00 54.12 C ATOM 33 O THR A 3 7.969 -0.945 -5.111 1.00 1.04 O ATOM 34 CB THR A 3 5.240 -0.211 -6.464 1.00 72.12 C ATOM 35 OG1 THR A 3 4.832 0.945 -5.724 1.00 40.25 O ATOM 36 CG2 THR A 3 4.113 -0.654 -7.385 1.00 53.30 C ATOM 0 H THR A 3 3.642 -1.244 -4.853 1.00 52.11 H new ATOM 0 HA THR A 3 5.914 -2.223 -6.075 1.00 70.42 H new ATOM 0 HB THR A 3 6.109 0.036 -7.073 1.00 72.12 H new ATOM 0 HG1 THR A 3 4.585 1.661 -6.346 1.00 40.25 H new ATOM 0 HG21 THR A 3 3.852 0.162 -8.059 1.00 53.30 H new ATOM 0 HG22 THR A 3 4.437 -1.516 -7.968 1.00 53.30 H new ATOM 0 HG23 THR A 3 3.242 -0.925 -6.789 1.00 53.30 H new ATOM 44 N ASP A 4 6.548 -0.443 -3.440 1.00 40.33 N ATOM 45 CA ASP A 4 7.597 0.019 -2.539 1.00 25.20 C ATOM 46 C ASP A 4 8.592 -1.100 -2.245 1.00 12.05 C ATOM 47 O ASP A 4 9.713 -0.847 -1.804 1.00 4.41 O ATOM 48 CB ASP A 4 6.988 0.533 -1.234 1.00 4.33 C ATOM 49 CG ASP A 4 6.474 1.954 -1.356 1.00 13.15 C ATOM 50 OD1 ASP A 4 7.291 2.861 -1.618 1.00 3.32 O ATOM 51 OD2 ASP A 4 5.253 2.159 -1.189 1.00 63.24 O ATOM 0 H ASP A 4 5.606 -0.391 -3.052 1.00 40.33 H new ATOM 0 HA ASP A 4 8.129 0.835 -3.028 1.00 25.20 H new ATOM 0 HB2 ASP A 4 6.170 -0.122 -0.935 1.00 4.33 H new ATOM 0 HB3 ASP A 4 7.737 0.487 -0.444 1.00 4.33 H new ATOM 56 N ILE A 5 8.173 -2.337 -2.490 1.00 14.32 N ATOM 57 CA ILE A 5 9.027 -3.494 -2.251 1.00 15.31 C ATOM 58 C ILE A 5 9.294 -4.256 -3.544 1.00 71.02 C ATOM 59 O ILE A 5 10.437 -4.593 -3.854 1.00 23.41 O ATOM 60 CB ILE A 5 8.399 -4.454 -1.223 1.00 3.53 C ATOM 61 CG1 ILE A 5 7.498 -3.682 -0.256 1.00 74.55 C ATOM 62 CG2 ILE A 5 9.486 -5.198 -0.462 1.00 30.24 C ATOM 63 CD1 ILE A 5 6.892 -4.548 0.826 1.00 23.13 C ATOM 0 H ILE A 5 7.247 -2.564 -2.854 1.00 14.32 H new ATOM 0 HA ILE A 5 9.969 -3.115 -1.854 1.00 15.31 H new ATOM 0 HB ILE A 5 7.789 -5.184 -1.754 1.00 3.53 H new ATOM 0 HG12 ILE A 5 8.077 -2.885 0.210 1.00 74.55 H new ATOM 0 HG13 ILE A 5 6.696 -3.206 -0.821 1.00 74.55 H new ATOM 0 HG21 ILE A 5 9.027 -5.873 0.261 1.00 30.24 H new ATOM 0 HG22 ILE A 5 10.091 -5.774 -1.162 1.00 30.24 H new ATOM 0 HG23 ILE A 5 10.119 -4.482 0.061 1.00 30.24 H new ATOM 0 HD11 ILE A 5 6.266 -3.935 1.474 1.00 23.13 H new ATOM 0 HD12 ILE A 5 6.285 -5.330 0.369 1.00 23.13 H new ATOM 0 HD13 ILE A 5 7.688 -5.004 1.415 1.00 23.13 H new ATOM 75 N LEU A 6 8.233 -4.523 -4.297 1.00 75.20 N ATOM 76 CA LEU A 6 8.352 -5.244 -5.559 1.00 71.54 C ATOM 77 C LEU A 6 8.396 -4.277 -6.737 1.00 44.45 C ATOM 78 O LEU A 6 8.320 -3.061 -6.558 1.00 71.14 O ATOM 79 CB LEU A 6 7.183 -6.216 -5.727 1.00 35.21 C ATOM 80 CG LEU A 6 7.462 -7.673 -5.355 1.00 52.11 C ATOM 81 CD1 LEU A 6 8.161 -7.755 -4.007 1.00 61.22 C ATOM 82 CD2 LEU A 6 6.169 -8.476 -5.337 1.00 43.04 C ATOM 0 H LEU A 6 7.280 -4.251 -4.055 1.00 75.20 H new ATOM 0 HA LEU A 6 9.285 -5.807 -5.540 1.00 71.54 H new ATOM 0 HB2 LEU A 6 6.351 -5.860 -5.120 1.00 35.21 H new ATOM 0 HB3 LEU A 6 6.856 -6.184 -6.766 1.00 35.21 H new ATOM 0 HG LEU A 6 8.122 -8.101 -6.110 1.00 52.11 H new ATOM 0 HD11 LEU A 6 8.351 -8.799 -3.759 1.00 61.22 H new ATOM 0 HD12 LEU A 6 9.107 -7.215 -4.054 1.00 61.22 H new ATOM 0 HD13 LEU A 6 7.527 -7.310 -3.241 1.00 61.22 H new ATOM 0 HD21 LEU A 6 6.387 -9.510 -5.070 1.00 43.04 H new ATOM 0 HD22 LEU A 6 5.485 -8.048 -4.604 1.00 43.04 H new ATOM 0 HD23 LEU A 6 5.708 -8.445 -6.324 1.00 43.04 H new ATOM 94 N SER A 7 8.518 -4.824 -7.942 1.00 64.35 N ATOM 95 CA SER A 7 8.574 -4.009 -9.150 1.00 64.34 C ATOM 96 C SER A 7 7.405 -4.330 -10.077 1.00 25.21 C ATOM 97 O SER A 7 7.186 -5.485 -10.440 1.00 30.42 O ATOM 98 CB SER A 7 9.898 -4.236 -9.883 1.00 70.33 C ATOM 99 OG SER A 7 10.906 -3.368 -9.396 1.00 23.13 O ATOM 0 H SER A 7 8.580 -5.828 -8.108 1.00 64.35 H new ATOM 0 HA SER A 7 8.505 -2.962 -8.855 1.00 64.34 H new ATOM 0 HB2 SER A 7 10.214 -5.272 -9.757 1.00 70.33 H new ATOM 0 HB3 SER A 7 9.758 -4.073 -10.952 1.00 70.33 H new ATOM 0 HG SER A 7 11.742 -3.534 -9.879 1.00 23.13 H new ATOM 105 N ALA A 8 6.658 -3.298 -10.456 1.00 23.55 N ATOM 106 CA ALA A 8 5.513 -3.469 -11.341 1.00 10.20 C ATOM 107 C ALA A 8 5.949 -3.976 -12.711 1.00 62.23 C ATOM 108 O ALA A 8 5.147 -4.526 -13.466 1.00 15.21 O ATOM 109 CB ALA A 8 4.753 -2.158 -11.479 1.00 32.13 C ATOM 0 H ALA A 8 6.826 -2.335 -10.164 1.00 23.55 H new ATOM 0 HA ALA A 8 4.852 -4.215 -10.900 1.00 10.20 H new ATOM 0 HB1 ALA A 8 3.900 -2.300 -12.143 1.00 32.13 H new ATOM 0 HB2 ALA A 8 4.400 -1.837 -10.499 1.00 32.13 H new ATOM 0 HB3 ALA A 8 5.413 -1.397 -11.894 1.00 32.13 H new ATOM 115 N LYS A 9 7.226 -3.788 -13.028 1.00 12.12 N ATOM 116 CA LYS A 9 7.770 -4.227 -14.307 1.00 41.44 C ATOM 117 C LYS A 9 8.485 -5.566 -14.164 1.00 20.42 C ATOM 118 O LYS A 9 9.093 -6.061 -15.113 1.00 72.13 O ATOM 119 CB LYS A 9 8.737 -3.177 -14.860 1.00 71.25 C ATOM 120 CG LYS A 9 8.665 -3.019 -16.369 1.00 54.04 C ATOM 121 CD LYS A 9 7.324 -2.452 -16.807 1.00 65.20 C ATOM 122 CE LYS A 9 7.358 -2.001 -18.259 1.00 54.21 C ATOM 123 NZ LYS A 9 7.132 -3.135 -19.198 1.00 5.22 N ATOM 0 H LYS A 9 7.904 -3.334 -12.416 1.00 12.12 H new ATOM 0 HA LYS A 9 6.940 -4.351 -15.003 1.00 41.44 H new ATOM 0 HB2 LYS A 9 8.523 -2.216 -14.392 1.00 71.25 H new ATOM 0 HB3 LYS A 9 9.755 -3.449 -14.580 1.00 71.25 H new ATOM 0 HG2 LYS A 9 9.467 -2.361 -16.706 1.00 54.04 H new ATOM 0 HG3 LYS A 9 8.825 -3.986 -16.845 1.00 54.04 H new ATOM 0 HD2 LYS A 9 6.549 -3.207 -16.677 1.00 65.20 H new ATOM 0 HD3 LYS A 9 7.058 -1.609 -16.169 1.00 65.20 H new ATOM 0 HE2 LYS A 9 6.596 -1.239 -18.420 1.00 54.21 H new ATOM 0 HE3 LYS A 9 8.322 -1.539 -18.473 1.00 54.21 H new ATOM 0 HZ1 LYS A 9 7.163 -2.786 -20.177 1.00 5.22 H new ATOM 0 HZ2 LYS A 9 7.874 -3.851 -19.062 1.00 5.22 H new ATOM 0 HZ3 LYS A 9 6.202 -3.560 -19.011 1.00 5.22 H new ATOM 137 N ASP A 10 8.407 -6.149 -12.972 1.00 51.34 N ATOM 138 CA ASP A 10 9.045 -7.433 -12.706 1.00 15.23 C ATOM 139 C ASP A 10 8.016 -8.469 -12.263 1.00 11.30 C ATOM 140 O ASP A 10 8.150 -9.657 -12.558 1.00 44.41 O ATOM 141 CB ASP A 10 10.124 -7.277 -11.634 1.00 22.44 C ATOM 142 CG ASP A 10 11.155 -6.228 -11.998 1.00 45.25 C ATOM 143 OD1 ASP A 10 11.122 -5.738 -13.147 1.00 24.04 O ATOM 144 OD2 ASP A 10 11.996 -5.897 -11.136 1.00 43.32 O ATOM 0 H ASP A 10 7.908 -5.753 -12.175 1.00 51.34 H new ATOM 0 HA ASP A 10 9.509 -7.780 -13.630 1.00 15.23 H new ATOM 0 HB2 ASP A 10 9.655 -7.008 -10.687 1.00 22.44 H new ATOM 0 HB3 ASP A 10 10.622 -8.235 -11.482 1.00 22.44 H new ATOM 149 N ILE A 11 6.990 -8.011 -11.553 1.00 4.31 N ATOM 150 CA ILE A 11 5.940 -8.898 -11.070 1.00 14.22 C ATOM 151 C ILE A 11 5.218 -9.578 -12.229 1.00 4.15 C ATOM 152 O ILE A 11 5.221 -10.803 -12.340 1.00 62.30 O ATOM 153 CB ILE A 11 4.909 -8.137 -10.214 1.00 45.25 C ATOM 154 CG1 ILE A 11 5.582 -7.543 -8.975 1.00 42.23 C ATOM 155 CG2 ILE A 11 3.769 -9.060 -9.813 1.00 53.14 C ATOM 156 CD1 ILE A 11 4.932 -6.267 -8.488 1.00 3.21 C ATOM 0 H ILE A 11 6.864 -7.031 -11.300 1.00 4.31 H new ATOM 0 HA ILE A 11 6.425 -9.654 -10.453 1.00 14.22 H new ATOM 0 HB ILE A 11 4.497 -7.321 -10.808 1.00 45.25 H new ATOM 0 HG12 ILE A 11 5.563 -8.280 -8.172 1.00 42.23 H new ATOM 0 HG13 ILE A 11 6.630 -7.344 -9.201 1.00 42.23 H new ATOM 0 HG21 ILE A 11 3.049 -8.508 -9.209 1.00 53.14 H new ATOM 0 HG22 ILE A 11 3.276 -9.440 -10.708 1.00 53.14 H new ATOM 0 HG23 ILE A 11 4.163 -9.895 -9.234 1.00 53.14 H new ATOM 0 HD11 ILE A 11 5.461 -5.902 -7.607 1.00 3.21 H new ATOM 0 HD12 ILE A 11 4.975 -5.514 -9.275 1.00 3.21 H new ATOM 0 HD13 ILE A 11 3.891 -6.464 -8.231 1.00 3.21 H new ATOM 168 N GLU A 12 4.603 -8.773 -13.089 1.00 61.45 N ATOM 169 CA GLU A 12 3.879 -9.298 -14.241 1.00 34.51 C ATOM 170 C GLU A 12 4.836 -9.945 -15.238 1.00 3.13 C ATOM 171 O GLU A 12 4.451 -10.833 -15.998 1.00 42.24 O ATOM 172 CB GLU A 12 3.088 -8.182 -14.927 1.00 23.13 C ATOM 173 CG GLU A 12 3.944 -7.277 -15.797 1.00 12.21 C ATOM 174 CD GLU A 12 3.979 -7.724 -17.245 1.00 44.34 C ATOM 175 OE1 GLU A 12 2.916 -7.698 -17.900 1.00 10.31 O ATOM 176 OE2 GLU A 12 5.070 -8.099 -17.724 1.00 74.44 O ATOM 0 H GLU A 12 4.591 -7.756 -13.010 1.00 61.45 H new ATOM 0 HA GLU A 12 3.185 -10.059 -13.884 1.00 34.51 H new ATOM 0 HB2 GLU A 12 2.305 -8.627 -15.541 1.00 23.13 H new ATOM 0 HB3 GLU A 12 2.593 -7.579 -14.166 1.00 23.13 H new ATOM 0 HG2 GLU A 12 3.559 -6.258 -15.744 1.00 12.21 H new ATOM 0 HG3 GLU A 12 4.960 -7.255 -15.403 1.00 12.21 H new ATOM 183 N SER A 13 6.086 -9.492 -15.228 1.00 30.24 N ATOM 184 CA SER A 13 7.098 -10.022 -16.133 1.00 64.52 C ATOM 185 C SER A 13 7.750 -11.272 -15.548 1.00 2.41 C ATOM 186 O SER A 13 8.688 -11.823 -16.123 1.00 3.24 O ATOM 187 CB SER A 13 8.165 -8.963 -16.417 1.00 55.41 C ATOM 188 OG SER A 13 9.125 -9.441 -17.343 1.00 2.43 O ATOM 0 H SER A 13 6.421 -8.759 -14.603 1.00 30.24 H new ATOM 0 HA SER A 13 6.607 -10.293 -17.068 1.00 64.52 H new ATOM 0 HB2 SER A 13 7.693 -8.063 -16.810 1.00 55.41 H new ATOM 0 HB3 SER A 13 8.660 -8.683 -15.487 1.00 55.41 H new ATOM 0 HG SER A 13 9.230 -10.409 -17.235 1.00 2.43 H new ATOM 194 N ALA A 14 7.245 -11.712 -14.400 1.00 62.22 N ATOM 195 CA ALA A 14 7.776 -12.897 -13.737 1.00 12.20 C ATOM 196 C ALA A 14 6.651 -13.783 -13.213 1.00 13.33 C ATOM 197 O ALA A 14 6.892 -14.741 -12.477 1.00 45.05 O ATOM 198 CB ALA A 14 8.706 -12.494 -12.602 1.00 33.31 C ATOM 0 H ALA A 14 6.469 -11.266 -13.910 1.00 62.22 H new ATOM 0 HA ALA A 14 8.343 -13.471 -14.470 1.00 12.20 H new ATOM 0 HB1 ALA A 14 9.095 -13.388 -12.116 1.00 33.31 H new ATOM 0 HB2 ALA A 14 9.534 -11.908 -13.001 1.00 33.31 H new ATOM 0 HB3 ALA A 14 8.156 -11.896 -11.875 1.00 33.31 H new ATOM 204 N LEU A 15 5.421 -13.457 -13.594 1.00 52.34 N ATOM 205 CA LEU A 15 4.257 -14.223 -13.162 1.00 2.00 C ATOM 206 C LEU A 15 4.026 -15.423 -14.074 1.00 72.24 C ATOM 207 O LEU A 15 3.608 -16.489 -13.621 1.00 53.43 O ATOM 208 CB LEU A 15 3.013 -13.333 -13.146 1.00 22.03 C ATOM 209 CG LEU A 15 2.682 -12.667 -11.810 1.00 0.32 C ATOM 210 CD1 LEU A 15 1.516 -11.704 -11.968 1.00 54.12 C ATOM 211 CD2 LEU A 15 2.370 -13.716 -10.753 1.00 72.42 C ATOM 0 H LEU A 15 5.204 -12.667 -14.202 1.00 52.34 H new ATOM 0 HA LEU A 15 4.448 -14.588 -12.153 1.00 2.00 H new ATOM 0 HB2 LEU A 15 3.139 -12.553 -13.897 1.00 22.03 H new ATOM 0 HB3 LEU A 15 2.157 -13.934 -13.452 1.00 22.03 H new ATOM 0 HG LEU A 15 3.554 -12.100 -11.484 1.00 0.32 H new ATOM 0 HD11 LEU A 15 1.295 -11.240 -11.007 1.00 54.12 H new ATOM 0 HD12 LEU A 15 1.777 -10.932 -12.692 1.00 54.12 H new ATOM 0 HD13 LEU A 15 0.639 -12.249 -12.318 1.00 54.12 H new ATOM 0 HD21 LEU A 15 2.137 -13.223 -9.809 1.00 72.42 H new ATOM 0 HD22 LEU A 15 1.515 -14.311 -11.073 1.00 72.42 H new ATOM 0 HD23 LEU A 15 3.235 -14.366 -10.619 1.00 72.42 H new ATOM 223 N SER A 16 4.303 -15.243 -15.362 1.00 34.30 N ATOM 224 CA SER A 16 4.123 -16.311 -16.339 1.00 2.11 C ATOM 225 C SER A 16 5.445 -16.651 -17.020 1.00 61.53 C ATOM 226 O SER A 16 5.651 -17.778 -17.471 1.00 65.13 O ATOM 227 CB SER A 16 3.086 -15.903 -17.387 1.00 43.21 C ATOM 228 OG SER A 16 3.063 -16.821 -18.466 1.00 61.30 O ATOM 0 H SER A 16 4.653 -14.368 -15.753 1.00 34.30 H new ATOM 0 HA SER A 16 3.767 -17.196 -15.812 1.00 2.11 H new ATOM 0 HB2 SER A 16 2.099 -15.853 -16.927 1.00 43.21 H new ATOM 0 HB3 SER A 16 3.314 -14.905 -17.760 1.00 43.21 H new ATOM 0 HG SER A 16 2.391 -16.539 -19.121 1.00 61.30 H new ATOM 234 N SER A 17 6.337 -15.669 -17.091 1.00 45.12 N ATOM 235 CA SER A 17 7.639 -15.862 -17.721 1.00 14.13 C ATOM 236 C SER A 17 8.348 -17.081 -17.140 1.00 34.53 C ATOM 237 O SER A 17 9.064 -17.792 -17.846 1.00 41.32 O ATOM 238 CB SER A 17 8.508 -14.616 -17.536 1.00 73.53 C ATOM 239 OG SER A 17 8.911 -14.086 -18.787 1.00 14.10 O ATOM 0 H SER A 17 6.183 -14.731 -16.720 1.00 45.12 H new ATOM 0 HA SER A 17 7.479 -16.030 -18.786 1.00 14.13 H new ATOM 0 HB2 SER A 17 7.953 -13.861 -16.979 1.00 73.53 H new ATOM 0 HB3 SER A 17 9.388 -14.867 -16.943 1.00 73.53 H new ATOM 0 HG SER A 17 9.464 -13.290 -18.642 1.00 14.10 H new ATOM 245 N CYS A 18 8.143 -17.317 -15.849 1.00 33.43 N ATOM 246 CA CYS A 18 8.763 -18.451 -15.171 1.00 14.53 C ATOM 247 C CYS A 18 7.747 -19.563 -14.931 1.00 52.31 C ATOM 248 O CYS A 18 7.734 -20.185 -13.870 1.00 35.24 O ATOM 249 CB CYS A 18 9.372 -18.005 -13.841 1.00 0.42 C ATOM 250 SG CYS A 18 10.548 -16.640 -13.989 1.00 5.52 S ATOM 0 H CYS A 18 7.553 -16.739 -15.251 1.00 33.43 H new ATOM 0 HA CYS A 18 9.554 -18.839 -15.813 1.00 14.53 H new ATOM 0 HB2 CYS A 18 8.568 -17.707 -13.168 1.00 0.42 H new ATOM 0 HB3 CYS A 18 9.875 -18.855 -13.380 1.00 0.42 H new ATOM 0 HG CYS A 18 11.007 -16.333 -12.812 1.00 5.52 H new ATOM 256 N GLN A 19 6.897 -19.805 -15.924 1.00 21.00 N ATOM 257 CA GLN A 19 5.876 -20.841 -15.819 1.00 41.33 C ATOM 258 C GLN A 19 5.730 -21.596 -17.136 1.00 63.40 C ATOM 259 O GLN A 19 4.663 -22.126 -17.444 1.00 22.42 O ATOM 260 CB GLN A 19 4.534 -20.225 -15.420 1.00 0.12 C ATOM 261 CG GLN A 19 4.632 -19.258 -14.251 1.00 43.21 C ATOM 262 CD GLN A 19 4.951 -19.954 -12.943 1.00 5.02 C ATOM 263 OE1 GLN A 19 4.673 -21.141 -12.774 1.00 70.51 O ATOM 264 NE2 GLN A 19 5.539 -19.217 -12.008 1.00 4.13 N ATOM 0 H GLN A 19 6.895 -19.298 -16.809 1.00 21.00 H new ATOM 0 HA GLN A 19 6.188 -21.547 -15.049 1.00 41.33 H new ATOM 0 HB2 GLN A 19 4.114 -19.702 -16.279 1.00 0.12 H new ATOM 0 HB3 GLN A 19 3.839 -21.024 -15.162 1.00 0.12 H new ATOM 0 HG2 GLN A 19 5.403 -18.517 -14.461 1.00 43.21 H new ATOM 0 HG3 GLN A 19 3.690 -18.718 -14.151 1.00 43.21 H new ATOM 0 HE21 GLN A 19 5.752 -18.236 -12.191 1.00 4.13 H new ATOM 0 HE22 GLN A 19 5.778 -19.632 -11.107 1.00 4.13 H new ATOM 273 N ALA A 20 6.810 -21.641 -17.910 1.00 21.25 N ATOM 274 CA ALA A 20 6.803 -22.333 -19.192 1.00 73.33 C ATOM 275 C ALA A 20 7.719 -23.552 -19.164 1.00 35.33 C ATOM 276 O ALA A 20 8.204 -23.951 -18.105 1.00 75.24 O ATOM 277 CB ALA A 20 7.219 -21.384 -20.306 1.00 74.35 C ATOM 0 H ALA A 20 7.701 -21.206 -17.671 1.00 21.25 H new ATOM 0 HA ALA A 20 5.787 -22.679 -19.384 1.00 73.33 H new ATOM 0 HB1 ALA A 20 7.209 -21.914 -21.258 1.00 74.35 H new ATOM 0 HB2 ALA A 20 6.522 -20.547 -20.350 1.00 74.35 H new ATOM 0 HB3 ALA A 20 8.224 -21.010 -20.109 1.00 74.35 H new ATOM 283 N ALA A 21 7.950 -24.140 -20.333 1.00 23.11 N ATOM 284 CA ALA A 21 8.809 -25.313 -20.441 1.00 50.14 C ATOM 285 C ALA A 21 10.259 -24.911 -20.687 1.00 3.43 C ATOM 286 O ALA A 21 11.185 -25.604 -20.266 1.00 64.33 O ATOM 287 CB ALA A 21 8.317 -26.226 -21.555 1.00 20.05 C ATOM 0 H ALA A 21 7.555 -23.824 -21.218 1.00 23.11 H new ATOM 0 HA ALA A 21 8.764 -25.854 -19.496 1.00 50.14 H new ATOM 0 HB1 ALA A 21 8.967 -27.098 -21.625 1.00 20.05 H new ATOM 0 HB2 ALA A 21 7.299 -26.549 -21.338 1.00 20.05 H new ATOM 0 HB3 ALA A 21 8.332 -25.686 -22.502 1.00 20.05 H new ATOM 293 N ASP A 22 10.449 -23.787 -21.370 1.00 22.14 N ATOM 294 CA ASP A 22 11.788 -23.292 -21.671 1.00 35.33 C ATOM 295 C ASP A 22 11.866 -21.782 -21.471 1.00 41.12 C ATOM 296 O ASP A 22 12.600 -21.090 -22.177 1.00 12.11 O ATOM 297 CB ASP A 22 12.176 -23.651 -23.106 1.00 51.50 C ATOM 298 CG ASP A 22 11.018 -23.503 -24.073 1.00 72.31 C ATOM 299 OD1 ASP A 22 10.727 -22.359 -24.481 1.00 35.12 O ATOM 300 OD2 ASP A 22 10.403 -24.532 -24.423 1.00 61.20 O ATOM 0 H ASP A 22 9.693 -23.202 -21.726 1.00 22.14 H new ATOM 0 HA ASP A 22 12.488 -23.767 -20.984 1.00 35.33 H new ATOM 0 HB2 ASP A 22 12.998 -23.012 -23.428 1.00 51.50 H new ATOM 0 HB3 ASP A 22 12.541 -24.678 -23.135 1.00 51.50 H new ATOM 305 N SER A 23 11.104 -21.277 -20.506 1.00 23.21 N ATOM 306 CA SER A 23 11.084 -19.848 -20.217 1.00 31.13 C ATOM 307 C SER A 23 11.731 -19.558 -18.866 1.00 13.12 C ATOM 308 O SER A 23 12.297 -18.485 -18.653 1.00 73.40 O ATOM 309 CB SER A 23 9.647 -19.324 -20.230 1.00 35.13 C ATOM 310 OG SER A 23 9.040 -19.531 -21.493 1.00 73.25 O ATOM 0 H SER A 23 10.493 -21.836 -19.911 1.00 23.21 H new ATOM 0 HA SER A 23 11.656 -19.337 -20.991 1.00 31.13 H new ATOM 0 HB2 SER A 23 9.066 -19.827 -19.457 1.00 35.13 H new ATOM 0 HB3 SER A 23 9.642 -18.261 -19.991 1.00 35.13 H new ATOM 0 HG SER A 23 8.186 -19.051 -21.528 1.00 73.25 H new ATOM 316 N PHE A 24 11.642 -20.522 -17.955 1.00 65.04 N ATOM 317 CA PHE A 24 12.218 -20.371 -16.624 1.00 32.11 C ATOM 318 C PHE A 24 13.632 -20.942 -16.575 1.00 30.04 C ATOM 319 O PHE A 24 13.827 -22.121 -16.281 1.00 10.55 O ATOM 320 CB PHE A 24 11.338 -21.067 -15.583 1.00 61.23 C ATOM 321 CG PHE A 24 11.856 -20.940 -14.179 1.00 61.32 C ATOM 322 CD1 PHE A 24 12.320 -19.724 -13.705 1.00 41.22 C ATOM 323 CD2 PHE A 24 11.878 -22.037 -13.333 1.00 65.31 C ATOM 324 CE1 PHE A 24 12.798 -19.605 -12.414 1.00 10.41 C ATOM 325 CE2 PHE A 24 12.355 -21.924 -12.041 1.00 32.15 C ATOM 326 CZ PHE A 24 12.814 -20.706 -11.580 1.00 42.31 C ATOM 0 H PHE A 24 11.177 -21.416 -18.114 1.00 65.04 H new ATOM 0 HA PHE A 24 12.267 -19.306 -16.395 1.00 32.11 H new ATOM 0 HB2 PHE A 24 10.333 -20.648 -15.630 1.00 61.23 H new ATOM 0 HB3 PHE A 24 11.255 -22.124 -15.837 1.00 61.23 H new ATOM 0 HD1 PHE A 24 12.308 -18.859 -14.352 1.00 41.22 H new ATOM 0 HD2 PHE A 24 11.518 -22.992 -13.687 1.00 65.31 H new ATOM 0 HE1 PHE A 24 13.159 -18.652 -12.057 1.00 10.41 H new ATOM 0 HE2 PHE A 24 12.369 -22.787 -11.392 1.00 32.15 H new ATOM 0 HZ PHE A 24 13.185 -20.614 -10.570 1.00 42.31 H new ATOM 336 N ASN A 25 14.615 -20.097 -16.865 1.00 44.45 N ATOM 337 CA ASN A 25 16.012 -20.516 -16.856 1.00 21.33 C ATOM 338 C ASN A 25 16.768 -19.863 -15.703 1.00 22.54 C ATOM 339 O ASN A 25 16.188 -19.130 -14.902 1.00 53.21 O ATOM 340 CB ASN A 25 16.682 -20.162 -18.185 1.00 30.31 C ATOM 341 CG ASN A 25 16.077 -18.929 -18.827 1.00 54.00 C ATOM 342 OD1 ASN A 25 15.177 -19.028 -19.662 1.00 31.15 O ATOM 343 ND2 ASN A 25 16.569 -17.758 -18.440 1.00 23.23 N ATOM 0 H ASN A 25 14.470 -19.117 -17.109 1.00 44.45 H new ATOM 0 HA ASN A 25 16.040 -21.597 -16.720 1.00 21.33 H new ATOM 0 HB2 ASN A 25 17.747 -19.997 -18.019 1.00 30.31 H new ATOM 0 HB3 ASN A 25 16.593 -21.005 -18.870 1.00 30.31 H new ATOM 0 HD21 ASN A 25 16.201 -16.894 -18.838 1.00 23.23 H new ATOM 0 HD22 ASN A 25 17.315 -17.723 -17.745 1.00 23.23 H new ATOM 350 N TYR A 26 18.066 -20.135 -15.625 1.00 2.03 N ATOM 351 CA TYR A 26 18.902 -19.576 -14.569 1.00 10.11 C ATOM 352 C TYR A 26 18.967 -18.055 -14.673 1.00 73.11 C ATOM 353 O TYR A 26 19.097 -17.357 -13.668 1.00 1.43 O ATOM 354 CB TYR A 26 20.312 -20.164 -14.641 1.00 3.40 C ATOM 355 CG TYR A 26 20.984 -19.963 -15.981 1.00 20.43 C ATOM 356 CD1 TYR A 26 21.649 -18.780 -16.277 1.00 12.00 C ATOM 357 CD2 TYR A 26 20.955 -20.959 -16.950 1.00 55.51 C ATOM 358 CE1 TYR A 26 22.263 -18.593 -17.500 1.00 41.30 C ATOM 359 CE2 TYR A 26 21.567 -20.781 -18.175 1.00 44.54 C ATOM 360 CZ TYR A 26 22.220 -19.596 -18.446 1.00 11.23 C ATOM 361 OH TYR A 26 22.832 -19.414 -19.665 1.00 12.43 O ATOM 0 H TYR A 26 18.562 -20.739 -16.280 1.00 2.03 H new ATOM 0 HA TYR A 26 18.455 -19.838 -13.610 1.00 10.11 H new ATOM 0 HB2 TYR A 26 20.926 -19.709 -13.864 1.00 3.40 H new ATOM 0 HB3 TYR A 26 20.263 -21.231 -14.425 1.00 3.40 H new ATOM 0 HD1 TYR A 26 21.687 -17.993 -15.538 1.00 12.00 H new ATOM 0 HD2 TYR A 26 20.445 -21.888 -16.741 1.00 55.51 H new ATOM 0 HE1 TYR A 26 22.774 -17.666 -17.715 1.00 41.30 H new ATOM 0 HE2 TYR A 26 21.535 -21.565 -18.917 1.00 44.54 H new ATOM 0 HH TYR A 26 22.710 -20.216 -20.215 1.00 12.43 H new ATOM 371 N LYS A 27 18.874 -17.548 -15.898 1.00 32.22 N ATOM 372 CA LYS A 27 18.919 -16.111 -16.137 1.00 5.41 C ATOM 373 C LYS A 27 17.627 -15.442 -15.680 1.00 1.23 C ATOM 374 O LYS A 27 17.635 -14.296 -15.231 1.00 4.41 O ATOM 375 CB LYS A 27 19.155 -15.827 -17.622 1.00 63.01 C ATOM 376 CG LYS A 27 20.604 -15.520 -17.960 1.00 71.02 C ATOM 377 CD LYS A 27 20.940 -14.061 -17.700 1.00 61.23 C ATOM 378 CE LYS A 27 20.826 -13.229 -18.968 1.00 43.51 C ATOM 379 NZ LYS A 27 19.522 -12.514 -19.047 1.00 62.13 N ATOM 0 H LYS A 27 18.767 -18.112 -16.741 1.00 32.22 H new ATOM 0 HA LYS A 27 19.745 -15.698 -15.558 1.00 5.41 H new ATOM 0 HB2 LYS A 27 18.830 -16.689 -18.204 1.00 63.01 H new ATOM 0 HB3 LYS A 27 18.534 -14.984 -17.925 1.00 63.01 H new ATOM 0 HG2 LYS A 27 21.260 -16.157 -17.366 1.00 71.02 H new ATOM 0 HG3 LYS A 27 20.792 -15.757 -19.007 1.00 71.02 H new ATOM 0 HD2 LYS A 27 20.269 -13.662 -16.940 1.00 61.23 H new ATOM 0 HD3 LYS A 27 21.952 -13.985 -17.303 1.00 61.23 H new ATOM 0 HE2 LYS A 27 21.640 -12.505 -19.001 1.00 43.51 H new ATOM 0 HE3 LYS A 27 20.939 -13.876 -19.838 1.00 43.51 H new ATOM 0 HZ1 LYS A 27 19.104 -12.657 -19.989 1.00 62.13 H new ATOM 0 HZ2 LYS A 27 18.877 -12.887 -18.322 1.00 62.13 H new ATOM 0 HZ3 LYS A 27 19.673 -11.498 -18.886 1.00 62.13 H new ATOM 393 N SER A 28 16.518 -16.166 -15.795 1.00 43.45 N ATOM 394 CA SER A 28 15.218 -15.641 -15.396 1.00 53.00 C ATOM 395 C SER A 28 15.126 -15.514 -13.878 1.00 72.44 C ATOM 396 O SER A 28 14.525 -14.575 -13.358 1.00 13.45 O ATOM 397 CB SER A 28 14.098 -16.547 -15.912 1.00 63.03 C ATOM 398 OG SER A 28 13.126 -15.801 -16.624 1.00 62.34 O ATOM 0 H SER A 28 16.494 -17.118 -16.161 1.00 43.45 H new ATOM 0 HA SER A 28 15.104 -14.649 -15.834 1.00 53.00 H new ATOM 0 HB2 SER A 28 14.518 -17.316 -16.561 1.00 63.03 H new ATOM 0 HB3 SER A 28 13.626 -17.060 -15.074 1.00 63.03 H new ATOM 0 HG SER A 28 12.422 -16.403 -16.945 1.00 62.34 H new ATOM 404 N PHE A 29 15.726 -16.468 -13.174 1.00 43.10 N ATOM 405 CA PHE A 29 15.712 -16.465 -11.716 1.00 22.12 C ATOM 406 C PHE A 29 16.377 -15.205 -11.168 1.00 33.40 C ATOM 407 O PHE A 29 16.115 -14.793 -10.038 1.00 35.11 O ATOM 408 CB PHE A 29 16.424 -17.707 -11.175 1.00 61.04 C ATOM 409 CG PHE A 29 16.587 -17.702 -9.682 1.00 63.33 C ATOM 410 CD1 PHE A 29 17.643 -17.028 -9.090 1.00 31.33 C ATOM 411 CD2 PHE A 29 15.685 -18.372 -8.871 1.00 64.35 C ATOM 412 CE1 PHE A 29 17.796 -17.022 -7.716 1.00 12.41 C ATOM 413 CE2 PHE A 29 15.833 -18.369 -7.497 1.00 51.33 C ATOM 414 CZ PHE A 29 16.890 -17.694 -6.919 1.00 1.31 C ATOM 0 H PHE A 29 16.228 -17.253 -13.589 1.00 43.10 H new ATOM 0 HA PHE A 29 14.673 -16.479 -11.388 1.00 22.12 H new ATOM 0 HB2 PHE A 29 15.863 -18.594 -11.468 1.00 61.04 H new ATOM 0 HB3 PHE A 29 17.407 -17.784 -11.640 1.00 61.04 H new ATOM 0 HD1 PHE A 29 18.355 -16.501 -9.709 1.00 31.33 H new ATOM 0 HD2 PHE A 29 14.857 -18.902 -9.318 1.00 64.35 H new ATOM 0 HE1 PHE A 29 18.623 -16.492 -7.266 1.00 12.41 H new ATOM 0 HE2 PHE A 29 15.123 -18.894 -6.876 1.00 51.33 H new ATOM 0 HZ PHE A 29 17.008 -17.692 -5.845 1.00 1.31 H new ATOM 424 N PHE A 30 17.239 -14.599 -11.977 1.00 52.21 N ATOM 425 CA PHE A 30 17.943 -13.387 -11.574 1.00 72.00 C ATOM 426 C PHE A 30 17.069 -12.154 -11.786 1.00 31.30 C ATOM 427 O PHE A 30 17.088 -11.221 -10.984 1.00 3.04 O ATOM 428 CB PHE A 30 19.247 -13.243 -12.362 1.00 34.31 C ATOM 429 CG PHE A 30 20.111 -14.471 -12.320 1.00 32.11 C ATOM 430 CD1 PHE A 30 20.132 -15.282 -11.196 1.00 54.34 C ATOM 431 CD2 PHE A 30 20.903 -14.814 -13.404 1.00 31.22 C ATOM 432 CE1 PHE A 30 20.925 -16.412 -11.155 1.00 25.54 C ATOM 433 CE2 PHE A 30 21.698 -15.944 -13.368 1.00 3.21 C ATOM 434 CZ PHE A 30 21.711 -16.743 -12.242 1.00 34.25 C ATOM 0 H PHE A 30 17.467 -14.927 -12.916 1.00 52.21 H new ATOM 0 HA PHE A 30 18.175 -13.468 -10.512 1.00 72.00 H new ATOM 0 HB2 PHE A 30 19.011 -13.010 -13.400 1.00 34.31 H new ATOM 0 HB3 PHE A 30 19.810 -12.398 -11.966 1.00 34.31 H new ATOM 0 HD1 PHE A 30 19.521 -15.027 -10.343 1.00 54.34 H new ATOM 0 HD2 PHE A 30 20.899 -14.192 -14.287 1.00 31.22 H new ATOM 0 HE1 PHE A 30 20.931 -17.036 -10.274 1.00 25.54 H new ATOM 0 HE2 PHE A 30 22.309 -16.202 -14.220 1.00 3.21 H new ATOM 0 HZ PHE A 30 22.334 -17.625 -12.211 1.00 34.25 H new ATOM 444 N SER A 31 16.303 -12.159 -12.873 1.00 5.33 N ATOM 445 CA SER A 31 15.425 -11.040 -13.194 1.00 4.44 C ATOM 446 C SER A 31 13.999 -11.318 -12.730 1.00 73.33 C ATOM 447 O SER A 31 13.037 -10.790 -13.289 1.00 73.32 O ATOM 448 CB SER A 31 15.441 -10.767 -14.699 1.00 73.30 C ATOM 449 OG SER A 31 14.977 -9.459 -14.985 1.00 74.45 O ATOM 0 H SER A 31 16.273 -12.925 -13.546 1.00 5.33 H new ATOM 0 HA SER A 31 15.793 -10.159 -12.669 1.00 4.44 H new ATOM 0 HB2 SER A 31 16.454 -10.889 -15.083 1.00 73.30 H new ATOM 0 HB3 SER A 31 14.816 -11.498 -15.211 1.00 73.30 H new ATOM 0 HG SER A 31 14.121 -9.309 -14.532 1.00 74.45 H new ATOM 455 N THR A 32 13.869 -12.153 -11.703 1.00 40.25 N ATOM 456 CA THR A 32 12.561 -12.504 -11.164 1.00 43.14 C ATOM 457 C THR A 32 11.929 -11.320 -10.441 1.00 60.40 C ATOM 458 O THR A 32 12.607 -10.347 -10.111 1.00 21.42 O ATOM 459 CB THR A 32 12.656 -13.695 -10.192 1.00 12.43 C ATOM 460 OG1 THR A 32 13.640 -14.627 -10.653 1.00 11.11 O ATOM 461 CG2 THR A 32 11.311 -14.393 -10.059 1.00 71.01 C ATOM 0 H THR A 32 14.654 -12.599 -11.228 1.00 40.25 H new ATOM 0 HA THR A 32 11.934 -12.785 -12.010 1.00 43.14 H new ATOM 0 HB THR A 32 12.948 -13.314 -9.213 1.00 12.43 H new ATOM 0 HG1 THR A 32 14.406 -14.623 -10.042 1.00 11.11 H new ATOM 0 HG21 THR A 32 11.403 -15.231 -9.368 1.00 71.01 H new ATOM 0 HG22 THR A 32 10.571 -13.688 -9.679 1.00 71.01 H new ATOM 0 HG23 THR A 32 10.994 -14.761 -11.035 1.00 71.01 H new ATOM 469 N VAL A 33 10.625 -11.410 -10.197 1.00 5.15 N ATOM 470 CA VAL A 33 9.902 -10.347 -9.510 1.00 14.40 C ATOM 471 C VAL A 33 10.644 -9.897 -8.256 1.00 73.43 C ATOM 472 O VAL A 33 10.648 -8.716 -7.915 1.00 10.53 O ATOM 473 CB VAL A 33 8.481 -10.796 -9.119 1.00 63.22 C ATOM 474 CG1 VAL A 33 8.526 -12.128 -8.385 1.00 14.41 C ATOM 475 CG2 VAL A 33 7.801 -9.733 -8.271 1.00 13.41 C ATOM 0 H VAL A 33 10.049 -12.208 -10.465 1.00 5.15 H new ATOM 0 HA VAL A 33 9.833 -9.511 -10.206 1.00 14.40 H new ATOM 0 HB VAL A 33 7.897 -10.929 -10.029 1.00 63.22 H new ATOM 0 HG11 VAL A 33 7.514 -12.430 -8.116 1.00 14.41 H new ATOM 0 HG12 VAL A 33 8.971 -12.885 -9.031 1.00 14.41 H new ATOM 0 HG13 VAL A 33 9.126 -12.025 -7.481 1.00 14.41 H new ATOM 0 HG21 VAL A 33 6.798 -10.067 -8.004 1.00 13.41 H new ATOM 0 HG22 VAL A 33 8.381 -9.565 -7.364 1.00 13.41 H new ATOM 0 HG23 VAL A 33 7.735 -8.804 -8.837 1.00 13.41 H new ATOM 485 N GLY A 34 11.272 -10.850 -7.574 1.00 11.14 N ATOM 486 CA GLY A 34 12.010 -10.533 -6.365 1.00 14.52 C ATOM 487 C GLY A 34 11.453 -11.238 -5.144 1.00 63.20 C ATOM 488 O GLY A 34 12.208 -11.713 -4.294 1.00 61.45 O ATOM 0 H GLY A 34 11.283 -11.835 -7.837 1.00 11.14 H new ATOM 0 HA2 GLY A 34 13.055 -10.813 -6.497 1.00 14.52 H new ATOM 0 HA3 GLY A 34 11.987 -9.456 -6.201 1.00 14.52 H new ATOM 492 N LEU A 35 10.130 -11.306 -5.054 1.00 33.20 N ATOM 493 CA LEU A 35 9.472 -11.958 -3.927 1.00 0.24 C ATOM 494 C LEU A 35 10.034 -13.358 -3.703 1.00 63.03 C ATOM 495 O LEU A 35 10.433 -13.708 -2.592 1.00 42.35 O ATOM 496 CB LEU A 35 7.963 -12.034 -4.166 1.00 0.14 C ATOM 497 CG LEU A 35 7.078 -11.474 -3.051 1.00 71.14 C ATOM 498 CD1 LEU A 35 5.615 -11.791 -3.321 1.00 63.44 C ATOM 499 CD2 LEU A 35 7.506 -12.030 -1.701 1.00 15.53 C ATOM 0 H LEU A 35 9.491 -10.918 -5.748 1.00 33.20 H new ATOM 0 HA LEU A 35 9.663 -11.363 -3.034 1.00 0.24 H new ATOM 0 HB2 LEU A 35 7.734 -11.499 -5.088 1.00 0.14 H new ATOM 0 HB3 LEU A 35 7.693 -13.078 -4.327 1.00 0.14 H new ATOM 0 HG LEU A 35 7.196 -10.391 -3.029 1.00 71.14 H new ATOM 0 HD11 LEU A 35 5.000 -11.385 -2.518 1.00 63.44 H new ATOM 0 HD12 LEU A 35 5.315 -11.344 -4.269 1.00 63.44 H new ATOM 0 HD13 LEU A 35 5.480 -12.871 -3.370 1.00 63.44 H new ATOM 0 HD21 LEU A 35 6.866 -11.621 -0.919 1.00 15.53 H new ATOM 0 HD22 LEU A 35 7.418 -13.116 -1.711 1.00 15.53 H new ATOM 0 HD23 LEU A 35 8.541 -11.751 -1.504 1.00 15.53 H new ATOM 511 N SER A 36 10.065 -14.155 -4.767 1.00 14.41 N ATOM 512 CA SER A 36 10.577 -15.518 -4.687 1.00 12.51 C ATOM 513 C SER A 36 11.997 -15.532 -4.130 1.00 62.32 C ATOM 514 O SER A 36 12.446 -16.533 -3.571 1.00 44.14 O ATOM 515 CB SER A 36 10.551 -16.176 -6.067 1.00 61.53 C ATOM 516 OG SER A 36 10.481 -15.204 -7.095 1.00 51.25 O ATOM 0 H SER A 36 9.741 -13.880 -5.694 1.00 14.41 H new ATOM 0 HA SER A 36 9.935 -16.083 -4.011 1.00 12.51 H new ATOM 0 HB2 SER A 36 11.445 -16.786 -6.199 1.00 61.53 H new ATOM 0 HB3 SER A 36 9.694 -16.846 -6.137 1.00 61.53 H new ATOM 0 HG SER A 36 9.874 -15.515 -7.798 1.00 51.25 H new ATOM 522 N SER A 37 12.699 -14.415 -4.287 1.00 43.44 N ATOM 523 CA SER A 37 14.070 -14.299 -3.805 1.00 4.15 C ATOM 524 C SER A 37 14.206 -13.133 -2.830 1.00 23.35 C ATOM 525 O SER A 37 15.230 -12.450 -2.798 1.00 62.25 O ATOM 526 CB SER A 37 15.033 -14.111 -4.979 1.00 31.32 C ATOM 527 OG SER A 37 16.381 -14.151 -4.544 1.00 62.34 O ATOM 0 H SER A 37 12.341 -13.577 -4.745 1.00 43.44 H new ATOM 0 HA SER A 37 14.323 -15.221 -3.281 1.00 4.15 H new ATOM 0 HB2 SER A 37 14.864 -14.891 -5.721 1.00 31.32 H new ATOM 0 HB3 SER A 37 14.833 -13.158 -5.468 1.00 31.32 H new ATOM 0 HG SER A 37 16.491 -13.567 -3.765 1.00 62.34 H new ATOM 533 N LYS A 38 13.166 -12.911 -2.034 1.00 33.52 N ATOM 534 CA LYS A 38 13.167 -11.830 -1.056 1.00 35.13 C ATOM 535 C LYS A 38 13.576 -12.342 0.321 1.00 23.34 C ATOM 536 O LYS A 38 13.577 -13.548 0.572 1.00 0.04 O ATOM 537 CB LYS A 38 11.782 -11.183 -0.979 1.00 50.45 C ATOM 538 CG LYS A 38 11.665 -9.900 -1.784 1.00 43.32 C ATOM 539 CD LYS A 38 12.312 -8.729 -1.064 1.00 3.33 C ATOM 540 CE LYS A 38 12.664 -7.606 -2.028 1.00 75.21 C ATOM 541 NZ LYS A 38 12.962 -6.334 -1.314 1.00 23.35 N ATOM 0 H LYS A 38 12.310 -13.466 -2.047 1.00 33.52 H new ATOM 0 HA LYS A 38 13.893 -11.084 -1.378 1.00 35.13 H new ATOM 0 HB2 LYS A 38 11.037 -11.895 -1.335 1.00 50.45 H new ATOM 0 HB3 LYS A 38 11.547 -10.971 0.064 1.00 50.45 H new ATOM 0 HG2 LYS A 38 12.137 -10.036 -2.757 1.00 43.32 H new ATOM 0 HG3 LYS A 38 10.614 -9.679 -1.968 1.00 43.32 H new ATOM 0 HD2 LYS A 38 11.634 -8.353 -0.298 1.00 3.33 H new ATOM 0 HD3 LYS A 38 13.214 -9.068 -0.554 1.00 3.33 H new ATOM 0 HE2 LYS A 38 13.528 -7.898 -2.625 1.00 75.21 H new ATOM 0 HE3 LYS A 38 11.836 -7.449 -2.720 1.00 75.21 H new ATOM 0 HZ1 LYS A 38 13.080 -5.567 -2.006 1.00 23.35 H new ATOM 0 HZ2 LYS A 38 12.176 -6.104 -0.673 1.00 23.35 H new ATOM 0 HZ3 LYS A 38 13.838 -6.442 -0.764 1.00 23.35 H new ATOM 555 N THR A 39 13.923 -11.419 1.212 1.00 4.44 N ATOM 556 CA THR A 39 14.335 -11.777 2.564 1.00 53.31 C ATOM 557 C THR A 39 13.131 -12.127 3.430 1.00 35.43 C ATOM 558 O THR A 39 12.007 -11.689 3.181 1.00 23.10 O ATOM 559 CB THR A 39 15.119 -10.633 3.234 1.00 42.10 C ATOM 560 OG1 THR A 39 16.391 -11.110 3.686 1.00 64.44 O ATOM 561 CG2 THR A 39 14.341 -10.059 4.408 1.00 4.44 C ATOM 0 H THR A 39 13.927 -10.417 1.022 1.00 4.44 H new ATOM 0 HA THR A 39 14.983 -12.649 2.477 1.00 53.31 H new ATOM 0 HB THR A 39 15.268 -9.844 2.497 1.00 42.10 H new ATOM 0 HG1 THR A 39 16.884 -10.376 4.109 1.00 64.44 H new ATOM 0 HG21 THR A 39 14.915 -9.253 4.865 1.00 4.44 H new ATOM 0 HG22 THR A 39 13.385 -9.670 4.056 1.00 4.44 H new ATOM 0 HG23 THR A 39 14.165 -10.842 5.145 1.00 4.44 H new ATOM 569 N PRO A 40 13.367 -12.936 4.474 1.00 72.22 N ATOM 570 CA PRO A 40 12.313 -13.363 5.399 1.00 1.44 C ATOM 571 C PRO A 40 11.812 -12.218 6.274 1.00 21.52 C ATOM 572 O PRO A 40 12.143 -12.138 7.457 1.00 23.02 O ATOM 573 CB PRO A 40 13.003 -14.428 6.255 1.00 14.15 C ATOM 574 CG PRO A 40 14.451 -14.082 6.196 1.00 34.53 C ATOM 575 CD PRO A 40 14.681 -13.496 4.831 1.00 60.41 C ATOM 0 HA PRO A 40 11.430 -13.726 4.873 1.00 1.44 H new ATOM 0 HB2 PRO A 40 12.634 -14.412 7.280 1.00 14.15 H new ATOM 0 HB3 PRO A 40 12.819 -15.429 5.865 1.00 14.15 H new ATOM 0 HG2 PRO A 40 14.714 -13.368 6.977 1.00 34.53 H new ATOM 0 HG3 PRO A 40 15.070 -14.966 6.351 1.00 34.53 H new ATOM 0 HD2 PRO A 40 15.454 -12.728 4.849 1.00 60.41 H new ATOM 0 HD3 PRO A 40 15.002 -14.254 4.117 1.00 60.41 H new ATOM 583 N ASP A 41 11.012 -11.336 5.685 1.00 23.33 N ATOM 584 CA ASP A 41 10.464 -10.197 6.412 1.00 41.10 C ATOM 585 C ASP A 41 9.568 -9.356 5.508 1.00 32.21 C ATOM 586 O ASP A 41 8.482 -8.939 5.910 1.00 21.13 O ATOM 587 CB ASP A 41 11.593 -9.334 6.977 1.00 44.34 C ATOM 588 CG ASP A 41 11.384 -8.989 8.438 1.00 35.20 C ATOM 589 OD1 ASP A 41 10.273 -8.537 8.788 1.00 41.43 O ATOM 590 OD2 ASP A 41 12.329 -9.173 9.232 1.00 23.12 O ATOM 0 H ASP A 41 10.729 -11.388 4.707 1.00 23.33 H new ATOM 0 HA ASP A 41 9.862 -10.579 7.237 1.00 41.10 H new ATOM 0 HB2 ASP A 41 12.540 -9.861 6.863 1.00 44.34 H new ATOM 0 HB3 ASP A 41 11.668 -8.414 6.397 1.00 44.34 H new ATOM 595 N GLN A 42 10.031 -9.111 4.287 1.00 72.24 N ATOM 596 CA GLN A 42 9.271 -8.319 3.327 1.00 42.40 C ATOM 597 C GLN A 42 8.191 -9.162 2.658 1.00 64.53 C ATOM 598 O GLN A 42 7.168 -8.640 2.214 1.00 65.24 O ATOM 599 CB GLN A 42 10.204 -7.730 2.268 1.00 45.42 C ATOM 600 CG GLN A 42 11.442 -7.064 2.849 1.00 34.42 C ATOM 601 CD GLN A 42 11.125 -6.185 4.043 1.00 51.13 C ATOM 602 OE1 GLN A 42 11.662 -6.381 5.133 1.00 25.10 O ATOM 603 NE2 GLN A 42 10.248 -5.208 3.842 1.00 1.05 N ATOM 0 H GLN A 42 10.928 -9.449 3.939 1.00 72.24 H new ATOM 0 HA GLN A 42 8.787 -7.506 3.868 1.00 42.40 H new ATOM 0 HB2 GLN A 42 10.514 -8.523 1.587 1.00 45.42 H new ATOM 0 HB3 GLN A 42 9.653 -6.999 1.676 1.00 45.42 H new ATOM 0 HG2 GLN A 42 12.157 -7.831 3.147 1.00 34.42 H new ATOM 0 HG3 GLN A 42 11.923 -6.463 2.077 1.00 34.42 H new ATOM 0 HE21 GLN A 42 9.827 -5.082 2.921 1.00 1.05 H new ATOM 0 HE22 GLN A 42 9.995 -4.584 4.608 1.00 1.05 H new ATOM 612 N ILE A 43 8.426 -10.468 2.589 1.00 62.44 N ATOM 613 CA ILE A 43 7.473 -11.384 1.974 1.00 50.00 C ATOM 614 C ILE A 43 6.117 -11.312 2.667 1.00 34.53 C ATOM 615 O ILE A 43 5.088 -11.100 2.024 1.00 24.22 O ATOM 616 CB ILE A 43 7.982 -12.837 2.014 1.00 33.15 C ATOM 617 CG1 ILE A 43 9.297 -12.962 1.243 1.00 51.33 C ATOM 618 CG2 ILE A 43 6.934 -13.781 1.443 1.00 63.00 C ATOM 619 CD1 ILE A 43 9.908 -14.344 1.310 1.00 43.32 C ATOM 0 H ILE A 43 9.268 -10.916 2.951 1.00 62.44 H new ATOM 0 HA ILE A 43 7.364 -11.075 0.934 1.00 50.00 H new ATOM 0 HB ILE A 43 8.165 -13.114 3.052 1.00 33.15 H new ATOM 0 HG12 ILE A 43 9.123 -12.701 0.199 1.00 51.33 H new ATOM 0 HG13 ILE A 43 10.010 -12.239 1.638 1.00 51.33 H new ATOM 0 HG21 ILE A 43 7.308 -14.804 1.478 1.00 63.00 H new ATOM 0 HG22 ILE A 43 6.020 -13.709 2.032 1.00 63.00 H new ATOM 0 HG23 ILE A 43 6.722 -13.507 0.409 1.00 63.00 H new ATOM 0 HD11 ILE A 43 10.838 -14.359 0.741 1.00 43.32 H new ATOM 0 HD12 ILE A 43 10.114 -14.601 2.349 1.00 43.32 H new ATOM 0 HD13 ILE A 43 9.213 -15.070 0.888 1.00 43.32 H new ATOM 631 N LYS A 44 6.121 -11.489 3.984 1.00 25.51 N ATOM 632 CA LYS A 44 4.893 -11.442 4.767 1.00 34.24 C ATOM 633 C LYS A 44 4.129 -10.149 4.504 1.00 53.43 C ATOM 634 O LYS A 44 2.908 -10.158 4.340 1.00 64.10 O ATOM 635 CB LYS A 44 5.210 -11.565 6.260 1.00 54.34 C ATOM 636 CG LYS A 44 6.375 -10.700 6.707 1.00 44.33 C ATOM 637 CD LYS A 44 6.548 -10.734 8.216 1.00 42.40 C ATOM 638 CE LYS A 44 6.658 -9.332 8.796 1.00 11.10 C ATOM 639 NZ LYS A 44 7.441 -9.315 10.062 1.00 22.44 N ATOM 0 H LYS A 44 6.963 -11.667 4.532 1.00 25.51 H new ATOM 0 HA LYS A 44 4.267 -12.281 4.464 1.00 34.24 H new ATOM 0 HB2 LYS A 44 4.325 -11.293 6.835 1.00 54.34 H new ATOM 0 HB3 LYS A 44 5.432 -12.607 6.491 1.00 54.34 H new ATOM 0 HG2 LYS A 44 7.291 -11.045 6.227 1.00 44.33 H new ATOM 0 HG3 LYS A 44 6.212 -9.673 6.382 1.00 44.33 H new ATOM 0 HD2 LYS A 44 5.702 -11.251 8.669 1.00 42.40 H new ATOM 0 HD3 LYS A 44 7.442 -11.304 8.468 1.00 42.40 H new ATOM 0 HE2 LYS A 44 7.131 -8.674 8.067 1.00 11.10 H new ATOM 0 HE3 LYS A 44 5.659 -8.936 8.981 1.00 11.10 H new ATOM 0 HZ1 LYS A 44 7.034 -8.613 10.713 1.00 22.44 H new ATOM 0 HZ2 LYS A 44 7.408 -10.256 10.503 1.00 22.44 H new ATOM 0 HZ3 LYS A 44 8.429 -9.064 9.856 1.00 22.44 H new ATOM 653 N LYS A 45 4.854 -9.036 4.462 1.00 23.35 N ATOM 654 CA LYS A 45 4.246 -7.734 4.216 1.00 62.23 C ATOM 655 C LYS A 45 3.556 -7.705 2.856 1.00 50.02 C ATOM 656 O LYS A 45 2.672 -6.882 2.615 1.00 63.55 O ATOM 657 CB LYS A 45 5.306 -6.632 4.286 1.00 73.14 C ATOM 658 CG LYS A 45 5.303 -5.868 5.598 1.00 21.23 C ATOM 659 CD LYS A 45 4.100 -4.946 5.705 1.00 60.15 C ATOM 660 CE LYS A 45 4.166 -3.823 4.681 1.00 5.00 C ATOM 661 NZ LYS A 45 3.541 -2.571 5.190 1.00 61.00 N ATOM 0 H LYS A 45 5.865 -9.010 4.595 1.00 23.35 H new ATOM 0 HA LYS A 45 3.497 -7.558 4.988 1.00 62.23 H new ATOM 0 HB2 LYS A 45 6.290 -7.076 4.136 1.00 73.14 H new ATOM 0 HB3 LYS A 45 5.144 -5.931 3.467 1.00 73.14 H new ATOM 0 HG2 LYS A 45 5.298 -6.572 6.430 1.00 21.23 H new ATOM 0 HG3 LYS A 45 6.219 -5.283 5.681 1.00 21.23 H new ATOM 0 HD2 LYS A 45 3.186 -5.521 5.558 1.00 60.15 H new ATOM 0 HD3 LYS A 45 4.053 -4.523 6.708 1.00 60.15 H new ATOM 0 HE2 LYS A 45 5.207 -3.630 4.421 1.00 5.00 H new ATOM 0 HE3 LYS A 45 3.661 -4.135 3.767 1.00 5.00 H new ATOM 0 HZ1 LYS A 45 3.606 -1.830 4.463 1.00 61.00 H new ATOM 0 HZ2 LYS A 45 2.541 -2.749 5.415 1.00 61.00 H new ATOM 0 HZ3 LYS A 45 4.038 -2.259 6.048 1.00 61.00 H new ATOM 675 N VAL A 46 3.964 -8.609 1.971 1.00 40.35 N ATOM 676 CA VAL A 46 3.383 -8.688 0.636 1.00 51.13 C ATOM 677 C VAL A 46 2.123 -9.547 0.635 1.00 42.32 C ATOM 678 O VAL A 46 1.304 -9.466 -0.281 1.00 45.02 O ATOM 679 CB VAL A 46 4.386 -9.266 -0.380 1.00 21.52 C ATOM 680 CG1 VAL A 46 3.763 -9.337 -1.766 1.00 10.34 C ATOM 681 CG2 VAL A 46 5.661 -8.436 -0.401 1.00 32.51 C ATOM 0 H VAL A 46 4.695 -9.297 2.154 1.00 40.35 H new ATOM 0 HA VAL A 46 3.126 -7.670 0.342 1.00 51.13 H new ATOM 0 HB VAL A 46 4.644 -10.279 -0.072 1.00 21.52 H new ATOM 0 HG11 VAL A 46 4.487 -9.748 -2.470 1.00 10.34 H new ATOM 0 HG12 VAL A 46 2.882 -9.978 -1.736 1.00 10.34 H new ATOM 0 HG13 VAL A 46 3.473 -8.336 -2.086 1.00 10.34 H new ATOM 0 HG21 VAL A 46 6.358 -8.859 -1.124 1.00 32.51 H new ATOM 0 HG22 VAL A 46 5.423 -7.410 -0.683 1.00 32.51 H new ATOM 0 HG23 VAL A 46 6.116 -8.444 0.589 1.00 32.51 H new ATOM 691 N PHE A 47 1.974 -10.369 1.668 1.00 73.01 N ATOM 692 CA PHE A 47 0.813 -11.244 1.787 1.00 63.23 C ATOM 693 C PHE A 47 -0.344 -10.523 2.472 1.00 24.34 C ATOM 694 O PHE A 47 -1.506 -10.889 2.302 1.00 22.32 O ATOM 695 CB PHE A 47 1.178 -12.507 2.570 1.00 3.20 C ATOM 696 CG PHE A 47 0.092 -12.972 3.498 1.00 44.42 C ATOM 697 CD1 PHE A 47 -0.966 -13.729 3.022 1.00 30.04 C ATOM 698 CD2 PHE A 47 0.130 -12.652 4.845 1.00 2.43 C ATOM 699 CE1 PHE A 47 -1.967 -14.157 3.874 1.00 61.21 C ATOM 700 CE2 PHE A 47 -0.868 -13.077 5.702 1.00 63.32 C ATOM 701 CZ PHE A 47 -1.917 -13.832 5.215 1.00 31.04 C ATOM 0 H PHE A 47 2.642 -10.448 2.435 1.00 73.01 H new ATOM 0 HA PHE A 47 0.498 -11.526 0.783 1.00 63.23 H new ATOM 0 HB2 PHE A 47 1.411 -13.306 1.867 1.00 3.20 H new ATOM 0 HB3 PHE A 47 2.083 -12.318 3.148 1.00 3.20 H new ATOM 0 HD1 PHE A 47 -1.009 -13.988 1.974 1.00 30.04 H new ATOM 0 HD2 PHE A 47 0.949 -12.063 5.231 1.00 2.43 H new ATOM 0 HE1 PHE A 47 -2.788 -14.745 3.491 1.00 61.21 H new ATOM 0 HE2 PHE A 47 -0.827 -12.819 6.750 1.00 63.32 H new ATOM 0 HZ PHE A 47 -2.697 -14.168 5.882 1.00 31.04 H new ATOM 711 N GLY A 48 -0.015 -9.496 3.250 1.00 54.43 N ATOM 712 CA GLY A 48 -1.037 -8.740 3.950 1.00 0.45 C ATOM 713 C GLY A 48 -1.902 -7.924 3.010 1.00 30.02 C ATOM 714 O GLY A 48 -2.911 -7.352 3.424 1.00 72.14 O ATOM 0 H GLY A 48 0.940 -9.174 3.408 1.00 54.43 H new ATOM 0 HA2 GLY A 48 -1.668 -9.426 4.516 1.00 0.45 H new ATOM 0 HA3 GLY A 48 -0.562 -8.075 4.671 1.00 0.45 H new ATOM 718 N ILE A 49 -1.506 -7.869 1.743 1.00 53.40 N ATOM 719 CA ILE A 49 -2.253 -7.116 0.742 1.00 22.33 C ATOM 720 C ILE A 49 -3.240 -8.013 0.003 1.00 20.55 C ATOM 721 O ILE A 49 -4.130 -7.531 -0.697 1.00 55.53 O ATOM 722 CB ILE A 49 -1.312 -6.454 -0.282 1.00 31.51 C ATOM 723 CG1 ILE A 49 -0.081 -5.880 0.421 1.00 4.40 C ATOM 724 CG2 ILE A 49 -2.047 -5.366 -1.050 1.00 2.22 C ATOM 725 CD1 ILE A 49 0.904 -5.226 -0.523 1.00 51.31 C ATOM 0 H ILE A 49 -0.673 -8.336 1.385 1.00 53.40 H new ATOM 0 HA ILE A 49 -2.801 -6.339 1.275 1.00 22.33 H new ATOM 0 HB ILE A 49 -0.980 -7.211 -0.992 1.00 31.51 H new ATOM 0 HG12 ILE A 49 -0.404 -5.148 1.161 1.00 4.40 H new ATOM 0 HG13 ILE A 49 0.424 -6.680 0.963 1.00 4.40 H new ATOM 0 HG21 ILE A 49 -1.369 -4.907 -1.770 1.00 2.22 H new ATOM 0 HG22 ILE A 49 -2.895 -5.803 -1.577 1.00 2.22 H new ATOM 0 HG23 ILE A 49 -2.404 -4.607 -0.354 1.00 2.22 H new ATOM 0 HD11 ILE A 49 1.752 -4.842 0.044 1.00 51.31 H new ATOM 0 HD12 ILE A 49 1.256 -5.960 -1.248 1.00 51.31 H new ATOM 0 HD13 ILE A 49 0.415 -4.404 -1.047 1.00 51.31 H new ATOM 737 N LEU A 50 -3.078 -9.322 0.166 1.00 44.11 N ATOM 738 CA LEU A 50 -3.956 -10.288 -0.484 1.00 61.42 C ATOM 739 C LEU A 50 -5.222 -10.511 0.336 1.00 32.44 C ATOM 740 O LEU A 50 -6.335 -10.414 -0.182 1.00 22.43 O ATOM 741 CB LEU A 50 -3.225 -11.617 -0.686 1.00 4.32 C ATOM 742 CG LEU A 50 -1.706 -11.530 -0.840 1.00 22.11 C ATOM 743 CD1 LEU A 50 -1.107 -12.917 -1.016 1.00 52.12 C ATOM 744 CD2 LEU A 50 -1.339 -10.636 -2.015 1.00 51.51 C ATOM 0 H LEU A 50 -2.347 -9.738 0.743 1.00 44.11 H new ATOM 0 HA LEU A 50 -4.241 -9.886 -1.456 1.00 61.42 H new ATOM 0 HB2 LEU A 50 -3.448 -12.264 0.162 1.00 4.32 H new ATOM 0 HB3 LEU A 50 -3.633 -12.102 -1.573 1.00 4.32 H new ATOM 0 HG LEU A 50 -1.293 -11.090 0.068 1.00 22.11 H new ATOM 0 HD11 LEU A 50 -0.025 -12.835 -1.124 1.00 52.12 H new ATOM 0 HD12 LEU A 50 -1.339 -13.527 -0.143 1.00 52.12 H new ATOM 0 HD13 LEU A 50 -1.526 -13.384 -1.907 1.00 52.12 H new ATOM 0 HD21 LEU A 50 -0.254 -10.586 -2.109 1.00 51.51 H new ATOM 0 HD22 LEU A 50 -1.764 -11.046 -2.931 1.00 51.51 H new ATOM 0 HD23 LEU A 50 -1.735 -9.634 -1.848 1.00 51.51 H new ATOM 756 N ASP A 51 -5.045 -10.808 1.619 1.00 20.40 N ATOM 757 CA ASP A 51 -6.173 -11.042 2.513 1.00 54.12 C ATOM 758 C ASP A 51 -7.289 -10.034 2.254 1.00 71.20 C ATOM 759 O ASP A 51 -7.051 -8.827 2.217 1.00 72.44 O ATOM 760 CB ASP A 51 -5.722 -10.958 3.972 1.00 62.03 C ATOM 761 CG ASP A 51 -4.576 -11.902 4.278 1.00 31.32 C ATOM 762 OD1 ASP A 51 -3.478 -11.703 3.719 1.00 5.44 O ATOM 763 OD2 ASP A 51 -4.778 -12.842 5.076 1.00 12.44 O ATOM 0 H ASP A 51 -4.131 -10.892 2.063 1.00 20.40 H new ATOM 0 HA ASP A 51 -6.558 -12.043 2.317 1.00 54.12 H new ATOM 0 HB2 ASP A 51 -5.417 -9.936 4.197 1.00 62.03 H new ATOM 0 HB3 ASP A 51 -6.564 -11.190 4.624 1.00 62.03 H new ATOM 768 N GLN A 52 -8.506 -10.539 2.075 1.00 4.11 N ATOM 769 CA GLN A 52 -9.657 -9.682 1.818 1.00 72.31 C ATOM 770 C GLN A 52 -9.701 -8.519 2.803 1.00 34.24 C ATOM 771 O GLN A 52 -9.912 -7.371 2.414 1.00 52.51 O ATOM 772 CB GLN A 52 -10.952 -10.492 1.908 1.00 61.02 C ATOM 773 CG GLN A 52 -10.967 -11.490 3.055 1.00 51.33 C ATOM 774 CD GLN A 52 -12.183 -11.335 3.947 1.00 3.51 C ATOM 775 OE1 GLN A 52 -12.867 -12.310 4.259 1.00 41.22 O ATOM 776 NE2 GLN A 52 -12.458 -10.104 4.364 1.00 74.31 N ATOM 0 H GLN A 52 -8.720 -11.536 2.103 1.00 4.11 H new ATOM 0 HA GLN A 52 -9.559 -9.277 0.811 1.00 72.31 H new ATOM 0 HB2 GLN A 52 -11.792 -9.807 2.022 1.00 61.02 H new ATOM 0 HB3 GLN A 52 -11.102 -11.027 0.970 1.00 61.02 H new ATOM 0 HG2 GLN A 52 -10.944 -12.502 2.651 1.00 51.33 H new ATOM 0 HG3 GLN A 52 -10.064 -11.365 3.653 1.00 51.33 H new ATOM 0 HE21 GLN A 52 -11.864 -9.325 4.081 1.00 74.31 H new ATOM 0 HE22 GLN A 52 -13.263 -9.938 4.967 1.00 74.31 H new ATOM 785 N ASP A 53 -9.502 -8.825 4.081 1.00 41.24 N ATOM 786 CA ASP A 53 -9.518 -7.805 5.122 1.00 13.55 C ATOM 787 C ASP A 53 -8.566 -8.170 6.256 1.00 22.55 C ATOM 788 O ASP A 53 -8.726 -7.714 7.389 1.00 50.45 O ATOM 789 CB ASP A 53 -10.936 -7.625 5.668 1.00 23.22 C ATOM 790 CG ASP A 53 -11.075 -6.379 6.520 1.00 41.31 C ATOM 791 OD1 ASP A 53 -10.117 -5.578 6.561 1.00 12.20 O ATOM 792 OD2 ASP A 53 -12.142 -6.204 7.145 1.00 43.54 O ATOM 0 H ASP A 53 -9.328 -9.771 4.420 1.00 41.24 H new ATOM 0 HA ASP A 53 -9.185 -6.866 4.680 1.00 13.55 H new ATOM 0 HB2 ASP A 53 -11.638 -7.573 4.836 1.00 23.22 H new ATOM 0 HB3 ASP A 53 -11.208 -8.499 6.260 1.00 23.22 H new ATOM 797 N LYS A 54 -7.574 -8.999 5.945 1.00 13.55 N ATOM 798 CA LYS A 54 -6.595 -9.427 6.937 1.00 1.11 C ATOM 799 C LYS A 54 -7.277 -10.123 8.111 1.00 53.44 C ATOM 800 O LYS A 54 -7.217 -9.649 9.245 1.00 32.33 O ATOM 801 CB LYS A 54 -5.790 -8.227 7.440 1.00 3.33 C ATOM 802 CG LYS A 54 -4.856 -7.640 6.396 1.00 52.51 C ATOM 803 CD LYS A 54 -3.485 -8.293 6.443 1.00 11.33 C ATOM 804 CE LYS A 54 -2.484 -7.432 7.198 1.00 24.45 C ATOM 805 NZ LYS A 54 -1.303 -8.221 7.647 1.00 4.43 N ATOM 0 H LYS A 54 -7.427 -9.388 5.013 1.00 13.55 H new ATOM 0 HA LYS A 54 -5.919 -10.137 6.460 1.00 1.11 H new ATOM 0 HB2 LYS A 54 -6.480 -7.452 7.775 1.00 3.33 H new ATOM 0 HB3 LYS A 54 -5.206 -8.531 8.309 1.00 3.33 H new ATOM 0 HG2 LYS A 54 -5.289 -7.772 5.404 1.00 52.51 H new ATOM 0 HG3 LYS A 54 -4.755 -6.567 6.560 1.00 52.51 H new ATOM 0 HD2 LYS A 54 -3.562 -9.269 6.922 1.00 11.33 H new ATOM 0 HD3 LYS A 54 -3.127 -8.464 5.428 1.00 11.33 H new ATOM 0 HE2 LYS A 54 -2.153 -6.614 6.558 1.00 24.45 H new ATOM 0 HE3 LYS A 54 -2.971 -6.983 8.063 1.00 24.45 H new ATOM 0 HZ1 LYS A 54 -0.644 -7.599 8.158 1.00 4.43 H new ATOM 0 HZ2 LYS A 54 -1.616 -8.986 8.278 1.00 4.43 H new ATOM 0 HZ3 LYS A 54 -0.823 -8.629 6.819 1.00 4.43 H new ATOM 819 N SER A 55 -7.925 -11.249 7.830 1.00 63.03 N ATOM 820 CA SER A 55 -8.620 -12.009 8.862 1.00 53.31 C ATOM 821 C SER A 55 -7.707 -13.073 9.461 1.00 22.54 C ATOM 822 O SER A 55 -8.169 -14.005 10.119 1.00 5.34 O ATOM 823 CB SER A 55 -9.876 -12.664 8.283 1.00 23.55 C ATOM 824 OG SER A 55 -10.511 -11.812 7.347 1.00 41.14 O ATOM 0 H SER A 55 -7.983 -11.655 6.896 1.00 63.03 H new ATOM 0 HA SER A 55 -8.911 -11.319 9.654 1.00 53.31 H new ATOM 0 HB2 SER A 55 -9.610 -13.605 7.801 1.00 23.55 H new ATOM 0 HB3 SER A 55 -10.569 -12.904 9.089 1.00 23.55 H new ATOM 0 HG SER A 55 -11.309 -12.255 6.991 1.00 41.14 H new ATOM 830 N GLY A 56 -6.406 -12.928 9.228 1.00 2.10 N ATOM 831 CA GLY A 56 -5.447 -13.883 9.751 1.00 61.40 C ATOM 832 C GLY A 56 -4.989 -14.878 8.703 1.00 45.34 C ATOM 833 O GLY A 56 -3.789 -15.072 8.503 1.00 52.53 O ATOM 0 H GLY A 56 -5.999 -12.166 8.686 1.00 2.10 H new ATOM 0 HA2 GLY A 56 -4.582 -13.347 10.142 1.00 61.40 H new ATOM 0 HA3 GLY A 56 -5.894 -14.421 10.587 1.00 61.40 H new ATOM 837 N PHE A 57 -5.945 -15.511 8.032 1.00 30.31 N ATOM 838 CA PHE A 57 -5.633 -16.493 7.000 1.00 32.42 C ATOM 839 C PHE A 57 -6.391 -16.188 5.712 1.00 74.03 C ATOM 840 O PHE A 57 -7.243 -15.299 5.676 1.00 45.20 O ATOM 841 CB PHE A 57 -5.978 -17.903 7.487 1.00 53.54 C ATOM 842 CG PHE A 57 -5.442 -18.213 8.855 1.00 50.51 C ATOM 843 CD1 PHE A 57 -4.137 -18.648 9.020 1.00 72.22 C ATOM 844 CD2 PHE A 57 -6.243 -18.069 9.976 1.00 12.33 C ATOM 845 CE1 PHE A 57 -3.640 -18.934 10.278 1.00 54.14 C ATOM 846 CE2 PHE A 57 -5.752 -18.353 11.236 1.00 2.55 C ATOM 847 CZ PHE A 57 -4.449 -18.787 11.387 1.00 13.23 C ATOM 0 H PHE A 57 -6.942 -15.362 8.184 1.00 30.31 H new ATOM 0 HA PHE A 57 -4.564 -16.439 6.793 1.00 32.42 H new ATOM 0 HB2 PHE A 57 -7.062 -18.021 7.495 1.00 53.54 H new ATOM 0 HB3 PHE A 57 -5.583 -18.630 6.778 1.00 53.54 H new ATOM 0 HD1 PHE A 57 -3.500 -18.765 8.156 1.00 72.22 H new ATOM 0 HD2 PHE A 57 -7.263 -17.731 9.864 1.00 12.33 H new ATOM 0 HE1 PHE A 57 -2.621 -19.272 10.393 1.00 54.14 H new ATOM 0 HE2 PHE A 57 -6.386 -18.236 12.102 1.00 2.55 H new ATOM 0 HZ PHE A 57 -4.064 -19.011 12.371 1.00 13.23 H new ATOM 857 N ILE A 58 -6.076 -16.931 4.656 1.00 3.04 N ATOM 858 CA ILE A 58 -6.727 -16.740 3.366 1.00 21.43 C ATOM 859 C ILE A 58 -7.289 -18.055 2.835 1.00 43.44 C ATOM 860 O ILE A 58 -6.539 -18.938 2.419 1.00 54.30 O ATOM 861 CB ILE A 58 -5.755 -16.153 2.326 1.00 2.44 C ATOM 862 CG1 ILE A 58 -5.520 -14.665 2.599 1.00 71.41 C ATOM 863 CG2 ILE A 58 -6.295 -16.360 0.919 1.00 14.05 C ATOM 864 CD1 ILE A 58 -4.494 -14.037 1.682 1.00 73.54 C ATOM 0 H ILE A 58 -5.374 -17.671 4.669 1.00 3.04 H new ATOM 0 HA ILE A 58 -7.544 -16.036 3.525 1.00 21.43 H new ATOM 0 HB ILE A 58 -4.801 -16.674 2.408 1.00 2.44 H new ATOM 0 HG12 ILE A 58 -6.464 -14.131 2.494 1.00 71.41 H new ATOM 0 HG13 ILE A 58 -5.197 -14.540 3.632 1.00 71.41 H new ATOM 0 HG21 ILE A 58 -5.596 -15.940 0.196 1.00 14.05 H new ATOM 0 HG22 ILE A 58 -6.416 -17.426 0.729 1.00 14.05 H new ATOM 0 HG23 ILE A 58 -7.260 -15.863 0.823 1.00 14.05 H new ATOM 0 HD11 ILE A 58 -4.379 -12.982 1.933 1.00 73.54 H new ATOM 0 HD12 ILE A 58 -3.538 -14.545 1.804 1.00 73.54 H new ATOM 0 HD13 ILE A 58 -4.825 -14.130 0.648 1.00 73.54 H new ATOM 876 N GLU A 59 -8.613 -18.175 2.850 1.00 65.31 N ATOM 877 CA GLU A 59 -9.274 -19.382 2.368 1.00 55.10 C ATOM 878 C GLU A 59 -9.193 -19.477 0.847 1.00 3.21 C ATOM 879 O GLU A 59 -8.905 -18.492 0.169 1.00 45.44 O ATOM 880 CB GLU A 59 -10.738 -19.400 2.813 1.00 13.31 C ATOM 881 CG GLU A 59 -10.939 -18.986 4.261 1.00 12.13 C ATOM 882 CD GLU A 59 -12.388 -19.077 4.698 1.00 13.13 C ATOM 883 OE1 GLU A 59 -12.825 -20.183 5.080 1.00 53.43 O ATOM 884 OE2 GLU A 59 -13.085 -18.041 4.659 1.00 33.20 O ATOM 0 H GLU A 59 -9.248 -17.453 3.190 1.00 65.31 H new ATOM 0 HA GLU A 59 -8.760 -20.242 2.796 1.00 55.10 H new ATOM 0 HB2 GLU A 59 -11.313 -18.733 2.170 1.00 13.31 H new ATOM 0 HB3 GLU A 59 -11.140 -20.403 2.672 1.00 13.31 H new ATOM 0 HG2 GLU A 59 -10.329 -19.620 4.904 1.00 12.13 H new ATOM 0 HG3 GLU A 59 -10.587 -17.963 4.395 1.00 12.13 H new ATOM 891 N GLU A 60 -9.448 -20.670 0.320 1.00 71.21 N ATOM 892 CA GLU A 60 -9.402 -20.894 -1.120 1.00 61.02 C ATOM 893 C GLU A 60 -10.249 -19.862 -1.859 1.00 11.23 C ATOM 894 O GLU A 60 -9.997 -19.556 -3.024 1.00 21.43 O ATOM 895 CB GLU A 60 -9.890 -22.305 -1.455 1.00 52.14 C ATOM 896 CG GLU A 60 -9.662 -22.700 -2.905 1.00 2.33 C ATOM 897 CD GLU A 60 -10.870 -22.430 -3.780 1.00 73.42 C ATOM 898 OE1 GLU A 60 -11.824 -21.787 -3.295 1.00 2.14 O ATOM 899 OE2 GLU A 60 -10.862 -22.863 -4.952 1.00 23.33 O ATOM 0 H GLU A 60 -9.688 -21.496 0.868 1.00 71.21 H new ATOM 0 HA GLU A 60 -8.367 -20.789 -1.445 1.00 61.02 H new ATOM 0 HB2 GLU A 60 -9.381 -23.020 -0.808 1.00 52.14 H new ATOM 0 HB3 GLU A 60 -10.955 -22.375 -1.231 1.00 52.14 H new ATOM 0 HG2 GLU A 60 -8.805 -22.152 -3.296 1.00 2.33 H new ATOM 0 HG3 GLU A 60 -9.412 -23.760 -2.954 1.00 2.33 H new ATOM 906 N GLU A 61 -11.255 -19.329 -1.171 1.00 61.45 N ATOM 907 CA GLU A 61 -12.140 -18.333 -1.763 1.00 11.13 C ATOM 908 C GLU A 61 -11.374 -17.058 -2.104 1.00 24.13 C ATOM 909 O GLU A 61 -11.502 -16.520 -3.203 1.00 21.40 O ATOM 910 CB GLU A 61 -13.290 -18.009 -0.807 1.00 75.22 C ATOM 911 CG GLU A 61 -14.259 -19.163 -0.607 1.00 42.14 C ATOM 912 CD GLU A 61 -15.420 -18.800 0.297 1.00 13.22 C ATOM 913 OE1 GLU A 61 -15.577 -17.600 0.608 1.00 72.25 O ATOM 914 OE2 GLU A 61 -16.172 -19.714 0.695 1.00 62.21 O ATOM 0 H GLU A 61 -11.477 -19.570 -0.205 1.00 61.45 H new ATOM 0 HA GLU A 61 -12.548 -18.749 -2.684 1.00 11.13 H new ATOM 0 HB2 GLU A 61 -12.877 -17.720 0.160 1.00 75.22 H new ATOM 0 HB3 GLU A 61 -13.838 -17.148 -1.190 1.00 75.22 H new ATOM 0 HG2 GLU A 61 -14.644 -19.481 -1.576 1.00 42.14 H new ATOM 0 HG3 GLU A 61 -13.724 -20.012 -0.182 1.00 42.14 H new ATOM 921 N GLU A 62 -10.577 -16.581 -1.152 1.00 54.11 N ATOM 922 CA GLU A 62 -9.792 -15.369 -1.351 1.00 44.23 C ATOM 923 C GLU A 62 -8.438 -15.695 -1.976 1.00 2.42 C ATOM 924 O GLU A 62 -7.696 -14.798 -2.379 1.00 64.24 O ATOM 925 CB GLU A 62 -9.590 -14.641 -0.021 1.00 2.23 C ATOM 926 CG GLU A 62 -10.434 -13.385 0.120 1.00 21.33 C ATOM 927 CD GLU A 62 -11.868 -13.687 0.510 1.00 61.11 C ATOM 928 OE1 GLU A 62 -12.080 -14.624 1.309 1.00 54.44 O ATOM 929 OE2 GLU A 62 -12.777 -12.988 0.017 1.00 51.14 O ATOM 0 H GLU A 62 -10.459 -17.015 -0.237 1.00 54.11 H new ATOM 0 HA GLU A 62 -10.341 -14.719 -2.032 1.00 44.23 H new ATOM 0 HB2 GLU A 62 -9.828 -15.322 0.796 1.00 2.23 H new ATOM 0 HB3 GLU A 62 -8.538 -14.375 0.082 1.00 2.23 H new ATOM 0 HG2 GLU A 62 -9.987 -12.733 0.871 1.00 21.33 H new ATOM 0 HG3 GLU A 62 -10.425 -12.838 -0.823 1.00 21.33 H new ATOM 936 N LEU A 63 -8.123 -16.983 -2.051 1.00 44.24 N ATOM 937 CA LEU A 63 -6.858 -17.429 -2.626 1.00 50.30 C ATOM 938 C LEU A 63 -6.889 -17.335 -4.148 1.00 63.52 C ATOM 939 O LEU A 63 -5.848 -17.201 -4.792 1.00 14.23 O ATOM 940 CB LEU A 63 -6.559 -18.866 -2.198 1.00 33.44 C ATOM 941 CG LEU A 63 -5.094 -19.298 -2.272 1.00 33.13 C ATOM 942 CD1 LEU A 63 -4.274 -18.588 -1.206 1.00 41.22 C ATOM 943 CD2 LEU A 63 -4.975 -20.808 -2.121 1.00 41.30 C ATOM 0 H LEU A 63 -8.725 -17.737 -1.721 1.00 44.24 H new ATOM 0 HA LEU A 63 -6.068 -16.775 -2.256 1.00 50.30 H new ATOM 0 HB2 LEU A 63 -6.904 -18.998 -1.173 1.00 33.44 H new ATOM 0 HB3 LEU A 63 -7.147 -19.539 -2.821 1.00 33.44 H new ATOM 0 HG LEU A 63 -4.701 -19.018 -3.250 1.00 33.13 H new ATOM 0 HD11 LEU A 63 -3.234 -18.908 -1.274 1.00 41.22 H new ATOM 0 HD12 LEU A 63 -4.333 -17.510 -1.359 1.00 41.22 H new ATOM 0 HD13 LEU A 63 -4.666 -18.836 -0.220 1.00 41.22 H new ATOM 0 HD21 LEU A 63 -3.926 -21.098 -2.176 1.00 41.30 H new ATOM 0 HD22 LEU A 63 -5.385 -21.111 -1.157 1.00 41.30 H new ATOM 0 HD23 LEU A 63 -5.529 -21.298 -2.921 1.00 41.30 H new ATOM 955 N GLN A 64 -8.088 -17.406 -4.716 1.00 72.22 N ATOM 956 CA GLN A 64 -8.254 -17.328 -6.163 1.00 23.22 C ATOM 957 C GLN A 64 -7.972 -15.917 -6.668 1.00 13.24 C ATOM 958 O GLN A 64 -8.031 -15.653 -7.869 1.00 44.33 O ATOM 959 CB GLN A 64 -9.669 -17.751 -6.559 1.00 32.51 C ATOM 960 CG GLN A 64 -10.710 -16.662 -6.355 1.00 45.14 C ATOM 961 CD GLN A 64 -12.101 -17.098 -6.770 1.00 62.41 C ATOM 962 OE1 GLN A 64 -12.342 -18.277 -7.030 1.00 71.55 O ATOM 963 NE2 GLN A 64 -13.026 -16.148 -6.834 1.00 4.45 N ATOM 0 H GLN A 64 -8.959 -17.517 -4.197 1.00 72.22 H new ATOM 0 HA GLN A 64 -7.537 -18.009 -6.623 1.00 23.22 H new ATOM 0 HB2 GLN A 64 -9.670 -18.051 -7.607 1.00 32.51 H new ATOM 0 HB3 GLN A 64 -9.953 -18.627 -5.977 1.00 32.51 H new ATOM 0 HG2 GLN A 64 -10.723 -16.370 -5.305 1.00 45.14 H new ATOM 0 HG3 GLN A 64 -10.424 -15.780 -6.928 1.00 45.14 H new ATOM 0 HE21 GLN A 64 -12.783 -15.183 -6.610 1.00 4.45 H new ATOM 0 HE22 GLN A 64 -13.980 -16.383 -7.107 1.00 4.45 H new ATOM 972 N LEU A 65 -7.668 -15.013 -5.743 1.00 25.01 N ATOM 973 CA LEU A 65 -7.377 -13.627 -6.094 1.00 31.20 C ATOM 974 C LEU A 65 -5.888 -13.330 -5.952 1.00 63.21 C ATOM 975 O LEU A 65 -5.492 -12.191 -5.704 1.00 20.14 O ATOM 976 CB LEU A 65 -8.185 -12.676 -5.209 1.00 61.21 C ATOM 977 CG LEU A 65 -9.600 -13.132 -4.852 1.00 12.55 C ATOM 978 CD1 LEU A 65 -10.173 -12.269 -3.738 1.00 51.30 C ATOM 979 CD2 LEU A 65 -10.500 -13.089 -6.078 1.00 61.31 C ATOM 0 H LEU A 65 -7.617 -15.215 -4.744 1.00 25.01 H new ATOM 0 HA LEU A 65 -7.661 -13.475 -7.135 1.00 31.20 H new ATOM 0 HB2 LEU A 65 -7.632 -12.515 -4.283 1.00 61.21 H new ATOM 0 HB3 LEU A 65 -8.252 -11.712 -5.712 1.00 61.21 H new ATOM 0 HG LEU A 65 -9.551 -14.162 -4.498 1.00 12.55 H new ATOM 0 HD11 LEU A 65 -11.181 -12.608 -3.497 1.00 51.30 H new ATOM 0 HD12 LEU A 65 -9.541 -12.350 -2.853 1.00 51.30 H new ATOM 0 HD13 LEU A 65 -10.208 -11.230 -4.064 1.00 51.30 H new ATOM 0 HD21 LEU A 65 -11.503 -13.417 -5.805 1.00 61.31 H new ATOM 0 HD22 LEU A 65 -10.543 -12.070 -6.462 1.00 61.31 H new ATOM 0 HD23 LEU A 65 -10.099 -13.750 -6.847 1.00 61.31 H new ATOM 991 N PHE A 66 -5.066 -14.362 -6.114 1.00 1.03 N ATOM 992 CA PHE A 66 -3.619 -14.212 -6.005 1.00 15.41 C ATOM 993 C PHE A 66 -3.047 -13.541 -7.250 1.00 72.04 C ATOM 994 O PHE A 66 -1.916 -13.053 -7.243 1.00 14.44 O ATOM 995 CB PHE A 66 -2.958 -15.575 -5.797 1.00 21.44 C ATOM 996 CG PHE A 66 -1.457 -15.518 -5.785 1.00 30.12 C ATOM 997 CD1 PHE A 66 -0.768 -15.306 -4.602 1.00 21.24 C ATOM 998 CD2 PHE A 66 -0.735 -15.676 -6.957 1.00 54.51 C ATOM 999 CE1 PHE A 66 0.613 -15.253 -4.587 1.00 63.22 C ATOM 1000 CE2 PHE A 66 0.646 -15.624 -6.949 1.00 13.03 C ATOM 1001 CZ PHE A 66 1.321 -15.411 -5.763 1.00 32.34 C ATOM 0 H PHE A 66 -5.377 -15.311 -6.321 1.00 1.03 H new ATOM 0 HA PHE A 66 -3.408 -13.579 -5.143 1.00 15.41 H new ATOM 0 HB2 PHE A 66 -3.305 -15.998 -4.854 1.00 21.44 H new ATOM 0 HB3 PHE A 66 -3.282 -16.251 -6.588 1.00 21.44 H new ATOM 0 HD1 PHE A 66 -1.317 -15.181 -3.680 1.00 21.24 H new ATOM 0 HD2 PHE A 66 -1.258 -15.842 -7.888 1.00 54.51 H new ATOM 0 HE1 PHE A 66 1.138 -15.088 -3.658 1.00 63.22 H new ATOM 0 HE2 PHE A 66 1.197 -15.750 -7.869 1.00 13.03 H new ATOM 0 HZ PHE A 66 2.400 -15.368 -5.755 1.00 32.34 H new ATOM 1011 N LEU A 67 -3.835 -13.522 -8.319 1.00 54.25 N ATOM 1012 CA LEU A 67 -3.408 -12.912 -9.574 1.00 54.10 C ATOM 1013 C LEU A 67 -3.879 -11.464 -9.663 1.00 50.24 C ATOM 1014 O LEU A 67 -3.543 -10.747 -10.607 1.00 32.33 O ATOM 1015 CB LEU A 67 -3.949 -13.710 -10.762 1.00 21.02 C ATOM 1016 CG LEU A 67 -3.123 -14.925 -11.186 1.00 3.12 C ATOM 1017 CD1 LEU A 67 -3.818 -15.678 -12.309 1.00 53.32 C ATOM 1018 CD2 LEU A 67 -1.726 -14.497 -11.613 1.00 30.33 C ATOM 0 H LEU A 67 -4.773 -13.922 -8.342 1.00 54.25 H new ATOM 0 HA LEU A 67 -2.318 -12.923 -9.603 1.00 54.10 H new ATOM 0 HB2 LEU A 67 -4.956 -14.048 -10.519 1.00 21.02 H new ATOM 0 HB3 LEU A 67 -4.035 -13.038 -11.616 1.00 21.02 H new ATOM 0 HG LEU A 67 -3.031 -15.594 -10.331 1.00 3.12 H new ATOM 0 HD11 LEU A 67 -3.215 -16.539 -12.597 1.00 53.32 H new ATOM 0 HD12 LEU A 67 -4.796 -16.017 -11.969 1.00 53.32 H new ATOM 0 HD13 LEU A 67 -3.942 -15.018 -13.168 1.00 53.32 H new ATOM 0 HD21 LEU A 67 -1.152 -15.374 -11.911 1.00 30.33 H new ATOM 0 HD22 LEU A 67 -1.798 -13.807 -12.454 1.00 30.33 H new ATOM 0 HD23 LEU A 67 -1.226 -14.003 -10.780 1.00 30.33 H new ATOM 1030 N LYS A 68 -4.657 -11.038 -8.674 1.00 52.12 N ATOM 1031 CA LYS A 68 -5.172 -9.674 -8.638 1.00 21.21 C ATOM 1032 C LYS A 68 -4.247 -8.765 -7.836 1.00 2.34 C ATOM 1033 O LYS A 68 -4.297 -7.542 -7.965 1.00 75.43 O ATOM 1034 CB LYS A 68 -6.577 -9.653 -8.031 1.00 63.33 C ATOM 1035 CG LYS A 68 -7.421 -10.857 -8.411 1.00 71.40 C ATOM 1036 CD LYS A 68 -8.845 -10.454 -8.754 1.00 53.11 C ATOM 1037 CE LYS A 68 -8.928 -9.822 -10.135 1.00 74.32 C ATOM 1038 NZ LYS A 68 -10.318 -9.838 -10.670 1.00 13.35 N ATOM 0 H LYS A 68 -4.945 -11.618 -7.886 1.00 52.12 H new ATOM 0 HA LYS A 68 -5.220 -9.303 -9.662 1.00 21.21 H new ATOM 0 HB2 LYS A 68 -6.494 -9.606 -6.945 1.00 63.33 H new ATOM 0 HB3 LYS A 68 -7.089 -8.745 -8.351 1.00 63.33 H new ATOM 0 HG2 LYS A 68 -6.970 -11.364 -9.264 1.00 71.40 H new ATOM 0 HG3 LYS A 68 -7.432 -11.569 -7.586 1.00 71.40 H new ATOM 0 HD2 LYS A 68 -9.492 -11.330 -8.714 1.00 53.11 H new ATOM 0 HD3 LYS A 68 -9.215 -9.751 -8.008 1.00 53.11 H new ATOM 0 HE2 LYS A 68 -8.570 -8.794 -10.086 1.00 74.32 H new ATOM 0 HE3 LYS A 68 -8.269 -10.357 -10.819 1.00 74.32 H new ATOM 0 HZ1 LYS A 68 -10.345 -9.339 -11.582 1.00 13.35 H new ATOM 0 HZ2 LYS A 68 -10.627 -10.822 -10.805 1.00 13.35 H new ATOM 0 HZ3 LYS A 68 -10.954 -9.365 -9.997 1.00 13.35 H new ATOM 1052 N ASN A 69 -3.401 -9.370 -7.008 1.00 15.05 N ATOM 1053 CA ASN A 69 -2.464 -8.614 -6.185 1.00 11.10 C ATOM 1054 C ASN A 69 -1.055 -8.681 -6.765 1.00 24.10 C ATOM 1055 O ASN A 69 -0.083 -8.303 -6.110 1.00 13.23 O ATOM 1056 CB ASN A 69 -2.464 -9.150 -4.752 1.00 0.42 C ATOM 1057 CG ASN A 69 -2.198 -8.063 -3.728 1.00 45.33 C ATOM 1058 OD1 ASN A 69 -3.122 -7.548 -3.099 1.00 5.53 O ATOM 1059 ND2 ASN A 69 -0.929 -7.709 -3.558 1.00 50.31 N ATOM 0 H ASN A 69 -3.345 -10.382 -6.889 1.00 15.05 H new ATOM 0 HA ASN A 69 -2.785 -7.572 -6.176 1.00 11.10 H new ATOM 0 HB2 ASN A 69 -3.427 -9.616 -4.541 1.00 0.42 H new ATOM 0 HB3 ASN A 69 -1.706 -9.928 -4.658 1.00 0.42 H new ATOM 0 HD21 ASN A 69 -0.688 -6.983 -2.884 1.00 50.31 H new ATOM 0 HD22 ASN A 69 -0.195 -8.164 -4.102 1.00 50.31 H new ATOM 1066 N PHE A 70 -0.951 -9.165 -7.998 1.00 43.34 N ATOM 1067 CA PHE A 70 0.340 -9.282 -8.667 1.00 72.14 C ATOM 1068 C PHE A 70 0.287 -8.668 -10.063 1.00 53.31 C ATOM 1069 O PHE A 70 1.184 -7.924 -10.460 1.00 73.23 O ATOM 1070 CB PHE A 70 0.758 -10.751 -8.760 1.00 44.10 C ATOM 1071 CG PHE A 70 1.257 -11.315 -7.460 1.00 72.34 C ATOM 1072 CD1 PHE A 70 0.385 -11.535 -6.406 1.00 22.12 C ATOM 1073 CD2 PHE A 70 2.597 -11.626 -7.293 1.00 75.44 C ATOM 1074 CE1 PHE A 70 0.842 -12.054 -5.209 1.00 15.43 C ATOM 1075 CE2 PHE A 70 3.059 -12.146 -6.099 1.00 15.44 C ATOM 1076 CZ PHE A 70 2.179 -12.360 -5.055 1.00 65.43 C ATOM 0 H PHE A 70 -1.745 -9.483 -8.554 1.00 43.34 H new ATOM 0 HA PHE A 70 1.077 -8.737 -8.077 1.00 72.14 H new ATOM 0 HB2 PHE A 70 -0.092 -11.342 -9.101 1.00 44.10 H new ATOM 0 HB3 PHE A 70 1.539 -10.851 -9.514 1.00 44.10 H new ATOM 0 HD1 PHE A 70 -0.663 -11.299 -6.521 1.00 22.12 H new ATOM 0 HD2 PHE A 70 3.289 -11.460 -8.106 1.00 75.44 H new ATOM 0 HE1 PHE A 70 0.153 -12.220 -4.394 1.00 15.43 H new ATOM 0 HE2 PHE A 70 4.106 -12.385 -5.982 1.00 15.44 H new ATOM 0 HZ PHE A 70 2.537 -12.766 -4.120 1.00 65.43 H new ATOM 1086 N SER A 71 -0.771 -8.985 -10.803 1.00 11.21 N ATOM 1087 CA SER A 71 -0.940 -8.468 -12.156 1.00 72.20 C ATOM 1088 C SER A 71 -1.945 -7.320 -12.178 1.00 24.04 C ATOM 1089 O SER A 71 -1.805 -6.373 -12.952 1.00 32.22 O ATOM 1090 CB SER A 71 -1.402 -9.583 -13.096 1.00 74.12 C ATOM 1091 OG SER A 71 -0.330 -10.055 -13.893 1.00 72.24 O ATOM 0 H SER A 71 -1.524 -9.597 -10.488 1.00 11.21 H new ATOM 0 HA SER A 71 0.024 -8.090 -12.497 1.00 72.20 H new ATOM 0 HB2 SER A 71 -1.816 -10.406 -12.513 1.00 74.12 H new ATOM 0 HB3 SER A 71 -2.201 -9.214 -13.738 1.00 74.12 H new ATOM 0 HG SER A 71 -0.651 -10.768 -14.484 1.00 72.24 H new ATOM 1097 N SER A 72 -2.957 -7.412 -11.322 1.00 14.03 N ATOM 1098 CA SER A 72 -3.988 -6.384 -11.244 1.00 54.31 C ATOM 1099 C SER A 72 -4.765 -6.293 -12.554 1.00 44.24 C ATOM 1100 O SER A 72 -5.471 -5.316 -12.804 1.00 34.25 O ATOM 1101 CB SER A 72 -3.362 -5.027 -10.914 1.00 70.51 C ATOM 1102 OG SER A 72 -4.319 -4.147 -10.352 1.00 14.21 O ATOM 0 H SER A 72 -3.085 -8.188 -10.673 1.00 14.03 H new ATOM 0 HA SER A 72 -4.681 -6.659 -10.449 1.00 54.31 H new ATOM 0 HB2 SER A 72 -2.536 -5.164 -10.216 1.00 70.51 H new ATOM 0 HB3 SER A 72 -2.945 -4.586 -11.819 1.00 70.51 H new ATOM 0 HG SER A 72 -5.130 -4.151 -10.902 1.00 14.21 H new ATOM 1108 N SER A 73 -4.627 -7.318 -13.389 1.00 32.33 N ATOM 1109 CA SER A 73 -5.312 -7.354 -14.676 1.00 2.23 C ATOM 1110 C SER A 73 -6.105 -8.647 -14.834 1.00 32.44 C ATOM 1111 O SER A 73 -7.191 -8.656 -15.413 1.00 1.33 O ATOM 1112 CB SER A 73 -4.303 -7.218 -15.818 1.00 21.41 C ATOM 1113 OG SER A 73 -4.903 -6.635 -16.962 1.00 23.04 O ATOM 0 H SER A 73 -4.047 -8.135 -13.197 1.00 32.33 H new ATOM 0 HA SER A 73 -6.008 -6.516 -14.713 1.00 2.23 H new ATOM 0 HB2 SER A 73 -3.462 -6.606 -15.493 1.00 21.41 H new ATOM 0 HB3 SER A 73 -3.903 -8.199 -16.073 1.00 21.41 H new ATOM 0 HG SER A 73 -4.237 -6.557 -17.677 1.00 23.04 H new ATOM 1119 N ALA A 74 -5.554 -9.739 -14.314 1.00 30.23 N ATOM 1120 CA ALA A 74 -6.210 -11.038 -14.394 1.00 62.54 C ATOM 1121 C ALA A 74 -7.579 -11.005 -13.724 1.00 1.01 C ATOM 1122 O ALA A 74 -8.067 -9.942 -13.341 1.00 52.41 O ATOM 1123 CB ALA A 74 -5.336 -12.111 -13.761 1.00 61.01 C ATOM 0 H ALA A 74 -4.655 -9.750 -13.833 1.00 30.23 H new ATOM 0 HA ALA A 74 -6.356 -11.278 -15.447 1.00 62.54 H new ATOM 0 HB1 ALA A 74 -5.839 -13.076 -13.828 1.00 61.01 H new ATOM 0 HB2 ALA A 74 -4.383 -12.161 -14.287 1.00 61.01 H new ATOM 0 HB3 ALA A 74 -5.160 -11.866 -12.714 1.00 61.01 H new ATOM 1129 N ARG A 75 -8.194 -12.175 -13.585 1.00 63.15 N ATOM 1130 CA ARG A 75 -9.508 -12.279 -12.963 1.00 2.22 C ATOM 1131 C ARG A 75 -9.434 -13.082 -11.668 1.00 21.05 C ATOM 1132 O ARG A 75 -9.640 -12.545 -10.579 1.00 71.20 O ATOM 1133 CB ARG A 75 -10.501 -12.933 -13.925 1.00 15.52 C ATOM 1134 CG ARG A 75 -9.841 -13.784 -14.997 1.00 31.34 C ATOM 1135 CD ARG A 75 -10.815 -14.793 -15.585 1.00 52.34 C ATOM 1136 NE ARG A 75 -10.127 -15.928 -16.194 1.00 44.42 N ATOM 1137 CZ ARG A 75 -10.736 -16.845 -16.937 1.00 53.42 C ATOM 1138 NH1 ARG A 75 -12.040 -16.760 -17.162 1.00 72.44 N ATOM 1139 NH2 ARG A 75 -10.041 -17.848 -17.457 1.00 73.31 N ATOM 0 H ARG A 75 -7.803 -13.065 -13.895 1.00 63.15 H new ATOM 0 HA ARG A 75 -9.851 -11.272 -12.727 1.00 2.22 H new ATOM 0 HB2 ARG A 75 -11.191 -13.554 -13.354 1.00 15.52 H new ATOM 0 HB3 ARG A 75 -11.095 -12.155 -14.405 1.00 15.52 H new ATOM 0 HG2 ARG A 75 -9.459 -13.141 -15.790 1.00 31.34 H new ATOM 0 HG3 ARG A 75 -8.985 -14.308 -14.571 1.00 31.34 H new ATOM 0 HD2 ARG A 75 -11.482 -15.152 -14.801 1.00 52.34 H new ATOM 0 HD3 ARG A 75 -11.437 -14.302 -16.333 1.00 52.34 H new ATOM 0 HE ARG A 75 -9.123 -16.022 -16.040 1.00 44.42 H new ATOM 0 HH11 ARG A 75 -12.577 -15.989 -16.764 1.00 72.44 H new ATOM 0 HH12 ARG A 75 -12.506 -17.465 -17.733 1.00 72.44 H new ATOM 0 HH21 ARG A 75 -9.038 -17.916 -17.286 1.00 73.31 H new ATOM 0 HH22 ARG A 75 -10.510 -18.552 -18.027 1.00 73.31 H new ATOM 1153 N VAL A 76 -9.139 -14.372 -11.793 1.00 63.02 N ATOM 1154 CA VAL A 76 -9.037 -15.250 -10.633 1.00 42.53 C ATOM 1155 C VAL A 76 -8.366 -16.569 -10.999 1.00 43.44 C ATOM 1156 O VAL A 76 -8.462 -17.032 -12.137 1.00 24.14 O ATOM 1157 CB VAL A 76 -10.422 -15.542 -10.027 1.00 54.14 C ATOM 1158 CG1 VAL A 76 -10.834 -14.430 -9.075 1.00 11.04 C ATOM 1159 CG2 VAL A 76 -11.457 -15.723 -11.128 1.00 12.13 C ATOM 0 H VAL A 76 -8.966 -14.833 -12.687 1.00 63.02 H new ATOM 0 HA VAL A 76 -8.428 -14.729 -9.894 1.00 42.53 H new ATOM 0 HB VAL A 76 -10.362 -16.470 -9.459 1.00 54.14 H new ATOM 0 HG11 VAL A 76 -11.815 -14.654 -8.657 1.00 11.04 H new ATOM 0 HG12 VAL A 76 -10.105 -14.353 -8.269 1.00 11.04 H new ATOM 0 HG13 VAL A 76 -10.878 -13.485 -9.616 1.00 11.04 H new ATOM 0 HG21 VAL A 76 -12.430 -15.929 -10.682 1.00 12.13 H new ATOM 0 HG22 VAL A 76 -11.516 -14.813 -11.725 1.00 12.13 H new ATOM 0 HG23 VAL A 76 -11.167 -16.557 -11.767 1.00 12.13 H new ATOM 1169 N LEU A 77 -7.687 -17.170 -10.029 1.00 4.43 N ATOM 1170 CA LEU A 77 -6.999 -18.437 -10.248 1.00 22.41 C ATOM 1171 C LEU A 77 -7.941 -19.469 -10.859 1.00 31.50 C ATOM 1172 O LEU A 77 -9.155 -19.266 -10.909 1.00 63.22 O ATOM 1173 CB LEU A 77 -6.430 -18.966 -8.930 1.00 33.21 C ATOM 1174 CG LEU A 77 -5.492 -18.022 -8.177 1.00 20.51 C ATOM 1175 CD1 LEU A 77 -4.703 -18.783 -7.123 1.00 65.31 C ATOM 1176 CD2 LEU A 77 -4.552 -17.320 -9.146 1.00 12.32 C ATOM 0 H LEU A 77 -7.598 -16.800 -9.083 1.00 4.43 H new ATOM 0 HA LEU A 77 -6.180 -18.262 -10.945 1.00 22.41 H new ATOM 0 HB2 LEU A 77 -7.263 -19.219 -8.273 1.00 33.21 H new ATOM 0 HB3 LEU A 77 -5.893 -19.892 -9.135 1.00 33.21 H new ATOM 0 HG LEU A 77 -6.095 -17.266 -7.674 1.00 20.51 H new ATOM 0 HD11 LEU A 77 -4.041 -18.095 -6.597 1.00 65.31 H new ATOM 0 HD12 LEU A 77 -5.392 -19.239 -6.412 1.00 65.31 H new ATOM 0 HD13 LEU A 77 -4.110 -19.561 -7.604 1.00 65.31 H new ATOM 0 HD21 LEU A 77 -3.892 -16.652 -8.593 1.00 12.32 H new ATOM 0 HD22 LEU A 77 -3.956 -18.062 -9.677 1.00 12.32 H new ATOM 0 HD23 LEU A 77 -5.134 -16.742 -9.864 1.00 12.32 H new ATOM 1188 N THR A 78 -7.375 -20.580 -11.321 1.00 43.15 N ATOM 1189 CA THR A 78 -8.164 -21.645 -11.928 1.00 45.31 C ATOM 1190 C THR A 78 -7.854 -22.992 -11.286 1.00 33.10 C ATOM 1191 O THR A 78 -7.212 -23.058 -10.238 1.00 64.32 O ATOM 1192 CB THR A 78 -7.907 -21.740 -13.444 1.00 22.11 C ATOM 1193 OG1 THR A 78 -8.928 -22.529 -14.065 1.00 51.30 O ATOM 1194 CG2 THR A 78 -6.544 -22.355 -13.724 1.00 43.53 C ATOM 0 H THR A 78 -6.373 -20.765 -11.286 1.00 43.15 H new ATOM 0 HA THR A 78 -9.212 -21.398 -11.760 1.00 45.31 H new ATOM 0 HB THR A 78 -7.925 -20.732 -13.857 1.00 22.11 H new ATOM 0 HG1 THR A 78 -8.759 -22.583 -15.029 1.00 51.30 H new ATOM 0 HG21 THR A 78 -6.385 -22.412 -14.801 1.00 43.53 H new ATOM 0 HG22 THR A 78 -5.767 -21.737 -13.274 1.00 43.53 H new ATOM 0 HG23 THR A 78 -6.503 -23.357 -13.298 1.00 43.53 H new ATOM 1202 N SER A 79 -8.315 -24.065 -11.921 1.00 51.12 N ATOM 1203 CA SER A 79 -8.090 -25.412 -11.410 1.00 1.34 C ATOM 1204 C SER A 79 -6.652 -25.856 -11.662 1.00 53.44 C ATOM 1205 O SER A 79 -6.410 -26.872 -12.312 1.00 73.31 O ATOM 1206 CB SER A 79 -9.062 -26.397 -12.062 1.00 10.14 C ATOM 1207 OG SER A 79 -10.393 -26.157 -11.637 1.00 44.00 O ATOM 0 H SER A 79 -8.847 -24.027 -12.791 1.00 51.12 H new ATOM 0 HA SER A 79 -8.264 -25.399 -10.334 1.00 1.34 H new ATOM 0 HB2 SER A 79 -9.002 -26.308 -13.147 1.00 10.14 H new ATOM 0 HB3 SER A 79 -8.775 -27.418 -11.809 1.00 10.14 H new ATOM 0 HG SER A 79 -10.995 -26.798 -12.069 1.00 44.00 H new ATOM 1213 N ALA A 80 -5.702 -25.085 -11.144 1.00 1.12 N ATOM 1214 CA ALA A 80 -4.288 -25.399 -11.311 1.00 13.52 C ATOM 1215 C ALA A 80 -3.412 -24.400 -10.562 1.00 32.34 C ATOM 1216 O ALA A 80 -2.383 -24.767 -9.996 1.00 42.01 O ATOM 1217 CB ALA A 80 -3.923 -25.419 -12.788 1.00 33.52 C ATOM 0 H ALA A 80 -5.885 -24.239 -10.605 1.00 1.12 H new ATOM 0 HA ALA A 80 -4.108 -26.388 -10.890 1.00 13.52 H new ATOM 0 HB1 ALA A 80 -2.864 -25.655 -12.898 1.00 33.52 H new ATOM 0 HB2 ALA A 80 -4.518 -26.175 -13.300 1.00 33.52 H new ATOM 0 HB3 ALA A 80 -4.124 -24.441 -13.226 1.00 33.52 H new ATOM 1223 N GLU A 81 -3.828 -23.138 -10.563 1.00 1.53 N ATOM 1224 CA GLU A 81 -3.079 -22.087 -9.884 1.00 2.23 C ATOM 1225 C GLU A 81 -3.404 -22.063 -8.393 1.00 33.00 C ATOM 1226 O GLU A 81 -2.508 -21.997 -7.550 1.00 74.25 O ATOM 1227 CB GLU A 81 -3.389 -20.724 -10.507 1.00 35.24 C ATOM 1228 CG GLU A 81 -2.931 -20.596 -11.949 1.00 44.34 C ATOM 1229 CD GLU A 81 -2.722 -19.154 -12.369 1.00 5.53 C ATOM 1230 OE1 GLU A 81 -1.826 -18.494 -11.801 1.00 14.32 O ATOM 1231 OE2 GLU A 81 -3.454 -18.685 -13.266 1.00 24.13 O ATOM 0 H GLU A 81 -4.679 -22.818 -11.026 1.00 1.53 H new ATOM 0 HA GLU A 81 -2.017 -22.299 -10.003 1.00 2.23 H new ATOM 0 HB2 GLU A 81 -4.464 -20.548 -10.459 1.00 35.24 H new ATOM 0 HB3 GLU A 81 -2.912 -19.945 -9.912 1.00 35.24 H new ATOM 0 HG2 GLU A 81 -2.000 -21.147 -12.081 1.00 44.34 H new ATOM 0 HG3 GLU A 81 -3.670 -21.058 -12.603 1.00 44.34 H new ATOM 1238 N THR A 82 -4.694 -22.116 -8.074 1.00 22.42 N ATOM 1239 CA THR A 82 -5.139 -22.099 -6.686 1.00 71.32 C ATOM 1240 C THR A 82 -4.739 -23.381 -5.965 1.00 34.24 C ATOM 1241 O THR A 82 -4.384 -23.358 -4.786 1.00 40.21 O ATOM 1242 CB THR A 82 -6.666 -21.923 -6.588 1.00 72.34 C ATOM 1243 OG1 THR A 82 -7.189 -21.472 -7.843 1.00 3.01 O ATOM 1244 CG2 THR A 82 -7.027 -20.929 -5.496 1.00 15.35 C ATOM 0 H THR A 82 -5.448 -22.171 -8.758 1.00 22.42 H new ATOM 0 HA THR A 82 -4.652 -21.249 -6.208 1.00 71.32 H new ATOM 0 HB THR A 82 -7.105 -22.889 -6.338 1.00 72.34 H new ATOM 0 HG1 THR A 82 -7.236 -22.226 -8.468 1.00 3.01 H new ATOM 0 HG21 THR A 82 -8.110 -20.821 -5.446 1.00 15.35 H new ATOM 0 HG22 THR A 82 -6.653 -21.290 -4.538 1.00 15.35 H new ATOM 0 HG23 THR A 82 -6.576 -19.962 -5.720 1.00 15.35 H new ATOM 1252 N LYS A 83 -4.799 -24.500 -6.679 1.00 51.10 N ATOM 1253 CA LYS A 83 -4.441 -25.793 -6.108 1.00 14.10 C ATOM 1254 C LYS A 83 -2.934 -25.897 -5.898 1.00 12.20 C ATOM 1255 O LYS A 83 -2.473 -26.299 -4.830 1.00 72.13 O ATOM 1256 CB LYS A 83 -4.919 -26.926 -7.019 1.00 53.22 C ATOM 1257 CG LYS A 83 -6.409 -26.885 -7.310 1.00 54.44 C ATOM 1258 CD LYS A 83 -7.215 -27.511 -6.185 1.00 12.03 C ATOM 1259 CE LYS A 83 -8.684 -27.644 -6.557 1.00 42.43 C ATOM 1260 NZ LYS A 83 -8.928 -28.816 -7.443 1.00 44.41 N ATOM 0 H LYS A 83 -5.093 -24.537 -7.655 1.00 51.10 H new ATOM 0 HA LYS A 83 -4.932 -25.882 -5.139 1.00 14.10 H new ATOM 0 HB2 LYS A 83 -4.372 -26.879 -7.961 1.00 53.22 H new ATOM 0 HB3 LYS A 83 -4.674 -27.882 -6.555 1.00 53.22 H new ATOM 0 HG2 LYS A 83 -6.724 -25.851 -7.453 1.00 54.44 H new ATOM 0 HG3 LYS A 83 -6.613 -27.412 -8.242 1.00 54.44 H new ATOM 0 HD2 LYS A 83 -6.808 -28.494 -5.948 1.00 12.03 H new ATOM 0 HD3 LYS A 83 -7.120 -26.902 -5.286 1.00 12.03 H new ATOM 0 HE2 LYS A 83 -9.281 -27.744 -5.650 1.00 42.43 H new ATOM 0 HE3 LYS A 83 -9.015 -26.735 -7.058 1.00 42.43 H new ATOM 0 HZ1 LYS A 83 -9.941 -28.872 -7.674 1.00 44.41 H new ATOM 0 HZ2 LYS A 83 -8.379 -28.709 -8.319 1.00 44.41 H new ATOM 0 HZ3 LYS A 83 -8.636 -29.687 -6.955 1.00 44.41 H new ATOM 1274 N ALA A 84 -2.172 -25.530 -6.923 1.00 22.11 N ATOM 1275 CA ALA A 84 -0.717 -25.579 -6.849 1.00 1.23 C ATOM 1276 C ALA A 84 -0.181 -24.524 -5.887 1.00 4.00 C ATOM 1277 O ALA A 84 1.007 -24.512 -5.562 1.00 51.01 O ATOM 1278 CB ALA A 84 -0.111 -25.391 -8.232 1.00 33.41 C ATOM 0 H ALA A 84 -2.538 -25.196 -7.814 1.00 22.11 H new ATOM 0 HA ALA A 84 -0.430 -26.560 -6.469 1.00 1.23 H new ATOM 0 HB1 ALA A 84 0.976 -25.430 -8.161 1.00 33.41 H new ATOM 0 HB2 ALA A 84 -0.460 -26.184 -8.893 1.00 33.41 H new ATOM 0 HB3 ALA A 84 -0.414 -24.424 -8.634 1.00 33.41 H new ATOM 1284 N PHE A 85 -1.063 -23.639 -5.435 1.00 2.10 N ATOM 1285 CA PHE A 85 -0.677 -22.578 -4.511 1.00 73.43 C ATOM 1286 C PHE A 85 -1.132 -22.902 -3.091 1.00 65.40 C ATOM 1287 O PHE A 85 -0.368 -22.760 -2.135 1.00 11.00 O ATOM 1288 CB PHE A 85 -1.275 -21.242 -4.958 1.00 25.25 C ATOM 1289 CG PHE A 85 -0.737 -20.062 -4.199 1.00 72.32 C ATOM 1290 CD1 PHE A 85 0.500 -19.524 -4.515 1.00 52.00 C ATOM 1291 CD2 PHE A 85 -1.469 -19.492 -3.170 1.00 41.10 C ATOM 1292 CE1 PHE A 85 0.997 -18.438 -3.819 1.00 41.04 C ATOM 1293 CE2 PHE A 85 -0.977 -18.406 -2.471 1.00 40.33 C ATOM 1294 CZ PHE A 85 0.258 -17.879 -2.795 1.00 50.25 C ATOM 0 H PHE A 85 -2.050 -23.635 -5.693 1.00 2.10 H new ATOM 0 HA PHE A 85 0.410 -22.502 -4.517 1.00 73.43 H new ATOM 0 HB2 PHE A 85 -1.077 -21.102 -6.021 1.00 25.25 H new ATOM 0 HB3 PHE A 85 -2.358 -21.279 -4.837 1.00 25.25 H new ATOM 0 HD1 PHE A 85 1.083 -19.958 -5.314 1.00 52.00 H new ATOM 0 HD2 PHE A 85 -2.435 -19.901 -2.911 1.00 41.10 H new ATOM 0 HE1 PHE A 85 1.962 -18.027 -4.076 1.00 41.04 H new ATOM 0 HE2 PHE A 85 -1.558 -17.970 -1.672 1.00 40.33 H new ATOM 0 HZ PHE A 85 0.645 -17.032 -2.249 1.00 50.25 H new ATOM 1304 N LEU A 86 -2.380 -23.338 -2.961 1.00 24.23 N ATOM 1305 CA LEU A 86 -2.938 -23.682 -1.657 1.00 64.55 C ATOM 1306 C LEU A 86 -2.295 -24.952 -1.108 1.00 73.33 C ATOM 1307 O LEU A 86 -1.787 -24.968 0.012 1.00 5.21 O ATOM 1308 CB LEU A 86 -4.452 -23.868 -1.762 1.00 54.31 C ATOM 1309 CG LEU A 86 -5.255 -23.566 -0.496 1.00 4.21 C ATOM 1310 CD1 LEU A 86 -6.685 -23.187 -0.848 1.00 21.43 C ATOM 1311 CD2 LEU A 86 -5.233 -24.761 0.446 1.00 15.54 C ATOM 0 H LEU A 86 -3.025 -23.462 -3.742 1.00 24.23 H new ATOM 0 HA LEU A 86 -2.725 -22.863 -0.970 1.00 64.55 H new ATOM 0 HB2 LEU A 86 -4.822 -23.229 -2.564 1.00 54.31 H new ATOM 0 HB3 LEU A 86 -4.652 -24.898 -2.058 1.00 54.31 H new ATOM 0 HG LEU A 86 -4.793 -22.720 0.012 1.00 4.21 H new ATOM 0 HD11 LEU A 86 -7.241 -22.976 0.066 1.00 21.43 H new ATOM 0 HD12 LEU A 86 -6.681 -22.301 -1.483 1.00 21.43 H new ATOM 0 HD13 LEU A 86 -7.160 -24.012 -1.379 1.00 21.43 H new ATOM 0 HD21 LEU A 86 -5.809 -24.529 1.342 1.00 15.54 H new ATOM 0 HD22 LEU A 86 -5.671 -25.626 -0.053 1.00 15.54 H new ATOM 0 HD23 LEU A 86 -4.203 -24.986 0.725 1.00 15.54 H new ATOM 1323 N ALA A 87 -2.321 -26.015 -1.906 1.00 42.21 N ATOM 1324 CA ALA A 87 -1.737 -27.288 -1.502 1.00 14.12 C ATOM 1325 C ALA A 87 -0.223 -27.178 -1.361 1.00 41.25 C ATOM 1326 O ALA A 87 0.424 -28.064 -0.804 1.00 42.22 O ATOM 1327 CB ALA A 87 -2.099 -28.376 -2.502 1.00 40.33 C ATOM 0 H ALA A 87 -2.740 -26.019 -2.836 1.00 42.21 H new ATOM 0 HA ALA A 87 -2.147 -27.555 -0.528 1.00 14.12 H new ATOM 0 HB1 ALA A 87 -1.656 -29.321 -2.188 1.00 40.33 H new ATOM 0 HB2 ALA A 87 -3.183 -28.481 -2.549 1.00 40.33 H new ATOM 0 HB3 ALA A 87 -1.718 -28.106 -3.487 1.00 40.33 H new ATOM 1333 N ALA A 88 0.336 -26.085 -1.871 1.00 60.23 N ATOM 1334 CA ALA A 88 1.774 -25.859 -1.801 1.00 63.24 C ATOM 1335 C ALA A 88 2.123 -24.883 -0.683 1.00 51.20 C ATOM 1336 O ALA A 88 3.221 -24.924 -0.130 1.00 32.04 O ATOM 1337 CB ALA A 88 2.293 -25.343 -3.136 1.00 20.55 C ATOM 0 H ALA A 88 -0.186 -25.343 -2.337 1.00 60.23 H new ATOM 0 HA ALA A 88 2.256 -26.811 -1.580 1.00 63.24 H new ATOM 0 HB1 ALA A 88 3.368 -25.179 -3.069 1.00 20.55 H new ATOM 0 HB2 ALA A 88 2.086 -26.077 -3.915 1.00 20.55 H new ATOM 0 HB3 ALA A 88 1.797 -24.404 -3.381 1.00 20.55 H new ATOM 1343 N GLY A 89 1.180 -24.004 -0.356 1.00 3.05 N ATOM 1344 CA GLY A 89 1.408 -23.029 0.695 1.00 50.11 C ATOM 1345 C GLY A 89 0.864 -23.483 2.035 1.00 52.41 C ATOM 1346 O GLY A 89 1.616 -23.642 2.996 1.00 0.44 O ATOM 0 H GLY A 89 0.263 -23.950 -0.800 1.00 3.05 H new ATOM 0 HA2 GLY A 89 2.478 -22.841 0.786 1.00 50.11 H new ATOM 0 HA3 GLY A 89 0.940 -22.084 0.418 1.00 50.11 H new ATOM 1350 N ASP A 90 -0.447 -23.690 2.100 1.00 42.22 N ATOM 1351 CA ASP A 90 -1.092 -24.127 3.333 1.00 64.35 C ATOM 1352 C ASP A 90 -0.373 -25.337 3.922 1.00 74.44 C ATOM 1353 O ASP A 90 -0.518 -26.458 3.432 1.00 21.34 O ATOM 1354 CB ASP A 90 -2.560 -24.467 3.072 1.00 10.13 C ATOM 1355 CG ASP A 90 -3.170 -25.292 4.188 1.00 0.15 C ATOM 1356 OD1 ASP A 90 -2.875 -25.004 5.367 1.00 34.33 O ATOM 1357 OD2 ASP A 90 -3.941 -26.226 3.883 1.00 13.32 O ATOM 0 H ASP A 90 -1.084 -23.562 1.313 1.00 42.22 H new ATOM 0 HA ASP A 90 -1.039 -23.310 4.052 1.00 64.35 H new ATOM 0 HB2 ASP A 90 -3.128 -23.544 2.954 1.00 10.13 H new ATOM 0 HB3 ASP A 90 -2.642 -25.014 2.133 1.00 10.13 H new ATOM 1362 N THR A 91 0.403 -25.103 4.975 1.00 32.54 N ATOM 1363 CA THR A 91 1.145 -26.173 5.630 1.00 25.00 C ATOM 1364 C THR A 91 0.700 -26.346 7.077 1.00 15.04 C ATOM 1365 O THR A 91 0.463 -27.464 7.535 1.00 74.35 O ATOM 1366 CB THR A 91 2.662 -25.904 5.601 1.00 52.44 C ATOM 1367 OG1 THR A 91 2.922 -24.532 5.920 1.00 31.10 O ATOM 1368 CG2 THR A 91 3.243 -26.230 4.233 1.00 20.23 C ATOM 0 H THR A 91 0.534 -24.182 5.393 1.00 32.54 H new ATOM 0 HA THR A 91 0.934 -27.088 5.076 1.00 25.00 H new ATOM 0 HB THR A 91 3.137 -26.546 6.343 1.00 52.44 H new ATOM 0 HG1 THR A 91 3.888 -24.369 5.901 1.00 31.10 H new ATOM 0 HG21 THR A 91 4.315 -26.032 4.236 1.00 20.23 H new ATOM 0 HG22 THR A 91 3.069 -27.281 4.005 1.00 20.23 H new ATOM 0 HG23 THR A 91 2.762 -25.610 3.476 1.00 20.23 H new ATOM 1376 N ASP A 92 0.586 -25.233 7.794 1.00 45.13 N ATOM 1377 CA ASP A 92 0.167 -25.262 9.190 1.00 52.40 C ATOM 1378 C ASP A 92 -1.231 -24.672 9.349 1.00 33.34 C ATOM 1379 O ASP A 92 -1.550 -24.073 10.375 1.00 10.32 O ATOM 1380 CB ASP A 92 1.161 -24.490 10.059 1.00 31.35 C ATOM 1381 CG ASP A 92 1.104 -24.910 11.515 1.00 0.12 C ATOM 1382 OD1 ASP A 92 1.814 -25.869 11.885 1.00 51.22 O ATOM 1383 OD2 ASP A 92 0.350 -24.279 12.285 1.00 3.10 O ATOM 0 H ASP A 92 0.778 -24.299 7.431 1.00 45.13 H new ATOM 0 HA ASP A 92 0.143 -26.302 9.515 1.00 52.40 H new ATOM 0 HB2 ASP A 92 2.170 -24.646 9.678 1.00 31.35 H new ATOM 0 HB3 ASP A 92 0.953 -23.423 9.983 1.00 31.35 H new ATOM 1388 N GLY A 93 -2.062 -24.847 8.326 1.00 41.22 N ATOM 1389 CA GLY A 93 -3.416 -24.326 8.372 1.00 44.42 C ATOM 1390 C GLY A 93 -4.448 -25.356 7.960 1.00 20.22 C ATOM 1391 O GLY A 93 -4.100 -26.466 7.557 1.00 73.23 O ATOM 0 H GLY A 93 -1.822 -25.340 7.466 1.00 41.22 H new ATOM 0 HA2 GLY A 93 -3.635 -23.981 9.382 1.00 44.42 H new ATOM 0 HA3 GLY A 93 -3.491 -23.459 7.716 1.00 44.42 H new ATOM 1395 N ASP A 94 -5.721 -24.990 8.064 1.00 62.15 N ATOM 1396 CA ASP A 94 -6.808 -25.892 7.699 1.00 3.44 C ATOM 1397 C ASP A 94 -7.586 -25.350 6.504 1.00 1.24 C ATOM 1398 O ASP A 94 -8.716 -24.885 6.646 1.00 50.12 O ATOM 1399 CB ASP A 94 -7.749 -26.095 8.887 1.00 34.42 C ATOM 1400 CG ASP A 94 -8.764 -27.194 8.640 1.00 73.14 C ATOM 1401 OD1 ASP A 94 -8.377 -28.380 8.684 1.00 22.14 O ATOM 1402 OD2 ASP A 94 -9.946 -26.868 8.400 1.00 0.21 O ATOM 0 H ASP A 94 -6.026 -24.076 8.398 1.00 62.15 H new ATOM 0 HA ASP A 94 -6.374 -26.852 7.421 1.00 3.44 H new ATOM 0 HB2 ASP A 94 -7.163 -26.338 9.773 1.00 34.42 H new ATOM 0 HB3 ASP A 94 -8.272 -25.162 9.096 1.00 34.42 H new ATOM 1407 N GLY A 95 -6.972 -25.412 5.327 1.00 64.43 N ATOM 1408 CA GLY A 95 -7.621 -24.923 4.125 1.00 60.55 C ATOM 1409 C GLY A 95 -7.431 -23.432 3.928 1.00 22.53 C ATOM 1410 O GLY A 95 -8.246 -22.775 3.281 1.00 2.52 O ATOM 0 H GLY A 95 -6.036 -25.792 5.184 1.00 64.43 H new ATOM 0 HA2 GLY A 95 -7.224 -25.454 3.260 1.00 60.55 H new ATOM 0 HA3 GLY A 95 -8.687 -25.147 4.175 1.00 60.55 H new ATOM 1414 N LYS A 96 -6.352 -22.896 4.489 1.00 33.34 N ATOM 1415 CA LYS A 96 -6.057 -21.473 4.374 1.00 25.20 C ATOM 1416 C LYS A 96 -4.552 -21.225 4.415 1.00 71.23 C ATOM 1417 O LYS A 96 -3.769 -22.141 4.670 1.00 55.01 O ATOM 1418 CB LYS A 96 -6.743 -20.696 5.499 1.00 1.24 C ATOM 1419 CG LYS A 96 -8.202 -21.070 5.695 1.00 22.45 C ATOM 1420 CD LYS A 96 -8.817 -20.323 6.866 1.00 10.54 C ATOM 1421 CE LYS A 96 -10.168 -20.905 7.252 1.00 21.42 C ATOM 1422 NZ LYS A 96 -10.924 -19.999 8.160 1.00 20.34 N ATOM 0 H LYS A 96 -5.667 -23.426 5.028 1.00 33.34 H new ATOM 0 HA LYS A 96 -6.440 -21.124 3.415 1.00 25.20 H new ATOM 0 HB2 LYS A 96 -6.204 -20.870 6.430 1.00 1.24 H new ATOM 0 HB3 LYS A 96 -6.676 -19.629 5.286 1.00 1.24 H new ATOM 0 HG2 LYS A 96 -8.761 -20.847 4.786 1.00 22.45 H new ATOM 0 HG3 LYS A 96 -8.284 -22.144 5.864 1.00 22.45 H new ATOM 0 HD2 LYS A 96 -8.143 -20.367 7.721 1.00 10.54 H new ATOM 0 HD3 LYS A 96 -8.934 -19.271 6.607 1.00 10.54 H new ATOM 0 HE2 LYS A 96 -10.755 -21.089 6.352 1.00 21.42 H new ATOM 0 HE3 LYS A 96 -10.022 -21.869 7.740 1.00 21.42 H new ATOM 0 HZ1 LYS A 96 -11.839 -20.432 8.400 1.00 20.34 H new ATOM 0 HZ2 LYS A 96 -10.376 -19.843 9.030 1.00 20.34 H new ATOM 0 HZ3 LYS A 96 -11.086 -19.088 7.685 1.00 20.34 H new ATOM 1436 N ILE A 97 -4.155 -19.982 4.163 1.00 21.42 N ATOM 1437 CA ILE A 97 -2.745 -19.615 4.174 1.00 45.31 C ATOM 1438 C ILE A 97 -2.533 -18.269 4.858 1.00 4.44 C ATOM 1439 O ILE A 97 -3.097 -17.256 4.447 1.00 1.34 O ATOM 1440 CB ILE A 97 -2.169 -19.549 2.747 1.00 50.41 C ATOM 1441 CG1 ILE A 97 -2.143 -20.944 2.119 1.00 55.52 C ATOM 1442 CG2 ILE A 97 -0.773 -18.945 2.766 1.00 3.24 C ATOM 1443 CD1 ILE A 97 -1.572 -20.965 0.719 1.00 64.35 C ATOM 0 H ILE A 97 -4.790 -19.213 3.949 1.00 21.42 H new ATOM 0 HA ILE A 97 -2.221 -20.391 4.733 1.00 45.31 H new ATOM 0 HB ILE A 97 -2.812 -18.910 2.141 1.00 50.41 H new ATOM 0 HG12 ILE A 97 -1.555 -21.608 2.753 1.00 55.52 H new ATOM 0 HG13 ILE A 97 -3.157 -21.342 2.095 1.00 55.52 H new ATOM 0 HG21 ILE A 97 -0.380 -18.905 1.750 1.00 3.24 H new ATOM 0 HG22 ILE A 97 -0.818 -17.937 3.177 1.00 3.24 H new ATOM 0 HG23 ILE A 97 -0.119 -19.560 3.384 1.00 3.24 H new ATOM 0 HD11 ILE A 97 -1.584 -21.986 0.336 1.00 64.35 H new ATOM 0 HD12 ILE A 97 -2.173 -20.327 0.071 1.00 64.35 H new ATOM 0 HD13 ILE A 97 -0.546 -20.597 0.739 1.00 64.35 H new ATOM 1455 N GLY A 98 -1.713 -18.266 5.905 1.00 3.43 N ATOM 1456 CA GLY A 98 -1.439 -17.038 6.629 1.00 22.14 C ATOM 1457 C GLY A 98 -0.150 -16.377 6.183 1.00 41.11 C ATOM 1458 O GLY A 98 -0.021 -15.967 5.029 1.00 12.23 O ATOM 0 H GLY A 98 -1.234 -19.092 6.265 1.00 3.43 H new ATOM 0 HA2 GLY A 98 -2.267 -16.344 6.487 1.00 22.14 H new ATOM 0 HA3 GLY A 98 -1.383 -17.254 7.696 1.00 22.14 H new ATOM 1462 N VAL A 99 0.807 -16.271 7.099 1.00 4.01 N ATOM 1463 CA VAL A 99 2.093 -15.654 6.794 1.00 73.10 C ATOM 1464 C VAL A 99 3.215 -16.685 6.813 1.00 25.31 C ATOM 1465 O VAL A 99 3.944 -16.841 5.834 1.00 24.21 O ATOM 1466 CB VAL A 99 2.426 -14.529 7.792 1.00 65.41 C ATOM 1467 CG1 VAL A 99 2.306 -13.169 7.123 1.00 44.42 C ATOM 1468 CG2 VAL A 99 1.522 -14.614 9.012 1.00 71.40 C ATOM 0 H VAL A 99 0.716 -16.604 8.059 1.00 4.01 H new ATOM 0 HA VAL A 99 2.012 -15.229 5.794 1.00 73.10 H new ATOM 0 HB VAL A 99 3.457 -14.654 8.123 1.00 65.41 H new ATOM 0 HG11 VAL A 99 2.545 -12.387 7.843 1.00 44.42 H new ATOM 0 HG12 VAL A 99 3.000 -13.114 6.284 1.00 44.42 H new ATOM 0 HG13 VAL A 99 1.287 -13.030 6.761 1.00 44.42 H new ATOM 0 HG21 VAL A 99 1.771 -13.812 9.706 1.00 71.40 H new ATOM 0 HG22 VAL A 99 0.482 -14.515 8.702 1.00 71.40 H new ATOM 0 HG23 VAL A 99 1.664 -15.576 9.504 1.00 71.40 H new ATOM 1478 N GLU A 100 3.348 -17.387 7.934 1.00 31.22 N ATOM 1479 CA GLU A 100 4.383 -18.404 8.080 1.00 11.03 C ATOM 1480 C GLU A 100 4.318 -19.415 6.939 1.00 53.31 C ATOM 1481 O GLU A 100 5.336 -19.971 6.531 1.00 64.13 O ATOM 1482 CB GLU A 100 4.236 -19.124 9.423 1.00 41.24 C ATOM 1483 CG GLU A 100 5.364 -18.831 10.397 1.00 4.31 C ATOM 1484 CD GLU A 100 6.694 -19.395 9.936 1.00 4.24 C ATOM 1485 OE1 GLU A 100 6.744 -19.963 8.825 1.00 21.03 O ATOM 1486 OE2 GLU A 100 7.685 -19.269 10.686 1.00 12.43 O ATOM 0 H GLU A 100 2.752 -17.270 8.754 1.00 31.22 H new ATOM 0 HA GLU A 100 5.352 -17.906 8.046 1.00 11.03 H new ATOM 0 HB2 GLU A 100 3.289 -18.835 9.879 1.00 41.24 H new ATOM 0 HB3 GLU A 100 4.190 -20.199 9.246 1.00 41.24 H new ATOM 0 HG2 GLU A 100 5.456 -17.753 10.527 1.00 4.31 H new ATOM 0 HG3 GLU A 100 5.115 -19.249 11.372 1.00 4.31 H new ATOM 1493 N GLU A 101 3.112 -19.646 6.430 1.00 73.44 N ATOM 1494 CA GLU A 101 2.914 -20.591 5.337 1.00 75.04 C ATOM 1495 C GLU A 101 3.113 -19.910 3.986 1.00 41.22 C ATOM 1496 O GLU A 101 3.408 -20.564 2.985 1.00 20.15 O ATOM 1497 CB GLU A 101 1.513 -21.203 5.410 1.00 50.15 C ATOM 1498 CG GLU A 101 1.151 -21.732 6.787 1.00 30.20 C ATOM 1499 CD GLU A 101 0.555 -20.665 7.684 1.00 54.11 C ATOM 1500 OE1 GLU A 101 -0.651 -20.375 7.541 1.00 54.44 O ATOM 1501 OE2 GLU A 101 1.295 -20.120 8.530 1.00 73.14 O ATOM 0 H GLU A 101 2.259 -19.193 6.756 1.00 73.44 H new ATOM 0 HA GLU A 101 3.655 -21.384 5.438 1.00 75.04 H new ATOM 0 HB2 GLU A 101 0.781 -20.451 5.115 1.00 50.15 H new ATOM 0 HB3 GLU A 101 1.443 -22.016 4.688 1.00 50.15 H new ATOM 0 HG2 GLU A 101 0.440 -22.551 6.682 1.00 30.20 H new ATOM 0 HG3 GLU A 101 2.043 -22.143 7.260 1.00 30.20 H new ATOM 1508 N PHE A 102 2.950 -18.591 3.965 1.00 75.11 N ATOM 1509 CA PHE A 102 3.110 -17.820 2.738 1.00 71.24 C ATOM 1510 C PHE A 102 4.578 -17.748 2.328 1.00 21.15 C ATOM 1511 O PHE A 102 4.952 -18.186 1.241 1.00 74.32 O ATOM 1512 CB PHE A 102 2.550 -16.408 2.920 1.00 32.13 C ATOM 1513 CG PHE A 102 2.544 -15.597 1.656 1.00 74.41 C ATOM 1514 CD1 PHE A 102 1.529 -15.749 0.725 1.00 53.00 C ATOM 1515 CD2 PHE A 102 3.553 -14.684 1.398 1.00 21.01 C ATOM 1516 CE1 PHE A 102 1.520 -15.004 -0.439 1.00 73.34 C ATOM 1517 CE2 PHE A 102 3.549 -13.936 0.236 1.00 63.32 C ATOM 1518 CZ PHE A 102 2.532 -14.097 -0.685 1.00 21.43 C ATOM 0 H PHE A 102 2.707 -18.034 4.784 1.00 75.11 H new ATOM 0 HA PHE A 102 2.554 -18.324 1.947 1.00 71.24 H new ATOM 0 HB2 PHE A 102 1.532 -16.476 3.303 1.00 32.13 H new ATOM 0 HB3 PHE A 102 3.140 -15.886 3.674 1.00 32.13 H new ATOM 0 HD1 PHE A 102 0.736 -16.458 0.911 1.00 53.00 H new ATOM 0 HD2 PHE A 102 4.352 -14.555 2.113 1.00 21.01 H new ATOM 0 HE1 PHE A 102 0.722 -15.131 -1.156 1.00 73.34 H new ATOM 0 HE2 PHE A 102 4.341 -13.226 0.048 1.00 63.32 H new ATOM 0 HZ PHE A 102 2.528 -13.515 -1.595 1.00 21.43 H new ATOM 1528 N GLN A 103 5.405 -17.192 3.208 1.00 14.31 N ATOM 1529 CA GLN A 103 6.832 -17.061 2.938 1.00 15.20 C ATOM 1530 C GLN A 103 7.493 -18.431 2.830 1.00 0.23 C ATOM 1531 O GLN A 103 8.592 -18.560 2.291 1.00 52.35 O ATOM 1532 CB GLN A 103 7.507 -16.240 4.038 1.00 21.21 C ATOM 1533 CG GLN A 103 7.267 -16.784 5.437 1.00 20.12 C ATOM 1534 CD GLN A 103 8.080 -16.060 6.492 1.00 14.33 C ATOM 1535 OE1 GLN A 103 8.313 -14.855 6.394 1.00 52.41 O ATOM 1536 NE2 GLN A 103 8.516 -16.792 7.510 1.00 32.33 N ATOM 0 H GLN A 103 5.111 -16.825 4.113 1.00 14.31 H new ATOM 0 HA GLN A 103 6.951 -16.545 1.985 1.00 15.20 H new ATOM 0 HB2 GLN A 103 8.580 -16.207 3.849 1.00 21.21 H new ATOM 0 HB3 GLN A 103 7.143 -15.214 3.989 1.00 21.21 H new ATOM 0 HG2 GLN A 103 6.208 -16.699 5.679 1.00 20.12 H new ATOM 0 HG3 GLN A 103 7.515 -17.845 5.458 1.00 20.12 H new ATOM 0 HE21 GLN A 103 8.300 -17.788 7.552 1.00 32.33 H new ATOM 0 HE22 GLN A 103 9.067 -16.359 8.251 1.00 32.33 H new ATOM 1545 N SER A 104 6.817 -19.451 3.348 1.00 72.42 N ATOM 1546 CA SER A 104 7.341 -20.812 3.313 1.00 0.35 C ATOM 1547 C SER A 104 7.155 -21.431 1.931 1.00 1.25 C ATOM 1548 O SER A 104 7.592 -22.554 1.677 1.00 3.04 O ATOM 1549 CB SER A 104 6.647 -21.675 4.369 1.00 3.10 C ATOM 1550 OG SER A 104 6.926 -23.050 4.167 1.00 3.53 O ATOM 0 H SER A 104 5.905 -19.361 3.797 1.00 72.42 H new ATOM 0 HA SER A 104 8.408 -20.770 3.532 1.00 0.35 H new ATOM 0 HB2 SER A 104 6.979 -21.376 5.363 1.00 3.10 H new ATOM 0 HB3 SER A 104 5.570 -21.509 4.329 1.00 3.10 H new ATOM 0 HG SER A 104 7.482 -23.157 3.367 1.00 3.53 H new ATOM 1556 N LEU A 105 6.503 -20.690 1.042 1.00 64.54 N ATOM 1557 CA LEU A 105 6.259 -21.165 -0.316 1.00 35.10 C ATOM 1558 C LEU A 105 6.933 -20.258 -1.340 1.00 24.20 C ATOM 1559 O LEU A 105 7.467 -20.728 -2.345 1.00 23.12 O ATOM 1560 CB LEU A 105 4.755 -21.233 -0.590 1.00 42.02 C ATOM 1561 CG LEU A 105 4.345 -21.348 -2.059 1.00 3.02 C ATOM 1562 CD1 LEU A 105 3.065 -22.157 -2.194 1.00 31.42 C ATOM 1563 CD2 LEU A 105 4.173 -19.967 -2.674 1.00 53.11 C ATOM 0 H LEU A 105 6.134 -19.759 1.236 1.00 64.54 H new ATOM 0 HA LEU A 105 6.685 -22.164 -0.407 1.00 35.10 H new ATOM 0 HB2 LEU A 105 4.346 -22.088 -0.051 1.00 42.02 H new ATOM 0 HB3 LEU A 105 4.289 -20.341 -0.172 1.00 42.02 H new ATOM 0 HG LEU A 105 5.137 -21.868 -2.598 1.00 3.02 H new ATOM 0 HD11 LEU A 105 2.789 -22.228 -3.246 1.00 31.42 H new ATOM 0 HD12 LEU A 105 3.223 -23.158 -1.792 1.00 31.42 H new ATOM 0 HD13 LEU A 105 2.264 -21.666 -1.641 1.00 31.42 H new ATOM 0 HD21 LEU A 105 3.881 -20.068 -3.719 1.00 53.11 H new ATOM 0 HD22 LEU A 105 3.400 -19.421 -2.133 1.00 53.11 H new ATOM 0 HD23 LEU A 105 5.114 -19.421 -2.611 1.00 53.11 H new ATOM 1575 N VAL A 106 6.907 -18.955 -1.077 1.00 64.41 N ATOM 1576 CA VAL A 106 7.519 -17.982 -1.974 1.00 24.21 C ATOM 1577 C VAL A 106 9.029 -18.179 -2.051 1.00 22.14 C ATOM 1578 O VAL A 106 9.616 -18.154 -3.133 1.00 32.32 O ATOM 1579 CB VAL A 106 7.223 -16.540 -1.523 1.00 2.51 C ATOM 1580 CG1 VAL A 106 7.775 -15.541 -2.529 1.00 61.43 C ATOM 1581 CG2 VAL A 106 5.728 -16.340 -1.326 1.00 40.44 C ATOM 0 H VAL A 106 6.469 -18.549 -0.250 1.00 64.41 H new ATOM 0 HA VAL A 106 7.084 -18.143 -2.960 1.00 24.21 H new ATOM 0 HB VAL A 106 7.719 -16.368 -0.568 1.00 2.51 H new ATOM 0 HG11 VAL A 106 7.556 -14.527 -2.193 1.00 61.43 H new ATOM 0 HG12 VAL A 106 8.854 -15.670 -2.615 1.00 61.43 H new ATOM 0 HG13 VAL A 106 7.311 -15.709 -3.501 1.00 61.43 H new ATOM 0 HG21 VAL A 106 5.537 -15.315 -1.007 1.00 40.44 H new ATOM 0 HG22 VAL A 106 5.209 -16.531 -2.265 1.00 40.44 H new ATOM 0 HG23 VAL A 106 5.366 -17.030 -0.564 1.00 40.44 H new ATOM 1591 N LYS A 107 9.654 -18.375 -0.895 1.00 22.54 N ATOM 1592 CA LYS A 107 11.097 -18.579 -0.829 1.00 15.00 C ATOM 1593 C LYS A 107 11.502 -19.843 -1.580 1.00 45.24 C ATOM 1594 O LYS A 107 12.672 -20.029 -1.913 1.00 64.34 O ATOM 1595 CB LYS A 107 11.554 -18.671 0.629 1.00 55.43 C ATOM 1596 CG LYS A 107 11.357 -17.383 1.410 1.00 75.00 C ATOM 1597 CD LYS A 107 12.535 -16.440 1.237 1.00 41.22 C ATOM 1598 CE LYS A 107 13.753 -16.923 2.009 1.00 45.42 C ATOM 1599 NZ LYS A 107 13.509 -16.939 3.478 1.00 52.34 N ATOM 0 H LYS A 107 9.184 -18.397 0.010 1.00 22.54 H new ATOM 0 HA LYS A 107 11.582 -17.725 -1.302 1.00 15.00 H new ATOM 0 HB2 LYS A 107 11.006 -19.473 1.123 1.00 55.43 H new ATOM 0 HB3 LYS A 107 12.609 -18.944 0.654 1.00 55.43 H new ATOM 0 HG2 LYS A 107 10.444 -16.890 1.077 1.00 75.00 H new ATOM 0 HG3 LYS A 107 11.227 -17.614 2.467 1.00 75.00 H new ATOM 0 HD2 LYS A 107 12.783 -16.356 0.179 1.00 41.22 H new ATOM 0 HD3 LYS A 107 12.258 -15.443 1.579 1.00 41.22 H new ATOM 0 HE2 LYS A 107 14.021 -17.925 1.675 1.00 45.42 H new ATOM 0 HE3 LYS A 107 14.602 -16.276 1.789 1.00 45.42 H new ATOM 0 HZ1 LYS A 107 14.419 -16.973 3.981 1.00 52.34 H new ATOM 0 HZ2 LYS A 107 12.993 -16.079 3.754 1.00 52.34 H new ATOM 0 HZ3 LYS A 107 12.945 -17.776 3.727 1.00 52.34 H new ATOM 1613 N ALA A 108 10.528 -20.707 -1.845 1.00 42.14 N ATOM 1614 CA ALA A 108 10.784 -21.951 -2.561 1.00 1.13 C ATOM 1615 C ALA A 108 10.733 -21.737 -4.070 1.00 31.03 C ATOM 1616 O ALA A 108 9.820 -21.090 -4.584 1.00 10.51 O ATOM 1617 CB ALA A 108 9.781 -23.016 -2.142 1.00 64.14 C ATOM 0 H ALA A 108 9.554 -20.569 -1.575 1.00 42.14 H new ATOM 0 HA ALA A 108 11.787 -22.290 -2.303 1.00 1.13 H new ATOM 0 HB1 ALA A 108 9.983 -23.940 -2.684 1.00 64.14 H new ATOM 0 HB2 ALA A 108 9.869 -23.197 -1.071 1.00 64.14 H new ATOM 0 HB3 ALA A 108 8.771 -22.675 -2.371 1.00 64.14 H new TER 1623 ALA A 108