USER MOD reduce.3.24.130724 H: found=0, std=0, add=709, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 706 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 77 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 80 GLN : amide:sc= 0.944 K(o=0.94,f=-4.1!) USER MOD Set 2.1: A 30 THR OG1 : rot 180:sc= -0.0323 USER MOD Set 2.2: A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 LYS NZ :NH3+ -108:sc= 1.26 (180deg=-0.0784) USER MOD Single : A 21 THR OG1 : rot 47:sc= 0.0475 USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 34 ASN : amide:sc= 0 X(o=0,f=-0.46) USER MOD Single : A 35 THR OG1 : rot -102:sc= 0.382 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 39 HIS : no HE2:sc= 0.113 K(o=0.11,f=-0.71) USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 60 HIS : no HE2:sc= 0.369 K(o=0.37,f=-1.4) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 ASN : amide:sc= 0.445 K(o=0.44,f=-4.1!) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 78 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 THR OG1 : rot 83:sc= 1.07 USER MOD Single : A 87 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 88 THR OG1 : rot 150:sc= -0.046 USER MOD Single : A 90 GLN : amide:sc= 0 X(o=0,f=-0.2) USER MOD Single : A 93 HIS : no HD1:sc= -0.489 K(o=-0.49,f=-1.1) USER MOD Single : A 98 LYS NZ :NH3+ 164:sc= 1.27 (180deg=0.84) USER MOD Single : A 100 GLN : amide:sc= 0 K(o=0,f=-0.87) USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 9 24.812 45.144 22.393 1.00 0.00 N ATOM 2 CA LYS A 9 24.671 44.191 21.336 1.00 0.00 C ATOM 3 C LYS A 9 25.206 42.863 21.745 1.00 0.00 C ATOM 4 O LYS A 9 26.364 42.568 21.453 1.00 0.00 O ATOM 5 CB LYS A 9 25.356 44.665 20.042 1.00 0.00 C ATOM 6 CG LYS A 9 24.767 45.945 19.446 1.00 0.00 C ATOM 7 CD LYS A 9 25.302 46.243 18.043 1.00 0.00 C ATOM 8 CE LYS A 9 26.757 46.712 17.978 1.00 0.00 C ATOM 9 NZ LYS A 9 26.864 48.188 17.941 1.00 0.00 N ATOM 0 HA LYS A 9 23.605 44.094 21.132 1.00 0.00 H new ATOM 0 HB2 LYS A 9 26.415 44.827 20.244 1.00 0.00 H new ATOM 0 HB3 LYS A 9 25.291 43.870 19.299 1.00 0.00 H new ATOM 0 HG2 LYS A 9 23.681 45.856 19.405 1.00 0.00 H new ATOM 0 HG3 LYS A 9 24.994 46.785 20.103 1.00 0.00 H new ATOM 0 HD2 LYS A 9 25.201 45.343 17.436 1.00 0.00 H new ATOM 0 HD3 LYS A 9 24.672 47.007 17.588 1.00 0.00 H new ATOM 0 HE2 LYS A 9 27.299 46.331 18.843 1.00 0.00 H new ATOM 0 HE3 LYS A 9 27.234 46.292 17.092 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 27.866 48.462 17.897 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 26.369 48.551 17.102 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 26.432 48.589 18.798 1.00 0.00 H new ATOM 23 N PRO A 10 24.484 41.992 22.385 1.00 0.00 N ATOM 24 CA PRO A 10 24.774 40.587 22.377 1.00 0.00 C ATOM 25 C PRO A 10 24.311 39.981 21.097 1.00 0.00 C ATOM 26 O PRO A 10 23.796 40.691 20.234 1.00 0.00 O ATOM 27 CB PRO A 10 23.975 40.063 23.569 1.00 0.00 C ATOM 28 CG PRO A 10 22.711 40.936 23.560 1.00 0.00 C ATOM 29 CD PRO A 10 23.250 42.297 23.092 1.00 0.00 C ATOM 0 HA PRO A 10 25.836 40.352 22.452 1.00 0.00 H new ATOM 0 HB2 PRO A 10 23.734 39.006 23.458 1.00 0.00 H new ATOM 0 HB3 PRO A 10 24.529 40.168 24.502 1.00 0.00 H new ATOM 0 HG2 PRO A 10 21.953 40.545 22.882 1.00 0.00 H new ATOM 0 HG3 PRO A 10 22.254 40.998 24.548 1.00 0.00 H new ATOM 0 HD2 PRO A 10 22.536 42.801 22.440 1.00 0.00 H new ATOM 0 HD3 PRO A 10 23.433 42.960 23.937 1.00 0.00 H new ATOM 37 N GLY A 11 24.494 38.666 20.882 1.00 0.00 N ATOM 38 CA GLY A 11 23.991 38.022 19.709 1.00 0.00 C ATOM 39 C GLY A 11 24.940 38.036 18.560 1.00 0.00 C ATOM 40 O GLY A 11 24.653 37.505 17.489 1.00 0.00 O ATOM 0 H GLY A 11 24.992 38.047 21.522 1.00 0.00 H new ATOM 0 HA2 GLY A 11 23.744 36.988 19.951 1.00 0.00 H new ATOM 0 HA3 GLY A 11 23.064 38.509 19.408 1.00 0.00 H new ATOM 44 N ASP A 12 26.113 38.671 18.733 1.00 0.00 N ATOM 45 CA ASP A 12 27.127 38.759 17.728 1.00 0.00 C ATOM 46 C ASP A 12 27.928 37.503 17.699 1.00 0.00 C ATOM 47 O ASP A 12 28.056 36.804 18.702 1.00 0.00 O ATOM 48 CB ASP A 12 28.001 39.993 18.010 1.00 0.00 C ATOM 49 CG ASP A 12 28.813 40.441 16.803 1.00 0.00 C ATOM 50 OD1 ASP A 12 28.418 40.168 15.638 1.00 0.00 O ATOM 51 OD2 ASP A 12 29.838 41.144 17.009 1.00 0.00 O ATOM 0 H ASP A 12 26.365 39.140 19.603 1.00 0.00 H new ATOM 0 HA ASP A 12 26.676 38.875 16.743 1.00 0.00 H new ATOM 0 HB2 ASP A 12 27.364 40.815 18.336 1.00 0.00 H new ATOM 0 HB3 ASP A 12 28.679 39.769 18.833 1.00 0.00 H new ATOM 56 N THR A 13 28.469 37.156 16.517 1.00 0.00 N ATOM 57 CA THR A 13 29.245 35.975 16.301 1.00 0.00 C ATOM 58 C THR A 13 30.699 36.295 16.246 1.00 0.00 C ATOM 59 O THR A 13 31.109 37.414 15.942 1.00 0.00 O ATOM 60 CB THR A 13 28.899 35.208 15.059 1.00 0.00 C ATOM 61 OG1 THR A 13 28.867 36.033 13.904 1.00 0.00 O ATOM 62 CG2 THR A 13 27.515 34.561 15.234 1.00 0.00 C ATOM 0 H THR A 13 28.361 37.723 15.676 1.00 0.00 H new ATOM 0 HA THR A 13 29.003 35.342 17.154 1.00 0.00 H new ATOM 0 HB THR A 13 29.674 34.455 14.915 1.00 0.00 H new ATOM 0 HG1 THR A 13 28.639 35.490 13.120 1.00 0.00 H new ATOM 0 HG21 THR A 13 27.258 34.002 14.334 1.00 0.00 H new ATOM 0 HG22 THR A 13 27.535 33.884 16.088 1.00 0.00 H new ATOM 0 HG23 THR A 13 26.769 35.338 15.404 1.00 0.00 H new ATOM 70 N PHE A 14 31.544 35.283 16.514 1.00 0.00 N ATOM 71 CA PHE A 14 32.966 35.441 16.471 1.00 0.00 C ATOM 72 C PHE A 14 33.522 34.145 15.992 1.00 0.00 C ATOM 73 O PHE A 14 33.275 33.088 16.571 1.00 0.00 O ATOM 74 CB PHE A 14 33.660 35.750 17.807 1.00 0.00 C ATOM 75 CG PHE A 14 32.835 36.584 18.725 1.00 0.00 C ATOM 76 CD1 PHE A 14 31.856 35.974 19.473 1.00 0.00 C ATOM 77 CD2 PHE A 14 33.027 37.940 18.845 1.00 0.00 C ATOM 78 CE1 PHE A 14 31.043 36.701 20.311 1.00 0.00 C ATOM 79 CE2 PHE A 14 32.225 38.676 19.685 1.00 0.00 C ATOM 80 CZ PHE A 14 31.227 38.061 20.405 1.00 0.00 C ATOM 0 H PHE A 14 31.237 34.343 16.764 1.00 0.00 H new ATOM 0 HA PHE A 14 33.153 36.304 15.832 1.00 0.00 H new ATOM 0 HB2 PHE A 14 33.908 34.812 18.304 1.00 0.00 H new ATOM 0 HB3 PHE A 14 34.601 36.264 17.609 1.00 0.00 H new ATOM 0 HD1 PHE A 14 31.723 34.905 19.401 1.00 0.00 H new ATOM 0 HD2 PHE A 14 33.808 38.427 18.280 1.00 0.00 H new ATOM 0 HE1 PHE A 14 30.272 36.211 20.887 1.00 0.00 H new ATOM 0 HE2 PHE A 14 32.379 39.741 19.780 1.00 0.00 H new ATOM 0 HZ PHE A 14 30.586 38.648 21.046 1.00 0.00 H new ATOM 90 N GLU A 15 34.311 34.193 14.904 1.00 0.00 N ATOM 91 CA GLU A 15 35.198 33.138 14.523 1.00 0.00 C ATOM 92 C GLU A 15 36.518 33.344 15.180 1.00 0.00 C ATOM 93 O GLU A 15 37.267 34.276 14.889 1.00 0.00 O ATOM 94 CB GLU A 15 35.323 32.982 12.998 1.00 0.00 C ATOM 95 CG GLU A 15 34.016 32.477 12.383 1.00 0.00 C ATOM 96 CD GLU A 15 34.094 32.225 10.884 1.00 0.00 C ATOM 97 OE1 GLU A 15 34.342 33.192 10.117 1.00 0.00 O ATOM 98 OE2 GLU A 15 33.820 31.073 10.453 1.00 0.00 O ATOM 0 H GLU A 15 34.332 34.991 14.269 1.00 0.00 H new ATOM 0 HA GLU A 15 34.775 32.195 14.869 1.00 0.00 H new ATOM 0 HB2 GLU A 15 35.591 33.940 12.553 1.00 0.00 H new ATOM 0 HB3 GLU A 15 36.129 32.286 12.766 1.00 0.00 H new ATOM 0 HG2 GLU A 15 33.725 31.553 12.882 1.00 0.00 H new ATOM 0 HG3 GLU A 15 33.229 33.206 12.578 1.00 0.00 H new ATOM 105 N VAL A 16 36.810 32.479 16.168 1.00 0.00 N ATOM 106 CA VAL A 16 37.876 32.547 17.119 1.00 0.00 C ATOM 107 C VAL A 16 38.993 31.667 16.671 1.00 0.00 C ATOM 108 O VAL A 16 38.887 30.442 16.692 1.00 0.00 O ATOM 109 CB VAL A 16 37.341 32.111 18.450 1.00 0.00 C ATOM 110 CG1 VAL A 16 38.423 31.762 19.486 1.00 0.00 C ATOM 111 CG2 VAL A 16 36.414 33.209 18.998 1.00 0.00 C ATOM 0 H VAL A 16 36.238 31.647 16.313 1.00 0.00 H new ATOM 0 HA VAL A 16 38.262 33.563 17.204 1.00 0.00 H new ATOM 0 HB VAL A 16 36.795 31.183 18.280 1.00 0.00 H new ATOM 0 HG11 VAL A 16 37.949 31.457 20.419 1.00 0.00 H new ATOM 0 HG12 VAL A 16 39.039 30.946 19.108 1.00 0.00 H new ATOM 0 HG13 VAL A 16 39.049 32.636 19.666 1.00 0.00 H new ATOM 0 HG21 VAL A 16 36.019 32.902 19.966 1.00 0.00 H new ATOM 0 HG22 VAL A 16 36.976 34.136 19.113 1.00 0.00 H new ATOM 0 HG23 VAL A 16 35.589 33.369 18.304 1.00 0.00 H new ATOM 121 N GLU A 17 40.118 32.254 16.227 1.00 0.00 N ATOM 122 CA GLU A 17 41.302 31.526 15.892 1.00 0.00 C ATOM 123 C GLU A 17 42.166 31.387 17.099 1.00 0.00 C ATOM 124 O GLU A 17 42.876 32.309 17.498 1.00 0.00 O ATOM 125 CB GLU A 17 42.071 32.193 14.738 1.00 0.00 C ATOM 126 CG GLU A 17 42.141 31.303 13.497 1.00 0.00 C ATOM 127 CD GLU A 17 42.907 31.957 12.355 1.00 0.00 C ATOM 128 OE1 GLU A 17 44.131 32.215 12.500 1.00 0.00 O ATOM 129 OE2 GLU A 17 42.301 32.186 11.274 1.00 0.00 O ATOM 0 H GLU A 17 40.207 33.262 16.097 1.00 0.00 H new ATOM 0 HA GLU A 17 41.009 30.534 15.549 1.00 0.00 H new ATOM 0 HB2 GLU A 17 41.588 33.136 14.480 1.00 0.00 H new ATOM 0 HB3 GLU A 17 43.082 32.432 15.068 1.00 0.00 H new ATOM 0 HG2 GLU A 17 42.619 30.359 13.757 1.00 0.00 H new ATOM 0 HG3 GLU A 17 41.130 31.068 13.165 1.00 0.00 H new ATOM 136 N LEU A 18 42.131 30.205 17.738 1.00 0.00 N ATOM 137 CA LEU A 18 43.009 29.876 18.818 1.00 0.00 C ATOM 138 C LEU A 18 43.994 28.864 18.346 1.00 0.00 C ATOM 139 O LEU A 18 43.783 28.124 17.387 1.00 0.00 O ATOM 140 CB LEU A 18 42.268 29.274 20.024 1.00 0.00 C ATOM 141 CG LEU A 18 41.408 30.280 20.808 1.00 0.00 C ATOM 142 CD1 LEU A 18 40.451 29.517 21.739 1.00 0.00 C ATOM 143 CD2 LEU A 18 42.236 31.310 21.595 1.00 0.00 C ATOM 0 H LEU A 18 41.477 29.460 17.499 1.00 0.00 H new ATOM 0 HA LEU A 18 43.487 30.803 19.135 1.00 0.00 H new ATOM 0 HB2 LEU A 18 41.629 28.463 19.675 1.00 0.00 H new ATOM 0 HB3 LEU A 18 42.999 28.834 20.702 1.00 0.00 H new ATOM 0 HG LEU A 18 40.838 30.856 20.079 1.00 0.00 H new ATOM 0 HD11 LEU A 18 39.841 30.228 22.296 1.00 0.00 H new ATOM 0 HD12 LEU A 18 39.805 28.870 21.146 1.00 0.00 H new ATOM 0 HD13 LEU A 18 41.029 28.911 22.437 1.00 0.00 H new ATOM 0 HD21 LEU A 18 41.566 31.988 22.124 1.00 0.00 H new ATOM 0 HD22 LEU A 18 42.871 30.793 22.314 1.00 0.00 H new ATOM 0 HD23 LEU A 18 42.858 31.880 20.905 1.00 0.00 H new ATOM 155 N ALA A 19 45.137 28.784 19.050 1.00 0.00 N ATOM 156 CA ALA A 19 45.915 27.588 19.144 1.00 0.00 C ATOM 157 C ALA A 19 45.610 27.053 20.501 1.00 0.00 C ATOM 158 O ALA A 19 45.386 27.823 21.435 1.00 0.00 O ATOM 159 CB ALA A 19 47.418 27.859 18.966 1.00 0.00 C ATOM 0 H ALA A 19 45.530 29.570 19.567 1.00 0.00 H new ATOM 0 HA ALA A 19 45.667 26.879 18.354 1.00 0.00 H new ATOM 0 HB1 ALA A 19 47.969 26.922 19.045 1.00 0.00 H new ATOM 0 HB2 ALA A 19 47.594 28.302 17.986 1.00 0.00 H new ATOM 0 HB3 ALA A 19 47.758 28.546 19.741 1.00 0.00 H new ATOM 165 N LYS A 20 45.572 25.721 20.680 1.00 0.00 N ATOM 166 CA LYS A 20 45.466 25.159 21.990 1.00 0.00 C ATOM 167 C LYS A 20 46.709 25.343 22.792 1.00 0.00 C ATOM 168 O LYS A 20 47.822 25.345 22.267 1.00 0.00 O ATOM 169 CB LYS A 20 45.112 23.663 21.947 1.00 0.00 C ATOM 170 CG LYS A 20 46.048 22.815 21.084 1.00 0.00 C ATOM 171 CD LYS A 20 45.821 21.304 21.166 1.00 0.00 C ATOM 172 CE LYS A 20 44.344 20.903 21.193 1.00 0.00 C ATOM 173 NZ LYS A 20 44.182 19.447 20.985 1.00 0.00 N ATOM 0 H LYS A 20 45.614 25.038 19.924 1.00 0.00 H new ATOM 0 HA LYS A 20 44.656 25.704 22.475 1.00 0.00 H new ATOM 0 HB2 LYS A 20 45.121 23.271 22.964 1.00 0.00 H new ATOM 0 HB3 LYS A 20 44.094 23.554 21.572 1.00 0.00 H new ATOM 0 HG2 LYS A 20 45.940 23.126 20.045 1.00 0.00 H new ATOM 0 HG3 LYS A 20 47.077 23.028 21.375 1.00 0.00 H new ATOM 0 HD2 LYS A 20 46.302 20.827 20.312 1.00 0.00 H new ATOM 0 HD3 LYS A 20 46.309 20.921 22.062 1.00 0.00 H new ATOM 0 HE2 LYS A 20 43.904 21.188 22.149 1.00 0.00 H new ATOM 0 HE3 LYS A 20 43.803 21.446 20.419 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 43.789 19.273 20.038 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 45.107 18.979 21.067 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 43.535 19.064 21.704 1.00 0.00 H new ATOM 187 N THR A 21 46.561 25.511 24.118 1.00 0.00 N ATOM 188 CA THR A 21 47.657 25.672 25.023 1.00 0.00 C ATOM 189 C THR A 21 47.828 24.413 25.802 1.00 0.00 C ATOM 190 O THR A 21 47.169 24.166 26.811 1.00 0.00 O ATOM 191 CB THR A 21 47.557 26.863 25.928 1.00 0.00 C ATOM 192 OG1 THR A 21 46.285 26.994 26.549 1.00 0.00 O ATOM 193 CG2 THR A 21 47.762 28.137 25.091 1.00 0.00 C ATOM 0 H THR A 21 45.650 25.536 24.575 1.00 0.00 H new ATOM 0 HA THR A 21 48.540 25.872 24.416 1.00 0.00 H new ATOM 0 HB THR A 21 48.313 26.726 26.701 1.00 0.00 H new ATOM 0 HG1 THR A 21 46.006 26.127 26.910 1.00 0.00 H new ATOM 0 HG21 THR A 21 47.692 29.012 25.737 1.00 0.00 H new ATOM 0 HG22 THR A 21 48.746 28.110 24.622 1.00 0.00 H new ATOM 0 HG23 THR A 21 46.994 28.193 24.320 1.00 0.00 H new ATOM 201 N ASP A 22 48.728 23.539 25.317 1.00 0.00 N ATOM 202 CA ASP A 22 49.053 22.261 25.872 1.00 0.00 C ATOM 203 C ASP A 22 47.878 21.366 26.062 1.00 0.00 C ATOM 204 O ASP A 22 47.524 20.963 27.170 1.00 0.00 O ATOM 205 CB ASP A 22 49.922 22.441 27.129 1.00 0.00 C ATOM 206 CG ASP A 22 50.814 21.244 27.427 1.00 0.00 C ATOM 207 OD1 ASP A 22 50.992 20.358 26.550 1.00 0.00 O ATOM 208 OD2 ASP A 22 51.399 21.214 28.543 1.00 0.00 O ATOM 0 H ASP A 22 49.267 23.741 24.475 1.00 0.00 H new ATOM 0 HA ASP A 22 49.649 21.720 25.137 1.00 0.00 H new ATOM 0 HB2 ASP A 22 50.545 23.327 27.006 1.00 0.00 H new ATOM 0 HB3 ASP A 22 49.274 22.623 27.986 1.00 0.00 H new ATOM 213 N GLY A 23 47.178 21.047 24.960 1.00 0.00 N ATOM 214 CA GLY A 23 45.989 20.253 24.982 1.00 0.00 C ATOM 215 C GLY A 23 44.717 21.000 25.195 1.00 0.00 C ATOM 216 O GLY A 23 43.672 20.625 24.666 1.00 0.00 O ATOM 0 H GLY A 23 47.447 21.351 24.024 1.00 0.00 H new ATOM 0 HA2 GLY A 23 45.918 19.712 24.038 1.00 0.00 H new ATOM 0 HA3 GLY A 23 46.087 19.507 25.770 1.00 0.00 H new ATOM 220 N SER A 24 44.742 22.075 26.003 1.00 0.00 N ATOM 221 CA SER A 24 43.573 22.730 26.502 1.00 0.00 C ATOM 222 C SER A 24 43.140 23.886 25.668 1.00 0.00 C ATOM 223 O SER A 24 43.954 24.610 25.094 1.00 0.00 O ATOM 224 CB SER A 24 43.824 23.240 27.931 1.00 0.00 C ATOM 225 OG SER A 24 42.637 23.642 28.599 1.00 0.00 O ATOM 0 H SER A 24 45.611 22.505 26.321 1.00 0.00 H new ATOM 0 HA SER A 24 42.779 21.983 26.479 1.00 0.00 H new ATOM 0 HB2 SER A 24 44.310 22.455 28.510 1.00 0.00 H new ATOM 0 HB3 SER A 24 44.515 24.082 27.893 1.00 0.00 H new ATOM 0 HG SER A 24 42.859 23.954 29.501 1.00 0.00 H new ATOM 231 N LEU A 25 41.818 24.115 25.568 1.00 0.00 N ATOM 232 CA LEU A 25 41.264 25.227 24.860 1.00 0.00 C ATOM 233 C LEU A 25 40.697 26.245 25.789 1.00 0.00 C ATOM 234 O LEU A 25 40.516 27.397 25.400 1.00 0.00 O ATOM 235 CB LEU A 25 40.200 24.807 23.832 1.00 0.00 C ATOM 236 CG LEU A 25 40.738 24.302 22.482 1.00 0.00 C ATOM 237 CD1 LEU A 25 41.603 25.351 21.762 1.00 0.00 C ATOM 238 CD2 LEU A 25 41.447 22.941 22.564 1.00 0.00 C ATOM 0 H LEU A 25 41.115 23.510 25.992 1.00 0.00 H new ATOM 0 HA LEU A 25 42.095 25.673 24.314 1.00 0.00 H new ATOM 0 HB2 LEU A 25 39.585 24.023 24.273 1.00 0.00 H new ATOM 0 HB3 LEU A 25 39.546 25.658 23.646 1.00 0.00 H new ATOM 0 HG LEU A 25 39.850 24.138 21.872 1.00 0.00 H new ATOM 0 HD11 LEU A 25 41.957 24.943 20.815 1.00 0.00 H new ATOM 0 HD12 LEU A 25 41.009 26.245 21.573 1.00 0.00 H new ATOM 0 HD13 LEU A 25 42.457 25.609 22.388 1.00 0.00 H new ATOM 0 HD21 LEU A 25 41.798 22.653 21.573 1.00 0.00 H new ATOM 0 HD22 LEU A 25 42.297 23.014 23.243 1.00 0.00 H new ATOM 0 HD23 LEU A 25 40.750 22.189 22.935 1.00 0.00 H new ATOM 250 N GLY A 26 40.403 25.922 27.061 1.00 0.00 N ATOM 251 CA GLY A 26 39.940 26.860 28.036 1.00 0.00 C ATOM 252 C GLY A 26 38.470 26.835 28.277 1.00 0.00 C ATOM 253 O GLY A 26 37.955 27.656 29.035 1.00 0.00 O ATOM 0 H GLY A 26 40.491 24.973 27.424 1.00 0.00 H new ATOM 0 HA2 GLY A 26 40.452 26.666 28.978 1.00 0.00 H new ATOM 0 HA3 GLY A 26 40.225 27.863 27.719 1.00 0.00 H new ATOM 257 N ILE A 27 37.741 25.894 27.650 1.00 0.00 N ATOM 258 CA ILE A 27 36.313 25.837 27.643 1.00 0.00 C ATOM 259 C ILE A 27 35.819 24.563 28.240 1.00 0.00 C ATOM 260 O ILE A 27 36.283 23.472 27.914 1.00 0.00 O ATOM 261 CB ILE A 27 35.756 26.015 26.262 1.00 0.00 C ATOM 262 CG1 ILE A 27 36.708 25.486 25.177 1.00 0.00 C ATOM 263 CG2 ILE A 27 35.461 27.513 26.070 1.00 0.00 C ATOM 264 CD1 ILE A 27 36.121 25.491 23.765 1.00 0.00 C ATOM 0 H ILE A 27 38.171 25.135 27.121 1.00 0.00 H new ATOM 0 HA ILE A 27 35.960 26.666 28.257 1.00 0.00 H new ATOM 0 HB ILE A 27 34.842 25.431 26.159 1.00 0.00 H new ATOM 0 HG12 ILE A 27 37.616 26.089 25.182 1.00 0.00 H new ATOM 0 HG13 ILE A 27 37.000 24.467 25.432 1.00 0.00 H new ATOM 0 HG21 ILE A 27 35.053 27.679 25.073 1.00 0.00 H new ATOM 0 HG22 ILE A 27 34.737 27.840 26.817 1.00 0.00 H new ATOM 0 HG23 ILE A 27 36.383 28.083 26.184 1.00 0.00 H new ATOM 0 HD11 ILE A 27 36.859 25.103 23.063 1.00 0.00 H new ATOM 0 HD12 ILE A 27 35.230 24.864 23.739 1.00 0.00 H new ATOM 0 HD13 ILE A 27 35.855 26.510 23.485 1.00 0.00 H new ATOM 276 N SER A 28 34.826 24.677 29.141 1.00 0.00 N ATOM 277 CA SER A 28 34.041 23.606 29.673 1.00 0.00 C ATOM 278 C SER A 28 32.646 23.798 29.184 1.00 0.00 C ATOM 279 O SER A 28 32.089 24.890 29.290 1.00 0.00 O ATOM 280 CB SER A 28 34.056 23.615 31.210 1.00 0.00 C ATOM 281 OG SER A 28 33.221 22.630 31.802 1.00 0.00 O ATOM 0 H SER A 28 34.553 25.582 29.524 1.00 0.00 H new ATOM 0 HA SER A 28 34.450 22.649 29.348 1.00 0.00 H new ATOM 0 HB2 SER A 28 35.079 23.464 31.554 1.00 0.00 H new ATOM 0 HB3 SER A 28 33.744 24.599 31.560 1.00 0.00 H new ATOM 0 HG SER A 28 33.282 22.693 32.778 1.00 0.00 H new ATOM 287 N VAL A 29 32.035 22.755 28.596 1.00 0.00 N ATOM 288 CA VAL A 29 30.799 22.838 27.881 1.00 0.00 C ATOM 289 C VAL A 29 29.661 22.167 28.569 1.00 0.00 C ATOM 290 O VAL A 29 29.825 21.360 29.483 1.00 0.00 O ATOM 291 CB VAL A 29 30.921 22.305 26.484 1.00 0.00 C ATOM 292 CG1 VAL A 29 31.808 23.263 25.672 1.00 0.00 C ATOM 293 CG2 VAL A 29 31.487 20.875 26.468 1.00 0.00 C ATOM 0 H VAL A 29 32.420 21.811 28.620 1.00 0.00 H new ATOM 0 HA VAL A 29 30.575 23.904 27.843 1.00 0.00 H new ATOM 0 HB VAL A 29 29.930 22.249 26.033 1.00 0.00 H new ATOM 0 HG11 VAL A 29 31.908 22.891 24.652 1.00 0.00 H new ATOM 0 HG12 VAL A 29 31.353 24.253 25.654 1.00 0.00 H new ATOM 0 HG13 VAL A 29 32.794 23.326 26.133 1.00 0.00 H new ATOM 0 HG21 VAL A 29 31.560 20.524 25.439 1.00 0.00 H new ATOM 0 HG22 VAL A 29 32.477 20.870 26.924 1.00 0.00 H new ATOM 0 HG23 VAL A 29 30.825 20.216 27.030 1.00 0.00 H new ATOM 303 N THR A 30 28.429 22.508 28.149 1.00 0.00 N ATOM 304 CA THR A 30 27.204 21.938 28.616 1.00 0.00 C ATOM 305 C THR A 30 26.227 21.839 27.496 1.00 0.00 C ATOM 306 O THR A 30 26.506 22.241 26.367 1.00 0.00 O ATOM 307 CB THR A 30 26.622 22.727 29.751 1.00 0.00 C ATOM 308 OG1 THR A 30 25.591 22.053 30.458 1.00 0.00 O ATOM 309 CG2 THR A 30 26.102 24.115 29.340 1.00 0.00 C ATOM 0 H THR A 30 28.281 23.226 27.440 1.00 0.00 H new ATOM 0 HA THR A 30 27.422 20.938 28.991 1.00 0.00 H new ATOM 0 HB THR A 30 27.477 22.851 30.416 1.00 0.00 H new ATOM 0 HG1 THR A 30 25.262 22.626 31.182 1.00 0.00 H new ATOM 0 HG21 THR A 30 25.696 24.625 30.214 1.00 0.00 H new ATOM 0 HG22 THR A 30 26.921 24.702 28.925 1.00 0.00 H new ATOM 0 HG23 THR A 30 25.319 24.003 28.590 1.00 0.00 H new ATOM 317 N GLY A 31 25.029 21.291 27.768 1.00 0.00 N ATOM 318 CA GLY A 31 23.915 21.271 26.873 1.00 0.00 C ATOM 319 C GLY A 31 23.775 19.997 26.114 1.00 0.00 C ATOM 320 O GLY A 31 23.975 18.895 26.622 1.00 0.00 O ATOM 0 H GLY A 31 24.828 20.838 28.660 1.00 0.00 H new ATOM 0 HA2 GLY A 31 23.002 21.447 27.441 1.00 0.00 H new ATOM 0 HA3 GLY A 31 24.014 22.095 26.166 1.00 0.00 H new ATOM 324 N GLY A 32 23.352 20.125 24.843 1.00 0.00 N ATOM 325 CA GLY A 32 23.105 19.030 23.958 1.00 0.00 C ATOM 326 C GLY A 32 21.780 18.386 24.183 1.00 0.00 C ATOM 327 O GLY A 32 21.181 18.488 25.253 1.00 0.00 O ATOM 0 H GLY A 32 23.174 21.033 24.414 1.00 0.00 H new ATOM 0 HA2 GLY A 32 23.161 19.383 22.928 1.00 0.00 H new ATOM 0 HA3 GLY A 32 23.891 18.285 24.083 1.00 0.00 H new ATOM 331 N VAL A 33 21.274 17.667 23.166 1.00 0.00 N ATOM 332 CA VAL A 33 19.953 17.120 23.131 1.00 0.00 C ATOM 333 C VAL A 33 19.633 16.098 24.166 1.00 0.00 C ATOM 334 O VAL A 33 18.467 15.800 24.421 1.00 0.00 O ATOM 335 CB VAL A 33 19.613 16.598 21.767 1.00 0.00 C ATOM 336 CG1 VAL A 33 19.683 17.743 20.743 1.00 0.00 C ATOM 337 CG2 VAL A 33 20.535 15.446 21.334 1.00 0.00 C ATOM 0 H VAL A 33 21.813 17.457 22.326 1.00 0.00 H new ATOM 0 HA VAL A 33 19.322 17.973 23.380 1.00 0.00 H new ATOM 0 HB VAL A 33 18.600 16.199 21.811 1.00 0.00 H new ATOM 0 HG11 VAL A 33 19.436 17.361 19.753 1.00 0.00 H new ATOM 0 HG12 VAL A 33 18.973 18.522 21.019 1.00 0.00 H new ATOM 0 HG13 VAL A 33 20.691 18.159 20.730 1.00 0.00 H new ATOM 0 HG21 VAL A 33 20.247 15.104 20.340 1.00 0.00 H new ATOM 0 HG22 VAL A 33 21.568 15.795 21.313 1.00 0.00 H new ATOM 0 HG23 VAL A 33 20.445 14.622 22.042 1.00 0.00 H new ATOM 347 N ASN A 34 20.637 15.526 24.854 1.00 0.00 N ATOM 348 CA ASN A 34 20.440 14.535 25.866 1.00 0.00 C ATOM 349 C ASN A 34 20.125 15.101 27.208 1.00 0.00 C ATOM 350 O ASN A 34 19.508 14.427 28.032 1.00 0.00 O ATOM 351 CB ASN A 34 21.691 13.646 25.963 1.00 0.00 C ATOM 352 CG ASN A 34 21.353 12.193 25.658 1.00 0.00 C ATOM 353 OD1 ASN A 34 21.727 11.657 24.616 1.00 0.00 O ATOM 354 ND2 ASN A 34 20.614 11.536 26.591 1.00 0.00 N ATOM 0 H ASN A 34 21.618 15.761 24.701 1.00 0.00 H new ATOM 0 HA ASN A 34 19.569 13.953 25.565 1.00 0.00 H new ATOM 0 HB2 ASN A 34 22.449 14.001 25.265 1.00 0.00 H new ATOM 0 HB3 ASN A 34 22.119 13.721 26.963 1.00 0.00 H new ATOM 0 HD21 ASN A 34 20.350 10.562 26.440 1.00 0.00 H new ATOM 0 HD22 ASN A 34 20.324 12.017 27.443 1.00 0.00 H new ATOM 361 N THR A 35 20.536 16.348 27.499 1.00 0.00 N ATOM 362 CA THR A 35 20.337 16.955 28.779 1.00 0.00 C ATOM 363 C THR A 35 19.059 17.719 28.820 1.00 0.00 C ATOM 364 O THR A 35 18.418 17.953 27.796 1.00 0.00 O ATOM 365 CB THR A 35 21.462 17.819 29.268 1.00 0.00 C ATOM 366 OG1 THR A 35 21.692 18.975 28.474 1.00 0.00 O ATOM 367 CG2 THR A 35 22.773 17.017 29.311 1.00 0.00 C ATOM 0 H THR A 35 21.018 16.948 26.830 1.00 0.00 H new ATOM 0 HA THR A 35 20.298 16.110 29.467 1.00 0.00 H new ATOM 0 HB THR A 35 21.155 18.148 30.261 1.00 0.00 H new ATOM 0 HG1 THR A 35 22.475 18.829 27.903 1.00 0.00 H new ATOM 0 HG21 THR A 35 23.580 17.657 29.668 1.00 0.00 H new ATOM 0 HG22 THR A 35 22.658 16.168 29.985 1.00 0.00 H new ATOM 0 HG23 THR A 35 23.012 16.656 28.311 1.00 0.00 H new ATOM 375 N SER A 36 18.603 18.141 30.013 1.00 0.00 N ATOM 376 CA SER A 36 17.359 18.824 30.193 1.00 0.00 C ATOM 377 C SER A 36 17.411 20.278 29.872 1.00 0.00 C ATOM 378 O SER A 36 17.197 21.148 30.715 1.00 0.00 O ATOM 379 CB SER A 36 16.778 18.603 31.600 1.00 0.00 C ATOM 380 OG SER A 36 15.366 18.756 31.596 1.00 0.00 O ATOM 0 H SER A 36 19.118 18.002 30.882 1.00 0.00 H new ATOM 0 HA SER A 36 16.688 18.372 29.463 1.00 0.00 H new ATOM 0 HB2 SER A 36 17.038 17.605 31.953 1.00 0.00 H new ATOM 0 HB3 SER A 36 17.223 19.313 32.297 1.00 0.00 H new ATOM 0 HG SER A 36 15.019 18.610 32.501 1.00 0.00 H new ATOM 386 N VAL A 37 17.738 20.601 28.608 1.00 0.00 N ATOM 387 CA VAL A 37 17.626 21.885 27.987 1.00 0.00 C ATOM 388 C VAL A 37 16.412 21.916 27.125 1.00 0.00 C ATOM 389 O VAL A 37 15.683 20.933 27.003 1.00 0.00 O ATOM 390 CB VAL A 37 18.857 22.255 27.213 1.00 0.00 C ATOM 391 CG1 VAL A 37 19.929 22.741 28.203 1.00 0.00 C ATOM 392 CG2 VAL A 37 19.387 21.059 26.404 1.00 0.00 C ATOM 0 H VAL A 37 18.113 19.902 27.966 1.00 0.00 H new ATOM 0 HA VAL A 37 17.527 22.634 28.772 1.00 0.00 H new ATOM 0 HB VAL A 37 18.610 23.046 26.505 1.00 0.00 H new ATOM 0 HG11 VAL A 37 20.832 23.014 27.657 1.00 0.00 H new ATOM 0 HG12 VAL A 37 19.556 23.610 28.746 1.00 0.00 H new ATOM 0 HG13 VAL A 37 20.160 21.944 28.909 1.00 0.00 H new ATOM 0 HG21 VAL A 37 20.279 21.358 25.854 1.00 0.00 H new ATOM 0 HG22 VAL A 37 19.636 20.243 27.082 1.00 0.00 H new ATOM 0 HG23 VAL A 37 18.622 20.727 25.702 1.00 0.00 H new ATOM 402 N ARG A 38 16.094 23.074 26.517 1.00 0.00 N ATOM 403 CA ARG A 38 14.927 23.273 25.715 1.00 0.00 C ATOM 404 C ARG A 38 14.962 22.633 24.371 1.00 0.00 C ATOM 405 O ARG A 38 14.142 21.767 24.069 1.00 0.00 O ATOM 406 CB ARG A 38 14.613 24.773 25.589 1.00 0.00 C ATOM 407 CG ARG A 38 14.546 25.497 26.936 1.00 0.00 C ATOM 408 CD ARG A 38 13.443 25.006 27.875 1.00 0.00 C ATOM 409 NE ARG A 38 13.814 25.439 29.252 1.00 0.00 N ATOM 410 CZ ARG A 38 13.050 25.158 30.346 1.00 0.00 C ATOM 411 NH1 ARG A 38 11.830 24.558 30.218 1.00 0.00 N ATOM 412 NH2 ARG A 38 13.520 25.460 31.592 1.00 0.00 N ATOM 0 H ARG A 38 16.677 23.908 26.588 1.00 0.00 H new ATOM 0 HA ARG A 38 14.126 22.761 26.249 1.00 0.00 H new ATOM 0 HB2 ARG A 38 15.375 25.245 24.969 1.00 0.00 H new ATOM 0 HB3 ARG A 38 13.661 24.895 25.072 1.00 0.00 H new ATOM 0 HG2 ARG A 38 15.507 25.388 27.439 1.00 0.00 H new ATOM 0 HG3 ARG A 38 14.401 26.562 26.753 1.00 0.00 H new ATOM 0 HD2 ARG A 38 12.478 25.423 27.587 1.00 0.00 H new ATOM 0 HD3 ARG A 38 13.349 23.921 27.825 1.00 0.00 H new ATOM 0 HE ARG A 38 14.676 25.968 29.382 1.00 0.00 H new ATOM 0 HH11 ARG A 38 11.477 24.313 29.293 1.00 0.00 H new ATOM 0 HH12 ARG A 38 11.272 24.355 31.047 1.00 0.00 H new ATOM 0 HH21 ARG A 38 14.437 25.893 31.700 1.00 0.00 H new ATOM 0 HH22 ARG A 38 12.954 25.253 32.415 1.00 0.00 H new ATOM 426 N HIS A 39 15.922 23.021 23.513 1.00 0.00 N ATOM 427 CA HIS A 39 16.062 22.492 22.191 1.00 0.00 C ATOM 428 C HIS A 39 17.489 22.153 21.929 1.00 0.00 C ATOM 429 O HIS A 39 18.098 22.599 20.959 1.00 0.00 O ATOM 430 CB HIS A 39 15.553 23.461 21.111 1.00 0.00 C ATOM 431 CG HIS A 39 15.931 24.904 21.274 1.00 0.00 C ATOM 432 ND1 HIS A 39 17.224 25.375 21.170 1.00 0.00 N ATOM 433 CD2 HIS A 39 15.155 26.004 21.460 1.00 0.00 C ATOM 434 CE1 HIS A 39 17.167 26.729 21.292 1.00 0.00 C ATOM 435 NE2 HIS A 39 15.928 27.148 21.463 1.00 0.00 N ATOM 0 H HIS A 39 16.623 23.725 23.746 1.00 0.00 H new ATOM 0 HA HIS A 39 15.447 21.594 22.138 1.00 0.00 H new ATOM 0 HB2 HIS A 39 15.922 23.119 20.144 1.00 0.00 H new ATOM 0 HB3 HIS A 39 14.465 23.395 21.078 1.00 0.00 H new ATOM 0 HD1 HIS A 39 18.064 24.814 21.028 1.00 0.00 H new ATOM 0 HD2 HIS A 39 14.083 25.986 21.588 1.00 0.00 H new ATOM 0 HE1 HIS A 39 18.028 27.379 21.254 1.00 0.00 H new ATOM 443 N GLY A 40 18.097 21.336 22.808 1.00 0.00 N ATOM 444 CA GLY A 40 19.487 21.006 22.738 1.00 0.00 C ATOM 445 C GLY A 40 20.391 22.182 22.873 1.00 0.00 C ATOM 446 O GLY A 40 20.343 22.916 23.859 1.00 0.00 O ATOM 0 H GLY A 40 17.610 20.894 23.587 1.00 0.00 H new ATOM 0 HA2 GLY A 40 19.720 20.288 23.524 1.00 0.00 H new ATOM 0 HA3 GLY A 40 19.687 20.513 21.786 1.00 0.00 H new ATOM 450 N GLY A 41 21.233 22.410 21.850 1.00 0.00 N ATOM 451 CA GLY A 41 22.241 23.424 21.842 1.00 0.00 C ATOM 452 C GLY A 41 23.419 23.151 22.713 1.00 0.00 C ATOM 453 O GLY A 41 23.292 22.721 23.858 1.00 0.00 O ATOM 0 H GLY A 41 21.210 21.863 20.990 1.00 0.00 H new ATOM 0 HA2 GLY A 41 22.589 23.560 20.818 1.00 0.00 H new ATOM 0 HA3 GLY A 41 21.789 24.366 22.153 1.00 0.00 H new ATOM 457 N ILE A 42 24.643 23.416 22.226 1.00 0.00 N ATOM 458 CA ILE A 42 25.833 23.304 23.011 1.00 0.00 C ATOM 459 C ILE A 42 26.139 24.653 23.566 1.00 0.00 C ATOM 460 O ILE A 42 26.136 25.644 22.837 1.00 0.00 O ATOM 461 CB ILE A 42 26.985 22.747 22.228 1.00 0.00 C ATOM 462 CG1 ILE A 42 26.634 21.405 21.564 1.00 0.00 C ATOM 463 CG2 ILE A 42 28.241 22.594 23.103 1.00 0.00 C ATOM 464 CD1 ILE A 42 26.295 20.268 22.527 1.00 0.00 C ATOM 0 H ILE A 42 24.810 23.715 21.265 1.00 0.00 H new ATOM 0 HA ILE A 42 25.669 22.594 23.821 1.00 0.00 H new ATOM 0 HB ILE A 42 27.200 23.467 21.438 1.00 0.00 H new ATOM 0 HG12 ILE A 42 25.786 21.559 20.897 1.00 0.00 H new ATOM 0 HG13 ILE A 42 27.475 21.095 20.943 1.00 0.00 H new ATOM 0 HG21 ILE A 42 29.055 22.188 22.503 1.00 0.00 H new ATOM 0 HG22 ILE A 42 28.531 23.568 23.497 1.00 0.00 H new ATOM 0 HG23 ILE A 42 28.028 21.917 23.930 1.00 0.00 H new ATOM 0 HD11 ILE A 42 26.063 19.367 21.959 1.00 0.00 H new ATOM 0 HD12 ILE A 42 27.148 20.076 23.178 1.00 0.00 H new ATOM 0 HD13 ILE A 42 25.432 20.548 23.132 1.00 0.00 H new ATOM 476 N TYR A 43 26.371 24.781 24.885 1.00 0.00 N ATOM 477 CA TYR A 43 26.592 26.055 25.496 1.00 0.00 C ATOM 478 C TYR A 43 27.857 26.008 26.281 1.00 0.00 C ATOM 479 O TYR A 43 28.311 24.949 26.712 1.00 0.00 O ATOM 480 CB TYR A 43 25.471 26.458 26.468 1.00 0.00 C ATOM 481 CG TYR A 43 24.155 26.638 25.793 1.00 0.00 C ATOM 482 CD1 TYR A 43 23.801 27.863 25.277 1.00 0.00 C ATOM 483 CD2 TYR A 43 23.251 25.602 25.742 1.00 0.00 C ATOM 484 CE1 TYR A 43 22.551 28.061 24.739 1.00 0.00 C ATOM 485 CE2 TYR A 43 22.000 25.793 25.205 1.00 0.00 C ATOM 486 CZ TYR A 43 21.644 27.028 24.719 1.00 0.00 C ATOM 487 OH TYR A 43 20.336 27.200 24.216 1.00 0.00 O ATOM 0 H TYR A 43 26.406 23.994 25.533 1.00 0.00 H new ATOM 0 HA TYR A 43 26.630 26.785 24.687 1.00 0.00 H new ATOM 0 HB2 TYR A 43 25.376 25.695 27.241 1.00 0.00 H new ATOM 0 HB3 TYR A 43 25.747 27.386 26.968 1.00 0.00 H new ATOM 0 HD1 TYR A 43 24.511 28.677 25.295 1.00 0.00 H new ATOM 0 HD2 TYR A 43 23.526 24.631 26.127 1.00 0.00 H new ATOM 0 HE1 TYR A 43 22.283 29.025 24.333 1.00 0.00 H new ATOM 0 HE2 TYR A 43 21.298 24.973 25.165 1.00 0.00 H new ATOM 0 HH TYR A 43 19.845 26.355 24.286 1.00 0.00 H new ATOM 497 N VAL A 44 28.470 27.180 26.527 1.00 0.00 N ATOM 498 CA VAL A 44 29.584 27.324 27.412 1.00 0.00 C ATOM 499 C VAL A 44 29.145 27.289 28.836 1.00 0.00 C ATOM 500 O VAL A 44 28.213 27.983 29.237 1.00 0.00 O ATOM 501 CB VAL A 44 30.376 28.567 27.136 1.00 0.00 C ATOM 502 CG1 VAL A 44 31.673 28.594 27.961 1.00 0.00 C ATOM 503 CG2 VAL A 44 30.728 28.616 25.640 1.00 0.00 C ATOM 0 H VAL A 44 28.180 28.057 26.095 1.00 0.00 H new ATOM 0 HA VAL A 44 30.242 26.474 27.228 1.00 0.00 H new ATOM 0 HB VAL A 44 29.773 29.431 27.415 1.00 0.00 H new ATOM 0 HG11 VAL A 44 32.226 29.507 27.740 1.00 0.00 H new ATOM 0 HG12 VAL A 44 31.429 28.566 29.023 1.00 0.00 H new ATOM 0 HG13 VAL A 44 32.285 27.728 27.706 1.00 0.00 H new ATOM 0 HG21 VAL A 44 31.304 29.517 25.431 1.00 0.00 H new ATOM 0 HG22 VAL A 44 31.319 27.739 25.376 1.00 0.00 H new ATOM 0 HG23 VAL A 44 29.811 28.627 25.051 1.00 0.00 H new ATOM 513 N LYS A 45 29.791 26.466 29.681 1.00 0.00 N ATOM 514 CA LYS A 45 29.504 26.373 31.080 1.00 0.00 C ATOM 515 C LYS A 45 30.479 27.157 31.888 1.00 0.00 C ATOM 516 O LYS A 45 30.102 28.067 32.626 1.00 0.00 O ATOM 517 CB LYS A 45 29.499 24.903 31.532 1.00 0.00 C ATOM 518 CG LYS A 45 29.330 24.693 33.037 1.00 0.00 C ATOM 519 CD LYS A 45 29.011 23.240 33.400 1.00 0.00 C ATOM 520 CE LYS A 45 27.510 22.959 33.481 1.00 0.00 C ATOM 521 NZ LYS A 45 27.283 21.501 33.581 1.00 0.00 N ATOM 0 H LYS A 45 30.540 25.843 29.380 1.00 0.00 H new ATOM 0 HA LYS A 45 28.513 26.797 31.244 1.00 0.00 H new ATOM 0 HB2 LYS A 45 28.694 24.382 31.014 1.00 0.00 H new ATOM 0 HB3 LYS A 45 30.433 24.438 31.218 1.00 0.00 H new ATOM 0 HG2 LYS A 45 30.244 24.998 33.547 1.00 0.00 H new ATOM 0 HG3 LYS A 45 28.531 25.338 33.402 1.00 0.00 H new ATOM 0 HD2 LYS A 45 29.459 22.579 32.658 1.00 0.00 H new ATOM 0 HD3 LYS A 45 29.472 23.001 34.359 1.00 0.00 H new ATOM 0 HE2 LYS A 45 27.081 23.464 34.347 1.00 0.00 H new ATOM 0 HE3 LYS A 45 27.007 23.356 32.599 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 26.262 21.312 33.636 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 27.678 21.030 32.742 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 27.749 21.135 34.435 1.00 0.00 H new ATOM 535 N ALA A 46 31.780 26.825 31.797 1.00 0.00 N ATOM 536 CA ALA A 46 32.783 27.442 32.608 1.00 0.00 C ATOM 537 C ALA A 46 34.004 27.711 31.798 1.00 0.00 C ATOM 538 O ALA A 46 34.270 27.043 30.801 1.00 0.00 O ATOM 539 CB ALA A 46 33.129 26.566 33.824 1.00 0.00 C ATOM 0 H ALA A 46 32.140 26.120 31.153 1.00 0.00 H new ATOM 0 HA ALA A 46 32.387 28.388 32.977 1.00 0.00 H new ATOM 0 HB1 ALA A 46 33.894 27.060 34.423 1.00 0.00 H new ATOM 0 HB2 ALA A 46 32.236 26.415 34.430 1.00 0.00 H new ATOM 0 HB3 ALA A 46 33.503 25.601 33.482 1.00 0.00 H new ATOM 545 N ILE A 47 34.786 28.725 32.210 1.00 0.00 N ATOM 546 CA ILE A 47 36.009 29.093 31.567 1.00 0.00 C ATOM 547 C ILE A 47 37.151 28.704 32.442 1.00 0.00 C ATOM 548 O ILE A 47 37.208 29.019 33.630 1.00 0.00 O ATOM 549 CB ILE A 47 35.951 30.510 31.080 1.00 0.00 C ATOM 550 CG1 ILE A 47 36.404 30.614 29.613 1.00 0.00 C ATOM 551 CG2 ILE A 47 36.700 31.527 31.957 1.00 0.00 C ATOM 552 CD1 ILE A 47 35.396 30.057 28.609 1.00 0.00 C ATOM 0 H ILE A 47 34.560 29.307 33.016 1.00 0.00 H new ATOM 0 HA ILE A 47 36.175 28.539 30.643 1.00 0.00 H new ATOM 0 HB ILE A 47 34.899 30.787 31.155 1.00 0.00 H new ATOM 0 HG12 ILE A 47 36.596 31.661 29.376 1.00 0.00 H new ATOM 0 HG13 ILE A 47 37.348 30.082 29.497 1.00 0.00 H new ATOM 0 HG21 ILE A 47 36.601 32.523 31.525 1.00 0.00 H new ATOM 0 HG22 ILE A 47 36.276 31.524 32.961 1.00 0.00 H new ATOM 0 HG23 ILE A 47 37.755 31.257 32.008 1.00 0.00 H new ATOM 0 HD11 ILE A 47 35.790 30.168 27.599 1.00 0.00 H new ATOM 0 HD12 ILE A 47 35.221 29.001 28.817 1.00 0.00 H new ATOM 0 HD13 ILE A 47 34.457 30.604 28.694 1.00 0.00 H new ATOM 564 N ILE A 48 38.071 27.877 31.913 1.00 0.00 N ATOM 565 CA ILE A 48 39.163 27.275 32.612 1.00 0.00 C ATOM 566 C ILE A 48 40.277 28.230 32.864 1.00 0.00 C ATOM 567 O ILE A 48 40.838 28.686 31.869 1.00 0.00 O ATOM 568 CB ILE A 48 39.698 26.070 31.896 1.00 0.00 C ATOM 569 CG1 ILE A 48 38.578 25.110 31.463 1.00 0.00 C ATOM 570 CG2 ILE A 48 40.761 25.338 32.733 1.00 0.00 C ATOM 571 CD1 ILE A 48 37.737 24.533 32.601 1.00 0.00 C ATOM 0 H ILE A 48 38.049 27.612 30.928 1.00 0.00 H new ATOM 0 HA ILE A 48 38.752 26.962 33.572 1.00 0.00 H new ATOM 0 HB ILE A 48 40.181 26.434 30.989 1.00 0.00 H new ATOM 0 HG12 ILE A 48 37.916 25.636 30.775 1.00 0.00 H new ATOM 0 HG13 ILE A 48 39.024 24.285 30.908 1.00 0.00 H new ATOM 0 HG21 ILE A 48 41.125 24.471 32.181 1.00 0.00 H new ATOM 0 HG22 ILE A 48 41.592 26.013 32.937 1.00 0.00 H new ATOM 0 HG23 ILE A 48 40.320 25.010 33.675 1.00 0.00 H new ATOM 0 HD11 ILE A 48 36.976 23.869 32.191 1.00 0.00 H new ATOM 0 HD12 ILE A 48 38.379 23.972 33.280 1.00 0.00 H new ATOM 0 HD13 ILE A 48 37.255 25.345 33.145 1.00 0.00 H new ATOM 583 N PRO A 49 40.699 28.588 34.041 1.00 0.00 N ATOM 584 CA PRO A 49 41.655 29.634 34.256 1.00 0.00 C ATOM 585 C PRO A 49 43.006 29.349 33.696 1.00 0.00 C ATOM 586 O PRO A 49 43.597 28.313 33.993 1.00 0.00 O ATOM 587 CB PRO A 49 41.691 29.830 35.769 1.00 0.00 C ATOM 588 CG PRO A 49 41.236 28.481 36.348 1.00 0.00 C ATOM 589 CD PRO A 49 40.220 28.018 35.292 1.00 0.00 C ATOM 0 HA PRO A 49 41.355 30.538 33.725 1.00 0.00 H new ATOM 0 HB2 PRO A 49 42.693 30.090 36.111 1.00 0.00 H new ATOM 0 HB3 PRO A 49 41.028 30.638 36.080 1.00 0.00 H new ATOM 0 HG2 PRO A 49 42.064 27.781 36.454 1.00 0.00 H new ATOM 0 HG3 PRO A 49 40.782 28.590 37.333 1.00 0.00 H new ATOM 0 HD2 PRO A 49 40.173 26.930 35.239 1.00 0.00 H new ATOM 0 HD3 PRO A 49 39.216 28.370 35.528 1.00 0.00 H new ATOM 597 N LYS A 50 43.506 30.256 32.839 1.00 0.00 N ATOM 598 CA LYS A 50 44.679 30.158 32.027 1.00 0.00 C ATOM 599 C LYS A 50 44.523 29.176 30.917 1.00 0.00 C ATOM 600 O LYS A 50 45.460 28.462 30.566 1.00 0.00 O ATOM 601 CB LYS A 50 46.002 29.994 32.795 1.00 0.00 C ATOM 602 CG LYS A 50 46.286 31.125 33.786 1.00 0.00 C ATOM 603 CD LYS A 50 47.600 30.912 34.540 1.00 0.00 C ATOM 604 CE LYS A 50 47.819 31.891 35.695 1.00 0.00 C ATOM 605 NZ LYS A 50 49.041 31.548 36.455 1.00 0.00 N ATOM 0 H LYS A 50 43.037 31.151 32.702 1.00 0.00 H new ATOM 0 HA LYS A 50 44.771 31.144 31.571 1.00 0.00 H new ATOM 0 HB2 LYS A 50 45.983 29.047 33.335 1.00 0.00 H new ATOM 0 HB3 LYS A 50 46.822 29.936 32.079 1.00 0.00 H new ATOM 0 HG2 LYS A 50 46.325 32.074 33.251 1.00 0.00 H new ATOM 0 HG3 LYS A 50 45.466 31.195 34.500 1.00 0.00 H new ATOM 0 HD2 LYS A 50 47.623 29.894 34.930 1.00 0.00 H new ATOM 0 HD3 LYS A 50 48.429 31.003 33.838 1.00 0.00 H new ATOM 0 HE2 LYS A 50 47.901 32.906 35.306 1.00 0.00 H new ATOM 0 HE3 LYS A 50 46.956 31.874 36.360 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 49.168 32.226 37.233 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 48.950 30.588 36.844 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 49.866 31.588 35.823 1.00 0.00 H new ATOM 619 N GLY A 51 43.326 29.098 30.308 1.00 0.00 N ATOM 620 CA GLY A 51 43.105 28.471 29.042 1.00 0.00 C ATOM 621 C GLY A 51 43.339 29.385 27.889 1.00 0.00 C ATOM 622 O GLY A 51 43.329 30.608 28.029 1.00 0.00 O ATOM 0 H GLY A 51 42.476 29.489 30.715 1.00 0.00 H new ATOM 0 HA2 GLY A 51 43.762 27.606 28.952 1.00 0.00 H new ATOM 0 HA3 GLY A 51 42.081 28.099 29.001 1.00 0.00 H new ATOM 626 N ALA A 52 43.469 28.810 26.680 1.00 0.00 N ATOM 627 CA ALA A 52 43.504 29.503 25.430 1.00 0.00 C ATOM 628 C ALA A 52 42.414 30.504 25.242 1.00 0.00 C ATOM 629 O ALA A 52 42.660 31.703 25.120 1.00 0.00 O ATOM 630 CB ALA A 52 43.547 28.495 24.270 1.00 0.00 C ATOM 0 H ALA A 52 43.555 27.800 26.570 1.00 0.00 H new ATOM 0 HA ALA A 52 44.420 30.094 25.438 1.00 0.00 H new ATOM 0 HB1 ALA A 52 43.573 29.032 23.322 1.00 0.00 H new ATOM 0 HB2 ALA A 52 44.438 27.874 24.360 1.00 0.00 H new ATOM 0 HB3 ALA A 52 42.660 27.863 24.304 1.00 0.00 H new ATOM 636 N ALA A 53 41.158 30.024 25.223 1.00 0.00 N ATOM 637 CA ALA A 53 39.942 30.763 25.088 1.00 0.00 C ATOM 638 C ALA A 53 39.683 31.703 26.215 1.00 0.00 C ATOM 639 O ALA A 53 39.375 32.876 26.013 1.00 0.00 O ATOM 640 CB ALA A 53 38.727 29.823 25.002 1.00 0.00 C ATOM 0 H ALA A 53 40.980 29.024 25.311 1.00 0.00 H new ATOM 0 HA ALA A 53 40.072 31.337 24.171 1.00 0.00 H new ATOM 0 HB1 ALA A 53 37.817 30.414 24.900 1.00 0.00 H new ATOM 0 HB2 ALA A 53 38.834 29.168 24.137 1.00 0.00 H new ATOM 0 HB3 ALA A 53 38.669 29.220 25.908 1.00 0.00 H new ATOM 646 N GLU A 54 39.823 31.174 27.443 1.00 0.00 N ATOM 647 CA GLU A 54 39.589 31.844 28.684 1.00 0.00 C ATOM 648 C GLU A 54 40.124 33.230 28.788 1.00 0.00 C ATOM 649 O GLU A 54 39.414 34.189 29.089 1.00 0.00 O ATOM 650 CB GLU A 54 40.233 31.029 29.817 1.00 0.00 C ATOM 651 CG GLU A 54 40.033 31.650 31.202 1.00 0.00 C ATOM 652 CD GLU A 54 41.155 32.513 31.762 1.00 0.00 C ATOM 653 OE1 GLU A 54 42.352 32.276 31.445 1.00 0.00 O ATOM 654 OE2 GLU A 54 40.837 33.419 32.577 1.00 0.00 O ATOM 0 H GLU A 54 40.121 30.208 27.577 1.00 0.00 H new ATOM 0 HA GLU A 54 38.504 31.923 28.754 1.00 0.00 H new ATOM 0 HB2 GLU A 54 39.814 30.023 29.814 1.00 0.00 H new ATOM 0 HB3 GLU A 54 41.301 30.930 29.622 1.00 0.00 H new ATOM 0 HG2 GLU A 54 39.128 32.257 31.169 1.00 0.00 H new ATOM 0 HG3 GLU A 54 39.849 30.841 31.908 1.00 0.00 H new ATOM 661 N SER A 55 41.440 33.340 28.532 1.00 0.00 N ATOM 662 CA SER A 55 42.198 34.544 28.683 1.00 0.00 C ATOM 663 C SER A 55 41.830 35.611 27.712 1.00 0.00 C ATOM 664 O SER A 55 41.958 36.802 27.994 1.00 0.00 O ATOM 665 CB SER A 55 43.689 34.194 28.537 1.00 0.00 C ATOM 666 OG SER A 55 44.547 35.265 28.900 1.00 0.00 O ATOM 0 H SER A 55 42.001 32.554 28.205 1.00 0.00 H new ATOM 0 HA SER A 55 41.976 34.952 29.669 1.00 0.00 H new ATOM 0 HB2 SER A 55 43.916 33.327 29.158 1.00 0.00 H new ATOM 0 HB3 SER A 55 43.890 33.908 27.505 1.00 0.00 H new ATOM 0 HG SER A 55 45.481 34.988 28.790 1.00 0.00 H new ATOM 672 N ASP A 56 41.334 35.229 26.522 1.00 0.00 N ATOM 673 CA ASP A 56 40.957 36.128 25.475 1.00 0.00 C ATOM 674 C ASP A 56 39.686 36.838 25.794 1.00 0.00 C ATOM 675 O ASP A 56 39.659 38.053 25.981 1.00 0.00 O ATOM 676 CB ASP A 56 40.875 35.348 24.152 1.00 0.00 C ATOM 677 CG ASP A 56 40.750 36.316 22.984 1.00 0.00 C ATOM 678 OD1 ASP A 56 41.809 36.798 22.499 1.00 0.00 O ATOM 679 OD2 ASP A 56 39.600 36.632 22.576 1.00 0.00 O ATOM 0 H ASP A 56 41.189 34.249 26.278 1.00 0.00 H new ATOM 0 HA ASP A 56 41.715 36.905 25.374 1.00 0.00 H new ATOM 0 HB2 ASP A 56 41.764 34.730 24.029 1.00 0.00 H new ATOM 0 HB3 ASP A 56 40.018 34.674 24.170 1.00 0.00 H new ATOM 684 N GLY A 57 38.561 36.105 25.880 1.00 0.00 N ATOM 685 CA GLY A 57 37.344 36.636 26.410 1.00 0.00 C ATOM 686 C GLY A 57 36.285 36.987 25.422 1.00 0.00 C ATOM 687 O GLY A 57 35.264 37.561 25.800 1.00 0.00 O ATOM 0 H GLY A 57 38.495 35.133 25.578 1.00 0.00 H new ATOM 0 HA2 GLY A 57 36.931 35.909 27.109 1.00 0.00 H new ATOM 0 HA3 GLY A 57 37.584 37.530 26.985 1.00 0.00 H new ATOM 691 N ARG A 58 36.436 36.603 24.142 1.00 0.00 N ATOM 692 CA ARG A 58 35.352 36.555 23.210 1.00 0.00 C ATOM 693 C ARG A 58 34.339 35.542 23.620 1.00 0.00 C ATOM 694 O ARG A 58 33.132 35.726 23.468 1.00 0.00 O ATOM 695 CB ARG A 58 35.837 36.185 21.797 1.00 0.00 C ATOM 696 CG ARG A 58 36.603 37.291 21.070 1.00 0.00 C ATOM 697 CD ARG A 58 37.251 36.779 19.782 1.00 0.00 C ATOM 698 NE ARG A 58 38.002 37.879 19.115 1.00 0.00 N ATOM 699 CZ ARG A 58 39.365 37.931 19.110 1.00 0.00 C ATOM 700 NH1 ARG A 58 40.120 37.207 19.989 1.00 0.00 N ATOM 701 NH2 ARG A 58 40.016 38.707 18.195 1.00 0.00 N ATOM 0 H ARG A 58 37.332 36.319 23.745 1.00 0.00 H new ATOM 0 HA ARG A 58 34.910 37.551 23.200 1.00 0.00 H new ATOM 0 HB2 ARG A 58 36.477 35.305 21.867 1.00 0.00 H new ATOM 0 HB3 ARG A 58 34.974 35.904 21.194 1.00 0.00 H new ATOM 0 HG2 ARG A 58 35.923 38.110 20.835 1.00 0.00 H new ATOM 0 HG3 ARG A 58 37.372 37.694 21.729 1.00 0.00 H new ATOM 0 HD2 ARG A 58 37.925 35.953 20.008 1.00 0.00 H new ATOM 0 HD3 ARG A 58 36.486 36.391 19.110 1.00 0.00 H new ATOM 0 HE ARG A 58 37.479 38.619 18.646 1.00 0.00 H new ATOM 0 HH11 ARG A 58 39.666 36.605 20.676 1.00 0.00 H new ATOM 0 HH12 ARG A 58 41.138 37.269 19.958 1.00 0.00 H new ATOM 0 HH21 ARG A 58 39.483 39.249 17.514 1.00 0.00 H new ATOM 0 HH22 ARG A 58 41.035 38.745 18.192 1.00 0.00 H new ATOM 715 N ILE A 59 34.817 34.422 24.190 1.00 0.00 N ATOM 716 CA ILE A 59 34.021 33.351 24.704 1.00 0.00 C ATOM 717 C ILE A 59 33.820 33.560 26.165 1.00 0.00 C ATOM 718 O ILE A 59 34.771 33.814 26.903 1.00 0.00 O ATOM 719 CB ILE A 59 34.672 32.023 24.454 1.00 0.00 C ATOM 720 CG1 ILE A 59 35.179 31.964 23.003 1.00 0.00 C ATOM 721 CG2 ILE A 59 33.660 30.909 24.773 1.00 0.00 C ATOM 722 CD1 ILE A 59 35.650 30.592 22.525 1.00 0.00 C ATOM 0 H ILE A 59 35.817 34.255 24.298 1.00 0.00 H new ATOM 0 HA ILE A 59 33.058 33.347 24.192 1.00 0.00 H new ATOM 0 HB ILE A 59 35.538 31.883 25.101 1.00 0.00 H new ATOM 0 HG12 ILE A 59 34.381 32.304 22.344 1.00 0.00 H new ATOM 0 HG13 ILE A 59 36.003 32.669 22.896 1.00 0.00 H new ATOM 0 HG21 ILE A 59 34.121 29.937 24.595 1.00 0.00 H new ATOM 0 HG22 ILE A 59 33.357 30.981 25.817 1.00 0.00 H new ATOM 0 HG23 ILE A 59 32.785 31.018 24.133 1.00 0.00 H new ATOM 0 HD11 ILE A 59 35.986 30.663 21.491 1.00 0.00 H new ATOM 0 HD12 ILE A 59 36.474 30.252 23.152 1.00 0.00 H new ATOM 0 HD13 ILE A 59 34.826 29.881 22.591 1.00 0.00 H new ATOM 734 N HIS A 60 32.564 33.497 26.643 1.00 0.00 N ATOM 735 CA HIS A 60 32.207 33.608 28.023 1.00 0.00 C ATOM 736 C HIS A 60 31.213 32.563 28.395 1.00 0.00 C ATOM 737 O HIS A 60 30.621 31.860 27.578 1.00 0.00 O ATOM 738 CB HIS A 60 31.599 34.983 28.348 1.00 0.00 C ATOM 739 CG HIS A 60 32.588 35.985 28.865 1.00 0.00 C ATOM 740 ND1 HIS A 60 33.843 36.194 28.330 1.00 0.00 N ATOM 741 CD2 HIS A 60 32.474 36.867 29.894 1.00 0.00 C ATOM 742 CE1 HIS A 60 34.423 37.187 29.056 1.00 0.00 C ATOM 743 NE2 HIS A 60 33.629 37.613 30.020 1.00 0.00 N ATOM 0 H HIS A 60 31.756 33.362 26.035 1.00 0.00 H new ATOM 0 HA HIS A 60 33.127 33.478 28.593 1.00 0.00 H new ATOM 0 HB2 HIS A 60 31.130 35.382 27.449 1.00 0.00 H new ATOM 0 HB3 HIS A 60 30.809 34.853 29.088 1.00 0.00 H new ATOM 0 HD1 HIS A 60 34.257 35.698 27.540 1.00 0.00 H new ATOM 0 HD2 HIS A 60 31.603 36.969 30.524 1.00 0.00 H new ATOM 0 HE1 HIS A 60 35.412 37.579 28.867 1.00 0.00 H new ATOM 751 N LYS A 61 30.965 32.443 29.711 1.00 0.00 N ATOM 752 CA LYS A 61 30.022 31.545 30.302 1.00 0.00 C ATOM 753 C LYS A 61 28.629 31.822 29.851 1.00 0.00 C ATOM 754 O LYS A 61 28.124 32.937 29.972 1.00 0.00 O ATOM 755 CB LYS A 61 30.115 31.674 31.832 1.00 0.00 C ATOM 756 CG LYS A 61 31.492 31.334 32.405 1.00 0.00 C ATOM 757 CD LYS A 61 31.752 31.923 33.793 1.00 0.00 C ATOM 758 CE LYS A 61 30.839 31.420 34.915 1.00 0.00 C ATOM 759 NZ LYS A 61 31.265 32.010 36.203 1.00 0.00 N ATOM 0 H LYS A 61 31.454 33.008 30.405 1.00 0.00 H new ATOM 0 HA LYS A 61 30.265 30.530 29.987 1.00 0.00 H new ATOM 0 HB2 LYS A 61 29.857 32.694 32.116 1.00 0.00 H new ATOM 0 HB3 LYS A 61 29.372 31.019 32.287 1.00 0.00 H new ATOM 0 HG2 LYS A 61 31.595 30.250 32.457 1.00 0.00 H new ATOM 0 HG3 LYS A 61 32.259 31.695 31.719 1.00 0.00 H new ATOM 0 HD2 LYS A 61 32.785 31.711 34.069 1.00 0.00 H new ATOM 0 HD3 LYS A 61 31.655 33.007 33.730 1.00 0.00 H new ATOM 0 HE2 LYS A 61 29.804 31.690 34.704 1.00 0.00 H new ATOM 0 HE3 LYS A 61 30.880 30.332 34.971 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 30.644 31.668 36.964 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 32.246 31.731 36.405 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 31.204 33.047 36.147 1.00 0.00 H new ATOM 773 N GLY A 62 27.935 30.821 29.281 1.00 0.00 N ATOM 774 CA GLY A 62 26.598 30.956 28.792 1.00 0.00 C ATOM 775 C GLY A 62 26.480 31.245 27.335 1.00 0.00 C ATOM 776 O GLY A 62 25.366 31.367 26.830 1.00 0.00 O ATOM 0 H GLY A 62 28.318 29.884 29.156 1.00 0.00 H new ATOM 0 HA2 GLY A 62 26.055 30.036 29.009 1.00 0.00 H new ATOM 0 HA3 GLY A 62 26.105 31.755 29.345 1.00 0.00 H new ATOM 780 N ASP A 63 27.598 31.351 26.595 1.00 0.00 N ATOM 781 CA ASP A 63 27.555 31.587 25.185 1.00 0.00 C ATOM 782 C ASP A 63 27.138 30.378 24.421 1.00 0.00 C ATOM 783 O ASP A 63 27.250 29.242 24.880 1.00 0.00 O ATOM 784 CB ASP A 63 28.917 32.062 24.652 1.00 0.00 C ATOM 785 CG ASP A 63 29.274 33.486 25.049 1.00 0.00 C ATOM 786 OD1 ASP A 63 28.389 34.303 25.419 1.00 0.00 O ATOM 787 OD2 ASP A 63 30.484 33.823 24.950 1.00 0.00 O ATOM 0 H ASP A 63 28.540 31.272 26.978 1.00 0.00 H new ATOM 0 HA ASP A 63 26.810 32.369 25.037 1.00 0.00 H new ATOM 0 HB2 ASP A 63 29.693 31.389 25.016 1.00 0.00 H new ATOM 0 HB3 ASP A 63 28.916 31.988 23.564 1.00 0.00 H new ATOM 792 N ARG A 64 26.613 30.586 23.200 1.00 0.00 N ATOM 793 CA ARG A 64 26.189 29.560 22.298 1.00 0.00 C ATOM 794 C ARG A 64 27.315 29.105 21.436 1.00 0.00 C ATOM 795 O ARG A 64 27.962 29.894 20.749 1.00 0.00 O ATOM 796 CB ARG A 64 25.067 30.110 21.400 1.00 0.00 C ATOM 797 CG ARG A 64 24.605 29.172 20.283 1.00 0.00 C ATOM 798 CD ARG A 64 23.455 29.735 19.445 1.00 0.00 C ATOM 799 NE ARG A 64 22.926 28.585 18.658 1.00 0.00 N ATOM 800 CZ ARG A 64 21.592 28.363 18.476 1.00 0.00 C ATOM 801 NH1 ARG A 64 20.658 29.331 18.709 1.00 0.00 N ATOM 802 NH2 ARG A 64 21.188 27.125 18.070 1.00 0.00 N ATOM 0 H ARG A 64 26.477 31.523 22.821 1.00 0.00 H new ATOM 0 HA ARG A 64 25.833 28.713 22.884 1.00 0.00 H new ATOM 0 HB2 ARG A 64 24.209 30.353 22.026 1.00 0.00 H new ATOM 0 HB3 ARG A 64 25.408 31.043 20.951 1.00 0.00 H new ATOM 0 HG2 ARG A 64 25.449 28.958 19.628 1.00 0.00 H new ATOM 0 HG3 ARG A 64 24.293 28.224 20.722 1.00 0.00 H new ATOM 0 HD2 ARG A 64 22.680 30.163 20.081 1.00 0.00 H new ATOM 0 HD3 ARG A 64 23.803 30.532 18.788 1.00 0.00 H new ATOM 0 HE ARG A 64 23.590 27.935 18.237 1.00 0.00 H new ATOM 0 HH11 ARG A 64 20.950 30.254 19.029 1.00 0.00 H new ATOM 0 HH12 ARG A 64 19.669 29.131 18.563 1.00 0.00 H new ATOM 0 HH21 ARG A 64 21.878 26.391 17.910 1.00 0.00 H new ATOM 0 HH22 ARG A 64 20.196 26.934 17.927 1.00 0.00 H new ATOM 816 N VAL A 65 27.584 27.787 21.422 1.00 0.00 N ATOM 817 CA VAL A 65 28.611 27.184 20.630 1.00 0.00 C ATOM 818 C VAL A 65 28.036 26.767 19.320 1.00 0.00 C ATOM 819 O VAL A 65 27.008 26.092 19.280 1.00 0.00 O ATOM 820 CB VAL A 65 29.172 25.992 21.347 1.00 0.00 C ATOM 821 CG1 VAL A 65 30.323 25.349 20.554 1.00 0.00 C ATOM 822 CG2 VAL A 65 29.677 26.415 22.737 1.00 0.00 C ATOM 0 H VAL A 65 27.065 27.114 21.986 1.00 0.00 H new ATOM 0 HA VAL A 65 29.414 27.902 20.462 1.00 0.00 H new ATOM 0 HB VAL A 65 28.376 25.254 21.449 1.00 0.00 H new ATOM 0 HG11 VAL A 65 30.706 24.488 21.102 1.00 0.00 H new ATOM 0 HG12 VAL A 65 29.957 25.025 19.580 1.00 0.00 H new ATOM 0 HG13 VAL A 65 31.122 26.077 20.418 1.00 0.00 H new ATOM 0 HG21 VAL A 65 30.084 25.547 23.256 1.00 0.00 H new ATOM 0 HG22 VAL A 65 30.455 27.170 22.627 1.00 0.00 H new ATOM 0 HG23 VAL A 65 28.850 26.828 23.314 1.00 0.00 H new ATOM 832 N LEU A 66 28.651 27.148 18.187 1.00 0.00 N ATOM 833 CA LEU A 66 28.140 26.792 16.899 1.00 0.00 C ATOM 834 C LEU A 66 28.957 25.716 16.271 1.00 0.00 C ATOM 835 O LEU A 66 28.434 24.663 15.910 1.00 0.00 O ATOM 836 CB LEU A 66 28.062 27.962 15.904 1.00 0.00 C ATOM 837 CG LEU A 66 26.894 28.948 16.062 1.00 0.00 C ATOM 838 CD1 LEU A 66 25.526 28.259 16.201 1.00 0.00 C ATOM 839 CD2 LEU A 66 27.102 29.970 17.193 1.00 0.00 C ATOM 0 H LEU A 66 29.505 27.705 18.162 1.00 0.00 H new ATOM 0 HA LEU A 66 27.124 26.451 17.099 1.00 0.00 H new ATOM 0 HB2 LEU A 66 28.992 28.527 15.975 1.00 0.00 H new ATOM 0 HB3 LEU A 66 28.018 27.546 14.898 1.00 0.00 H new ATOM 0 HG LEU A 66 26.886 29.501 15.123 1.00 0.00 H new ATOM 0 HD11 LEU A 66 24.748 29.014 16.309 1.00 0.00 H new ATOM 0 HD12 LEU A 66 25.329 27.659 15.313 1.00 0.00 H new ATOM 0 HD13 LEU A 66 25.531 27.615 17.080 1.00 0.00 H new ATOM 0 HD21 LEU A 66 26.239 30.634 17.247 1.00 0.00 H new ATOM 0 HD22 LEU A 66 27.216 29.445 18.141 1.00 0.00 H new ATOM 0 HD23 LEU A 66 27.999 30.556 16.993 1.00 0.00 H new ATOM 851 N ALA A 67 30.273 25.931 16.089 1.00 0.00 N ATOM 852 CA ALA A 67 31.064 25.022 15.321 1.00 0.00 C ATOM 853 C ALA A 67 32.477 24.986 15.795 1.00 0.00 C ATOM 854 O ALA A 67 33.071 26.015 16.115 1.00 0.00 O ATOM 855 CB ALA A 67 31.068 25.410 13.832 1.00 0.00 C ATOM 0 H ALA A 67 30.785 26.727 16.470 1.00 0.00 H new ATOM 0 HA ALA A 67 30.612 24.038 15.449 1.00 0.00 H new ATOM 0 HB1 ALA A 67 31.678 24.700 13.273 1.00 0.00 H new ATOM 0 HB2 ALA A 67 30.048 25.393 13.449 1.00 0.00 H new ATOM 0 HB3 ALA A 67 31.481 26.412 13.718 1.00 0.00 H new ATOM 861 N VAL A 68 33.064 23.779 15.870 1.00 0.00 N ATOM 862 CA VAL A 68 34.434 23.594 16.235 1.00 0.00 C ATOM 863 C VAL A 68 35.208 23.207 15.023 1.00 0.00 C ATOM 864 O VAL A 68 35.104 22.086 14.525 1.00 0.00 O ATOM 865 CB VAL A 68 34.640 22.550 17.293 1.00 0.00 C ATOM 866 CG1 VAL A 68 36.128 22.464 17.669 1.00 0.00 C ATOM 867 CG2 VAL A 68 33.798 22.854 18.544 1.00 0.00 C ATOM 0 H VAL A 68 32.573 22.907 15.671 1.00 0.00 H new ATOM 0 HA VAL A 68 34.779 24.540 16.652 1.00 0.00 H new ATOM 0 HB VAL A 68 34.315 21.591 16.889 1.00 0.00 H new ATOM 0 HG11 VAL A 68 36.266 21.703 18.437 1.00 0.00 H new ATOM 0 HG12 VAL A 68 36.711 22.199 16.787 1.00 0.00 H new ATOM 0 HG13 VAL A 68 36.464 23.429 18.049 1.00 0.00 H new ATOM 0 HG21 VAL A 68 33.968 22.081 19.293 1.00 0.00 H new ATOM 0 HG22 VAL A 68 34.087 23.823 18.951 1.00 0.00 H new ATOM 0 HG23 VAL A 68 32.742 22.874 18.276 1.00 0.00 H new ATOM 877 N ASN A 69 36.033 24.131 14.501 1.00 0.00 N ATOM 878 CA ASN A 69 37.033 23.893 13.507 1.00 0.00 C ATOM 879 C ASN A 69 36.511 23.309 12.239 1.00 0.00 C ATOM 880 O ASN A 69 36.973 22.281 11.747 1.00 0.00 O ATOM 881 CB ASN A 69 38.192 23.104 14.140 1.00 0.00 C ATOM 882 CG ASN A 69 39.522 23.383 13.452 1.00 0.00 C ATOM 883 OD1 ASN A 69 39.837 24.533 13.151 1.00 0.00 O ATOM 884 ND2 ASN A 69 40.348 22.321 13.250 1.00 0.00 N ATOM 0 H ASN A 69 35.999 25.108 14.793 1.00 0.00 H new ATOM 0 HA ASN A 69 37.419 24.856 13.173 1.00 0.00 H new ATOM 0 HB2 ASN A 69 38.270 23.362 15.196 1.00 0.00 H new ATOM 0 HB3 ASN A 69 37.974 22.037 14.087 1.00 0.00 H new ATOM 0 HD21 ASN A 69 41.268 22.463 12.834 1.00 0.00 H new ATOM 0 HD22 ASN A 69 40.047 21.383 13.515 1.00 0.00 H new ATOM 891 N GLY A 70 35.479 23.952 11.662 1.00 0.00 N ATOM 892 CA GLY A 70 34.795 23.513 10.486 1.00 0.00 C ATOM 893 C GLY A 70 33.546 22.745 10.759 1.00 0.00 C ATOM 894 O GLY A 70 32.626 22.755 9.942 1.00 0.00 O ATOM 0 H GLY A 70 35.103 24.823 12.036 1.00 0.00 H new ATOM 0 HA2 GLY A 70 34.548 24.382 9.876 1.00 0.00 H new ATOM 0 HA3 GLY A 70 35.470 22.892 9.897 1.00 0.00 H new ATOM 898 N VAL A 71 33.461 22.028 11.894 1.00 0.00 N ATOM 899 CA VAL A 71 32.403 21.105 12.163 1.00 0.00 C ATOM 900 C VAL A 71 31.348 21.726 13.012 1.00 0.00 C ATOM 901 O VAL A 71 31.597 22.105 14.156 1.00 0.00 O ATOM 902 CB VAL A 71 32.902 19.853 12.821 1.00 0.00 C ATOM 903 CG1 VAL A 71 31.759 18.860 13.098 1.00 0.00 C ATOM 904 CG2 VAL A 71 33.953 19.186 11.916 1.00 0.00 C ATOM 0 H VAL A 71 34.148 22.092 12.646 1.00 0.00 H new ATOM 0 HA VAL A 71 31.974 20.837 11.198 1.00 0.00 H new ATOM 0 HB VAL A 71 33.345 20.128 13.778 1.00 0.00 H new ATOM 0 HG11 VAL A 71 32.161 17.966 13.575 1.00 0.00 H new ATOM 0 HG12 VAL A 71 31.025 19.324 13.757 1.00 0.00 H new ATOM 0 HG13 VAL A 71 31.280 18.585 12.158 1.00 0.00 H new ATOM 0 HG21 VAL A 71 34.318 18.276 12.392 1.00 0.00 H new ATOM 0 HG22 VAL A 71 33.501 18.938 10.956 1.00 0.00 H new ATOM 0 HG23 VAL A 71 34.786 19.872 11.759 1.00 0.00 H new ATOM 914 N SER A 72 30.105 21.839 12.511 1.00 0.00 N ATOM 915 CA SER A 72 29.011 22.348 13.280 1.00 0.00 C ATOM 916 C SER A 72 28.595 21.414 14.363 1.00 0.00 C ATOM 917 O SER A 72 28.403 20.219 14.141 1.00 0.00 O ATOM 918 CB SER A 72 27.755 22.667 12.451 1.00 0.00 C ATOM 919 OG SER A 72 27.962 23.794 11.610 1.00 0.00 O ATOM 0 H SER A 72 29.855 21.573 11.558 1.00 0.00 H new ATOM 0 HA SER A 72 29.407 23.274 13.697 1.00 0.00 H new ATOM 0 HB2 SER A 72 27.488 21.802 11.844 1.00 0.00 H new ATOM 0 HB3 SER A 72 26.915 22.859 13.119 1.00 0.00 H new ATOM 0 HG SER A 72 27.148 23.971 11.094 1.00 0.00 H new ATOM 925 N LEU A 73 28.431 21.925 15.596 1.00 0.00 N ATOM 926 CA LEU A 73 28.033 21.150 16.729 1.00 0.00 C ATOM 927 C LEU A 73 26.558 21.170 16.942 1.00 0.00 C ATOM 928 O LEU A 73 26.026 20.467 17.800 1.00 0.00 O ATOM 929 CB LEU A 73 28.714 21.613 18.027 1.00 0.00 C ATOM 930 CG LEU A 73 30.172 21.157 18.207 1.00 0.00 C ATOM 931 CD1 LEU A 73 30.688 21.678 19.560 1.00 0.00 C ATOM 932 CD2 LEU A 73 30.333 19.628 18.171 1.00 0.00 C ATOM 0 H LEU A 73 28.581 22.911 15.811 1.00 0.00 H new ATOM 0 HA LEU A 73 28.351 20.133 16.498 1.00 0.00 H new ATOM 0 HB2 LEU A 73 28.685 22.702 18.064 1.00 0.00 H new ATOM 0 HB3 LEU A 73 28.131 21.249 18.873 1.00 0.00 H new ATOM 0 HG LEU A 73 30.745 21.562 17.373 1.00 0.00 H new ATOM 0 HD11 LEU A 73 31.722 21.362 19.701 1.00 0.00 H new ATOM 0 HD12 LEU A 73 30.636 22.767 19.574 1.00 0.00 H new ATOM 0 HD13 LEU A 73 30.072 21.275 20.364 1.00 0.00 H new ATOM 0 HD21 LEU A 73 31.384 19.370 18.303 1.00 0.00 H new ATOM 0 HD22 LEU A 73 29.746 19.181 18.973 1.00 0.00 H new ATOM 0 HD23 LEU A 73 29.984 19.248 17.211 1.00 0.00 H new ATOM 944 N GLU A 74 25.815 21.977 16.164 1.00 0.00 N ATOM 945 CA GLU A 74 24.395 22.134 16.244 1.00 0.00 C ATOM 946 C GLU A 74 23.618 20.868 16.128 1.00 0.00 C ATOM 947 O GLU A 74 23.801 20.067 15.213 1.00 0.00 O ATOM 948 CB GLU A 74 23.943 23.125 15.158 1.00 0.00 C ATOM 949 CG GLU A 74 24.341 24.571 15.461 1.00 0.00 C ATOM 950 CD GLU A 74 23.223 25.310 16.183 1.00 0.00 C ATOM 951 OE1 GLU A 74 22.273 25.746 15.479 1.00 0.00 O ATOM 952 OE2 GLU A 74 23.249 25.440 17.435 1.00 0.00 O ATOM 0 H GLU A 74 26.232 22.555 15.434 1.00 0.00 H new ATOM 0 HA GLU A 74 24.184 22.510 17.245 1.00 0.00 H new ATOM 0 HB2 GLU A 74 24.374 22.829 14.202 1.00 0.00 H new ATOM 0 HB3 GLU A 74 22.860 23.068 15.050 1.00 0.00 H new ATOM 0 HG2 GLU A 74 25.243 24.582 16.074 1.00 0.00 H new ATOM 0 HG3 GLU A 74 24.581 25.087 14.531 1.00 0.00 H new ATOM 959 N GLY A 75 22.722 20.624 17.100 1.00 0.00 N ATOM 960 CA GLY A 75 21.914 19.447 17.184 1.00 0.00 C ATOM 961 C GLY A 75 22.511 18.300 17.922 1.00 0.00 C ATOM 962 O GLY A 75 21.828 17.311 18.182 1.00 0.00 O ATOM 0 H GLY A 75 22.553 21.278 17.864 1.00 0.00 H new ATOM 0 HA2 GLY A 75 20.971 19.711 17.663 1.00 0.00 H new ATOM 0 HA3 GLY A 75 21.677 19.119 16.172 1.00 0.00 H new ATOM 966 N ALA A 76 23.814 18.361 18.254 1.00 0.00 N ATOM 967 CA ALA A 76 24.521 17.309 18.917 1.00 0.00 C ATOM 968 C ALA A 76 24.213 17.091 20.358 1.00 0.00 C ATOM 969 O ALA A 76 23.430 17.796 20.992 1.00 0.00 O ATOM 970 CB ALA A 76 26.031 17.535 18.739 1.00 0.00 C ATOM 0 H ALA A 76 24.397 19.174 18.053 1.00 0.00 H new ATOM 0 HA ALA A 76 24.172 16.396 18.435 1.00 0.00 H new ATOM 0 HB1 ALA A 76 26.580 16.738 19.241 1.00 0.00 H new ATOM 0 HB2 ALA A 76 26.277 17.532 17.677 1.00 0.00 H new ATOM 0 HB3 ALA A 76 26.309 18.496 19.173 1.00 0.00 H new ATOM 976 N THR A 77 24.858 16.078 20.965 1.00 0.00 N ATOM 977 CA THR A 77 24.915 15.907 22.383 1.00 0.00 C ATOM 978 C THR A 77 26.126 16.566 22.948 1.00 0.00 C ATOM 979 O THR A 77 27.042 16.984 22.241 1.00 0.00 O ATOM 980 CB THR A 77 24.872 14.487 22.867 1.00 0.00 C ATOM 981 OG1 THR A 77 26.012 13.724 22.502 1.00 0.00 O ATOM 982 CG2 THR A 77 23.629 13.770 22.316 1.00 0.00 C ATOM 0 H THR A 77 25.357 15.353 20.450 1.00 0.00 H new ATOM 0 HA THR A 77 24.000 16.379 22.740 1.00 0.00 H new ATOM 0 HB THR A 77 24.845 14.554 23.955 1.00 0.00 H new ATOM 0 HG1 THR A 77 25.920 12.812 22.849 1.00 0.00 H new ATOM 0 HG21 THR A 77 23.613 12.741 22.676 1.00 0.00 H new ATOM 0 HG22 THR A 77 22.731 14.287 22.654 1.00 0.00 H new ATOM 0 HG23 THR A 77 23.661 13.772 21.226 1.00 0.00 H new ATOM 990 N HIS A 78 26.195 16.631 24.290 1.00 0.00 N ATOM 991 CA HIS A 78 27.341 17.001 25.061 1.00 0.00 C ATOM 992 C HIS A 78 28.546 16.190 24.733 1.00 0.00 C ATOM 993 O HIS A 78 29.646 16.720 24.583 1.00 0.00 O ATOM 994 CB HIS A 78 26.992 16.885 26.555 1.00 0.00 C ATOM 995 CG HIS A 78 28.115 16.820 27.547 1.00 0.00 C ATOM 996 ND1 HIS A 78 28.580 15.632 28.073 1.00 0.00 N ATOM 997 CD2 HIS A 78 28.798 17.803 28.193 1.00 0.00 C ATOM 998 CE1 HIS A 78 29.511 15.954 29.011 1.00 0.00 C ATOM 999 NE2 HIS A 78 29.659 17.260 29.127 1.00 0.00 N ATOM 0 H HIS A 78 25.391 16.409 24.877 1.00 0.00 H new ATOM 0 HA HIS A 78 27.598 18.031 24.813 1.00 0.00 H new ATOM 0 HB2 HIS A 78 26.367 17.738 26.817 1.00 0.00 H new ATOM 0 HB3 HIS A 78 26.382 15.991 26.685 1.00 0.00 H new ATOM 0 HD2 HIS A 78 28.683 18.860 28.002 1.00 0.00 H new ATOM 0 HE1 HIS A 78 30.062 15.228 29.591 1.00 0.00 H new ATOM 0 HE2 HIS A 78 30.275 17.760 29.767 1.00 0.00 H new ATOM 1007 N LYS A 79 28.380 14.867 24.555 1.00 0.00 N ATOM 1008 CA LYS A 79 29.432 13.966 24.204 1.00 0.00 C ATOM 1009 C LYS A 79 30.142 14.306 22.937 1.00 0.00 C ATOM 1010 O LYS A 79 31.371 14.290 22.902 1.00 0.00 O ATOM 1011 CB LYS A 79 28.935 12.511 24.191 1.00 0.00 C ATOM 1012 CG LYS A 79 30.056 11.469 24.216 1.00 0.00 C ATOM 1013 CD LYS A 79 30.801 11.382 25.549 1.00 0.00 C ATOM 1014 CE LYS A 79 32.008 10.445 25.476 1.00 0.00 C ATOM 1015 NZ LYS A 79 32.666 10.290 26.793 1.00 0.00 N ATOM 0 H LYS A 79 27.476 14.407 24.660 1.00 0.00 H new ATOM 0 HA LYS A 79 30.180 14.079 24.989 1.00 0.00 H new ATOM 0 HB2 LYS A 79 28.286 12.352 25.052 1.00 0.00 H new ATOM 0 HB3 LYS A 79 28.327 12.354 23.300 1.00 0.00 H new ATOM 0 HG2 LYS A 79 29.633 10.491 23.984 1.00 0.00 H new ATOM 0 HG3 LYS A 79 30.771 11.702 23.427 1.00 0.00 H new ATOM 0 HD2 LYS A 79 31.133 12.378 25.843 1.00 0.00 H new ATOM 0 HD3 LYS A 79 30.118 11.032 26.323 1.00 0.00 H new ATOM 0 HE2 LYS A 79 31.688 9.468 25.113 1.00 0.00 H new ATOM 0 HE3 LYS A 79 32.727 10.834 24.755 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 33.479 9.648 26.701 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 32.994 11.218 27.129 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 31.988 9.895 27.475 1.00 0.00 H new ATOM 1029 N GLN A 80 29.433 14.705 21.866 1.00 0.00 N ATOM 1030 CA GLN A 80 30.033 15.147 20.645 1.00 0.00 C ATOM 1031 C GLN A 80 30.935 16.322 20.801 1.00 0.00 C ATOM 1032 O GLN A 80 32.069 16.304 20.324 1.00 0.00 O ATOM 1033 CB GLN A 80 29.007 15.526 19.564 1.00 0.00 C ATOM 1034 CG GLN A 80 28.440 14.371 18.736 1.00 0.00 C ATOM 1035 CD GLN A 80 27.338 13.600 19.449 1.00 0.00 C ATOM 1036 OE1 GLN A 80 26.194 14.048 19.501 1.00 0.00 O ATOM 1037 NE2 GLN A 80 27.676 12.402 19.997 1.00 0.00 N ATOM 0 H GLN A 80 28.413 14.721 21.849 1.00 0.00 H new ATOM 0 HA GLN A 80 30.611 14.275 20.338 1.00 0.00 H new ATOM 0 HB2 GLN A 80 28.177 16.042 20.046 1.00 0.00 H new ATOM 0 HB3 GLN A 80 29.473 16.239 18.884 1.00 0.00 H new ATOM 0 HG2 GLN A 80 28.049 14.764 17.797 1.00 0.00 H new ATOM 0 HG3 GLN A 80 29.248 13.685 18.482 1.00 0.00 H new ATOM 0 HE21 GLN A 80 28.636 12.065 19.933 1.00 0.00 H new ATOM 0 HE22 GLN A 80 26.969 11.841 20.472 1.00 0.00 H new ATOM 1046 N ALA A 81 30.484 17.391 21.482 1.00 0.00 N ATOM 1047 CA ALA A 81 31.257 18.545 21.820 1.00 0.00 C ATOM 1048 C ALA A 81 32.479 18.245 22.617 1.00 0.00 C ATOM 1049 O ALA A 81 33.562 18.744 22.311 1.00 0.00 O ATOM 1050 CB ALA A 81 30.362 19.518 22.607 1.00 0.00 C ATOM 0 H ALA A 81 29.522 17.452 21.816 1.00 0.00 H new ATOM 0 HA ALA A 81 31.606 18.980 20.883 1.00 0.00 H new ATOM 0 HB1 ALA A 81 30.936 20.406 22.874 1.00 0.00 H new ATOM 0 HB2 ALA A 81 29.510 19.808 21.991 1.00 0.00 H new ATOM 0 HB3 ALA A 81 30.005 19.031 23.514 1.00 0.00 H new ATOM 1056 N VAL A 82 32.386 17.379 23.641 1.00 0.00 N ATOM 1057 CA VAL A 82 33.481 16.953 24.457 1.00 0.00 C ATOM 1058 C VAL A 82 34.471 16.153 23.684 1.00 0.00 C ATOM 1059 O VAL A 82 35.669 16.414 23.769 1.00 0.00 O ATOM 1060 CB VAL A 82 33.033 16.192 25.670 1.00 0.00 C ATOM 1061 CG1 VAL A 82 34.219 15.616 26.461 1.00 0.00 C ATOM 1062 CG2 VAL A 82 32.252 17.147 26.589 1.00 0.00 C ATOM 0 H VAL A 82 31.500 16.953 23.914 1.00 0.00 H new ATOM 0 HA VAL A 82 33.969 17.865 24.800 1.00 0.00 H new ATOM 0 HB VAL A 82 32.413 15.361 25.335 1.00 0.00 H new ATOM 0 HG11 VAL A 82 33.847 15.073 27.330 1.00 0.00 H new ATOM 0 HG12 VAL A 82 34.786 14.937 25.824 1.00 0.00 H new ATOM 0 HG13 VAL A 82 34.866 16.429 26.790 1.00 0.00 H new ATOM 0 HG21 VAL A 82 31.919 16.608 27.476 1.00 0.00 H new ATOM 0 HG22 VAL A 82 32.897 17.973 26.887 1.00 0.00 H new ATOM 0 HG23 VAL A 82 31.385 17.538 26.056 1.00 0.00 H new ATOM 1072 N GLU A 83 34.019 15.188 22.862 1.00 0.00 N ATOM 1073 CA GLU A 83 34.864 14.402 22.017 1.00 0.00 C ATOM 1074 C GLU A 83 35.545 15.216 20.973 1.00 0.00 C ATOM 1075 O GLU A 83 36.722 15.025 20.672 1.00 0.00 O ATOM 1076 CB GLU A 83 34.140 13.216 21.356 1.00 0.00 C ATOM 1077 CG GLU A 83 33.767 12.094 22.327 1.00 0.00 C ATOM 1078 CD GLU A 83 33.155 10.867 21.667 1.00 0.00 C ATOM 1079 OE1 GLU A 83 33.026 10.815 20.415 1.00 0.00 O ATOM 1080 OE2 GLU A 83 32.828 9.903 22.410 1.00 0.00 O ATOM 0 H GLU A 83 33.031 14.947 22.783 1.00 0.00 H new ATOM 0 HA GLU A 83 35.618 13.996 22.691 1.00 0.00 H new ATOM 0 HB2 GLU A 83 33.233 13.581 20.873 1.00 0.00 H new ATOM 0 HB3 GLU A 83 34.777 12.807 20.571 1.00 0.00 H new ATOM 0 HG2 GLU A 83 34.661 11.790 22.872 1.00 0.00 H new ATOM 0 HG3 GLU A 83 33.063 12.485 23.062 1.00 0.00 H new ATOM 1087 N THR A 84 34.841 16.218 20.414 1.00 0.00 N ATOM 1088 CA THR A 84 35.326 17.191 19.485 1.00 0.00 C ATOM 1089 C THR A 84 36.388 18.065 20.058 1.00 0.00 C ATOM 1090 O THR A 84 37.432 18.268 19.440 1.00 0.00 O ATOM 1091 CB THR A 84 34.196 18.015 18.943 1.00 0.00 C ATOM 1092 OG1 THR A 84 33.364 17.215 18.116 1.00 0.00 O ATOM 1093 CG2 THR A 84 34.647 19.209 18.085 1.00 0.00 C ATOM 0 H THR A 84 33.854 16.357 20.631 1.00 0.00 H new ATOM 0 HA THR A 84 35.788 16.637 18.667 1.00 0.00 H new ATOM 0 HB THR A 84 33.676 18.395 19.822 1.00 0.00 H new ATOM 0 HG1 THR A 84 32.730 16.717 18.674 1.00 0.00 H new ATOM 0 HG21 THR A 84 33.772 19.754 17.731 1.00 0.00 H new ATOM 0 HG22 THR A 84 35.270 19.873 18.684 1.00 0.00 H new ATOM 0 HG23 THR A 84 35.219 18.848 17.231 1.00 0.00 H new ATOM 1101 N LEU A 85 36.219 18.590 21.285 1.00 0.00 N ATOM 1102 CA LEU A 85 37.228 19.340 21.969 1.00 0.00 C ATOM 1103 C LEU A 85 38.401 18.532 22.406 1.00 0.00 C ATOM 1104 O LEU A 85 39.482 19.065 22.654 1.00 0.00 O ATOM 1105 CB LEU A 85 36.662 20.046 23.212 1.00 0.00 C ATOM 1106 CG LEU A 85 35.688 21.203 22.930 1.00 0.00 C ATOM 1107 CD1 LEU A 85 35.140 21.743 24.262 1.00 0.00 C ATOM 1108 CD2 LEU A 85 36.341 22.337 22.121 1.00 0.00 C ATOM 0 H LEU A 85 35.355 18.490 21.818 1.00 0.00 H new ATOM 0 HA LEU A 85 37.568 20.062 21.227 1.00 0.00 H new ATOM 0 HB2 LEU A 85 36.151 19.306 23.828 1.00 0.00 H new ATOM 0 HB3 LEU A 85 37.495 20.430 23.801 1.00 0.00 H new ATOM 0 HG LEU A 85 34.873 20.812 22.321 1.00 0.00 H new ATOM 0 HD11 LEU A 85 34.449 22.563 24.066 1.00 0.00 H new ATOM 0 HD12 LEU A 85 34.616 20.946 24.790 1.00 0.00 H new ATOM 0 HD13 LEU A 85 35.966 22.103 24.876 1.00 0.00 H new ATOM 0 HD21 LEU A 85 35.611 23.128 21.949 1.00 0.00 H new ATOM 0 HD22 LEU A 85 37.188 22.739 22.677 1.00 0.00 H new ATOM 0 HD23 LEU A 85 36.687 21.948 21.163 1.00 0.00 H new ATOM 1120 N ARG A 86 38.254 17.203 22.545 1.00 0.00 N ATOM 1121 CA ARG A 86 39.334 16.283 22.729 1.00 0.00 C ATOM 1122 C ARG A 86 40.118 16.109 21.473 1.00 0.00 C ATOM 1123 O ARG A 86 41.335 16.285 21.437 1.00 0.00 O ATOM 1124 CB ARG A 86 38.797 14.937 23.242 1.00 0.00 C ATOM 1125 CG ARG A 86 39.235 14.576 24.662 1.00 0.00 C ATOM 1126 CD ARG A 86 38.780 13.171 25.057 1.00 0.00 C ATOM 1127 NE ARG A 86 39.386 12.832 26.376 1.00 0.00 N ATOM 1128 CZ ARG A 86 39.390 11.562 26.875 1.00 0.00 C ATOM 1129 NH1 ARG A 86 38.722 10.542 26.264 1.00 0.00 N ATOM 1130 NH2 ARG A 86 40.096 11.292 28.013 1.00 0.00 N ATOM 0 H ARG A 86 37.341 16.749 22.528 1.00 0.00 H new ATOM 0 HA ARG A 86 40.013 16.693 23.477 1.00 0.00 H new ATOM 0 HB2 ARG A 86 37.708 14.958 23.206 1.00 0.00 H new ATOM 0 HB3 ARG A 86 39.123 14.148 22.564 1.00 0.00 H new ATOM 0 HG2 ARG A 86 40.321 14.640 24.735 1.00 0.00 H new ATOM 0 HG3 ARG A 86 38.825 15.302 25.364 1.00 0.00 H new ATOM 0 HD2 ARG A 86 37.693 13.128 25.117 1.00 0.00 H new ATOM 0 HD3 ARG A 86 39.086 12.447 24.302 1.00 0.00 H new ATOM 0 HE ARG A 86 39.814 13.577 26.926 1.00 0.00 H new ATOM 0 HH11 ARG A 86 38.198 10.717 25.406 1.00 0.00 H new ATOM 0 HH12 ARG A 86 38.746 9.604 26.665 1.00 0.00 H new ATOM 0 HH21 ARG A 86 40.613 12.036 28.481 1.00 0.00 H new ATOM 0 HH22 ARG A 86 40.106 10.346 28.395 1.00 0.00 H new ATOM 1144 N ASN A 87 39.424 15.773 20.371 1.00 0.00 N ATOM 1145 CA ASN A 87 39.981 15.448 19.095 1.00 0.00 C ATOM 1146 C ASN A 87 40.085 16.628 18.192 1.00 0.00 C ATOM 1147 O ASN A 87 39.783 16.545 17.003 1.00 0.00 O ATOM 1148 CB ASN A 87 39.101 14.349 18.475 1.00 0.00 C ATOM 1149 CG ASN A 87 39.827 13.460 17.474 1.00 0.00 C ATOM 1150 OD1 ASN A 87 39.674 13.548 16.257 1.00 0.00 O ATOM 1151 ND2 ASN A 87 40.650 12.520 18.009 1.00 0.00 N ATOM 0 H ASN A 87 38.405 15.726 20.373 1.00 0.00 H new ATOM 0 HA ASN A 87 41.004 15.098 19.229 1.00 0.00 H new ATOM 0 HB2 ASN A 87 38.701 13.726 19.274 1.00 0.00 H new ATOM 0 HB3 ASN A 87 38.250 14.817 17.979 1.00 0.00 H new ATOM 0 HD21 ASN A 87 41.152 11.875 17.399 1.00 0.00 H new ATOM 0 HD22 ASN A 87 40.766 12.460 19.021 1.00 0.00 H new ATOM 1158 N THR A 88 40.536 17.788 18.702 1.00 0.00 N ATOM 1159 CA THR A 88 40.816 18.952 17.918 1.00 0.00 C ATOM 1160 C THR A 88 42.285 19.162 17.784 1.00 0.00 C ATOM 1161 O THR A 88 43.092 18.624 18.541 1.00 0.00 O ATOM 1162 CB THR A 88 40.045 20.188 18.276 1.00 0.00 C ATOM 1163 OG1 THR A 88 40.096 21.190 17.271 1.00 0.00 O ATOM 1164 CG2 THR A 88 40.568 20.774 19.599 1.00 0.00 C ATOM 0 H THR A 88 40.712 17.921 19.698 1.00 0.00 H new ATOM 0 HA THR A 88 40.422 18.736 16.925 1.00 0.00 H new ATOM 0 HB THR A 88 39.004 19.881 18.377 1.00 0.00 H new ATOM 0 HG1 THR A 88 39.270 21.716 17.292 1.00 0.00 H new ATOM 0 HG21 THR A 88 40.001 21.671 19.849 1.00 0.00 H new ATOM 0 HG22 THR A 88 40.452 20.038 20.394 1.00 0.00 H new ATOM 0 HG23 THR A 88 41.622 21.029 19.492 1.00 0.00 H new ATOM 1172 N GLY A 89 42.683 19.941 16.763 1.00 0.00 N ATOM 1173 CA GLY A 89 44.027 20.042 16.286 1.00 0.00 C ATOM 1174 C GLY A 89 44.850 21.023 17.046 1.00 0.00 C ATOM 1175 O GLY A 89 44.482 21.453 18.138 1.00 0.00 O ATOM 0 H GLY A 89 42.033 20.531 16.243 1.00 0.00 H new ATOM 0 HA2 GLY A 89 44.500 19.061 16.342 1.00 0.00 H new ATOM 0 HA3 GLY A 89 44.011 20.329 15.235 1.00 0.00 H new ATOM 1179 N GLN A 90 46.013 21.428 16.504 1.00 0.00 N ATOM 1180 CA GLN A 90 46.794 22.458 17.113 1.00 0.00 C ATOM 1181 C GLN A 90 46.154 23.799 17.012 1.00 0.00 C ATOM 1182 O GLN A 90 46.025 24.512 18.005 1.00 0.00 O ATOM 1183 CB GLN A 90 48.247 22.527 16.610 1.00 0.00 C ATOM 1184 CG GLN A 90 49.094 23.433 17.505 1.00 0.00 C ATOM 1185 CD GLN A 90 50.569 23.493 17.134 1.00 0.00 C ATOM 1186 OE1 GLN A 90 51.039 23.062 16.082 1.00 0.00 O ATOM 1187 NE2 GLN A 90 51.361 24.086 18.068 1.00 0.00 N ATOM 0 H GLN A 90 46.411 21.043 15.647 1.00 0.00 H new ATOM 0 HA GLN A 90 46.835 22.171 18.164 1.00 0.00 H new ATOM 0 HB2 GLN A 90 48.677 21.525 16.590 1.00 0.00 H new ATOM 0 HB3 GLN A 90 48.264 22.902 15.587 1.00 0.00 H new ATOM 0 HG2 GLN A 90 48.683 24.442 17.470 1.00 0.00 H new ATOM 0 HG3 GLN A 90 49.006 23.088 18.535 1.00 0.00 H new ATOM 0 HE21 GLN A 90 50.953 24.437 18.934 1.00 0.00 H new ATOM 0 HE22 GLN A 90 52.363 24.179 17.902 1.00 0.00 H new ATOM 1196 N VAL A 91 45.720 24.193 15.802 1.00 0.00 N ATOM 1197 CA VAL A 91 45.081 25.449 15.561 1.00 0.00 C ATOM 1198 C VAL A 91 43.624 25.214 15.353 1.00 0.00 C ATOM 1199 O VAL A 91 43.207 24.434 14.499 1.00 0.00 O ATOM 1200 CB VAL A 91 45.676 26.187 14.398 1.00 0.00 C ATOM 1201 CG1 VAL A 91 44.982 27.542 14.178 1.00 0.00 C ATOM 1202 CG2 VAL A 91 47.168 26.421 14.688 1.00 0.00 C ATOM 0 H VAL A 91 45.817 23.619 14.964 1.00 0.00 H new ATOM 0 HA VAL A 91 45.238 26.085 16.432 1.00 0.00 H new ATOM 0 HB VAL A 91 45.541 25.592 13.495 1.00 0.00 H new ATOM 0 HG11 VAL A 91 45.437 28.050 13.328 1.00 0.00 H new ATOM 0 HG12 VAL A 91 43.923 27.380 13.979 1.00 0.00 H new ATOM 0 HG13 VAL A 91 45.093 28.157 15.071 1.00 0.00 H new ATOM 0 HG21 VAL A 91 47.621 26.957 13.854 1.00 0.00 H new ATOM 0 HG22 VAL A 91 47.274 27.011 15.599 1.00 0.00 H new ATOM 0 HG23 VAL A 91 47.668 25.461 14.817 1.00 0.00 H new ATOM 1212 N VAL A 92 42.790 25.864 16.185 1.00 0.00 N ATOM 1213 CA VAL A 92 41.414 25.543 16.401 1.00 0.00 C ATOM 1214 C VAL A 92 40.569 26.739 16.124 1.00 0.00 C ATOM 1215 O VAL A 92 40.720 27.791 16.744 1.00 0.00 O ATOM 1216 CB VAL A 92 41.233 25.086 17.818 1.00 0.00 C ATOM 1217 CG1 VAL A 92 39.765 24.716 18.094 1.00 0.00 C ATOM 1218 CG2 VAL A 92 42.075 23.822 18.064 1.00 0.00 C ATOM 0 H VAL A 92 43.097 26.663 16.740 1.00 0.00 H new ATOM 0 HA VAL A 92 41.109 24.742 15.727 1.00 0.00 H new ATOM 0 HB VAL A 92 41.541 25.903 18.471 1.00 0.00 H new ATOM 0 HG11 VAL A 92 39.661 24.388 19.128 1.00 0.00 H new ATOM 0 HG12 VAL A 92 39.132 25.587 17.924 1.00 0.00 H new ATOM 0 HG13 VAL A 92 39.461 23.911 17.425 1.00 0.00 H new ATOM 0 HG21 VAL A 92 41.942 23.491 19.094 1.00 0.00 H new ATOM 0 HG22 VAL A 92 41.753 23.032 17.385 1.00 0.00 H new ATOM 0 HG23 VAL A 92 43.127 24.046 17.887 1.00 0.00 H new ATOM 1228 N HIS A 93 39.633 26.638 15.163 1.00 0.00 N ATOM 1229 CA HIS A 93 38.806 27.720 14.726 1.00 0.00 C ATOM 1230 C HIS A 93 37.410 27.613 15.240 1.00 0.00 C ATOM 1231 O HIS A 93 36.566 26.936 14.656 1.00 0.00 O ATOM 1232 CB HIS A 93 38.807 27.733 13.189 1.00 0.00 C ATOM 1233 CG HIS A 93 38.412 29.017 12.521 1.00 0.00 C ATOM 1234 ND1 HIS A 93 38.090 29.076 11.181 1.00 0.00 N ATOM 1235 CD2 HIS A 93 38.485 30.309 12.938 1.00 0.00 C ATOM 1236 CE1 HIS A 93 37.983 30.393 10.855 1.00 0.00 C ATOM 1237 NE2 HIS A 93 38.219 31.171 11.894 1.00 0.00 N ATOM 0 H HIS A 93 39.445 25.765 14.670 1.00 0.00 H new ATOM 0 HA HIS A 93 39.211 28.651 15.123 1.00 0.00 H new ATOM 0 HB2 HIS A 93 39.808 27.467 12.848 1.00 0.00 H new ATOM 0 HB3 HIS A 93 38.133 26.949 12.843 1.00 0.00 H new ATOM 0 HD2 HIS A 93 38.719 30.618 13.946 1.00 0.00 H new ATOM 0 HE1 HIS A 93 37.736 30.756 9.868 1.00 0.00 H new ATOM 0 HE2 HIS A 93 38.207 32.191 11.920 1.00 0.00 H new ATOM 1245 N LEU A 94 37.075 28.276 16.361 1.00 0.00 N ATOM 1246 CA LEU A 94 35.783 28.186 16.967 1.00 0.00 C ATOM 1247 C LEU A 94 34.821 29.207 16.464 1.00 0.00 C ATOM 1248 O LEU A 94 35.134 30.394 16.394 1.00 0.00 O ATOM 1249 CB LEU A 94 35.806 28.371 18.494 1.00 0.00 C ATOM 1250 CG LEU A 94 36.884 27.539 19.208 1.00 0.00 C ATOM 1251 CD1 LEU A 94 36.920 27.829 20.719 1.00 0.00 C ATOM 1252 CD2 LEU A 94 36.616 26.044 18.963 1.00 0.00 C ATOM 0 H LEU A 94 37.719 28.891 16.859 1.00 0.00 H new ATOM 0 HA LEU A 94 35.466 27.178 16.699 1.00 0.00 H new ATOM 0 HB2 LEU A 94 35.966 29.425 18.720 1.00 0.00 H new ATOM 0 HB3 LEU A 94 34.829 28.104 18.897 1.00 0.00 H new ATOM 0 HG LEU A 94 37.856 27.815 18.799 1.00 0.00 H new ATOM 0 HD11 LEU A 94 37.694 27.222 21.188 1.00 0.00 H new ATOM 0 HD12 LEU A 94 37.138 28.884 20.882 1.00 0.00 H new ATOM 0 HD13 LEU A 94 35.953 27.586 21.159 1.00 0.00 H new ATOM 0 HD21 LEU A 94 37.378 25.450 19.468 1.00 0.00 H new ATOM 0 HD22 LEU A 94 35.633 25.782 19.355 1.00 0.00 H new ATOM 0 HD23 LEU A 94 36.646 25.840 17.893 1.00 0.00 H new ATOM 1264 N LEU A 95 33.576 28.807 16.148 1.00 0.00 N ATOM 1265 CA LEU A 95 32.509 29.727 15.904 1.00 0.00 C ATOM 1266 C LEU A 95 31.594 29.736 17.080 1.00 0.00 C ATOM 1267 O LEU A 95 31.080 28.690 17.476 1.00 0.00 O ATOM 1268 CB LEU A 95 31.736 29.368 14.624 1.00 0.00 C ATOM 1269 CG LEU A 95 30.549 30.274 14.259 1.00 0.00 C ATOM 1270 CD1 LEU A 95 30.943 31.734 13.979 1.00 0.00 C ATOM 1271 CD2 LEU A 95 29.810 29.697 13.040 1.00 0.00 C ATOM 0 H LEU A 95 33.306 27.827 16.060 1.00 0.00 H new ATOM 0 HA LEU A 95 32.932 30.721 15.758 1.00 0.00 H new ATOM 0 HB2 LEU A 95 32.438 29.373 13.790 1.00 0.00 H new ATOM 0 HB3 LEU A 95 31.367 28.347 14.724 1.00 0.00 H new ATOM 0 HG LEU A 95 29.899 30.292 15.134 1.00 0.00 H new ATOM 0 HD11 LEU A 95 30.052 32.310 13.729 1.00 0.00 H new ATOM 0 HD12 LEU A 95 31.413 32.160 14.865 1.00 0.00 H new ATOM 0 HD13 LEU A 95 31.643 31.768 13.144 1.00 0.00 H new ATOM 0 HD21 LEU A 95 28.969 30.342 12.785 1.00 0.00 H new ATOM 0 HD22 LEU A 95 30.494 29.640 12.193 1.00 0.00 H new ATOM 0 HD23 LEU A 95 29.442 28.699 13.277 1.00 0.00 H new ATOM 1283 N LEU A 96 31.367 30.908 17.699 1.00 0.00 N ATOM 1284 CA LEU A 96 30.446 31.056 18.783 1.00 0.00 C ATOM 1285 C LEU A 96 29.647 32.307 18.655 1.00 0.00 C ATOM 1286 O LEU A 96 29.978 33.191 17.868 1.00 0.00 O ATOM 1287 CB LEU A 96 31.059 30.885 20.183 1.00 0.00 C ATOM 1288 CG LEU A 96 31.969 31.965 20.793 1.00 0.00 C ATOM 1289 CD1 LEU A 96 33.060 32.482 19.841 1.00 0.00 C ATOM 1290 CD2 LEU A 96 31.199 33.115 21.463 1.00 0.00 C ATOM 0 H LEU A 96 31.836 31.776 17.439 1.00 0.00 H new ATOM 0 HA LEU A 96 29.762 30.212 18.693 1.00 0.00 H new ATOM 0 HB2 LEU A 96 30.231 30.738 20.877 1.00 0.00 H new ATOM 0 HB3 LEU A 96 31.632 29.958 20.168 1.00 0.00 H new ATOM 0 HG LEU A 96 32.495 31.440 21.590 1.00 0.00 H new ATOM 0 HD11 LEU A 96 33.657 33.240 20.349 1.00 0.00 H new ATOM 0 HD12 LEU A 96 33.703 31.655 19.541 1.00 0.00 H new ATOM 0 HD13 LEU A 96 32.595 32.919 18.957 1.00 0.00 H new ATOM 0 HD21 LEU A 96 31.906 33.838 21.870 1.00 0.00 H new ATOM 0 HD22 LEU A 96 30.563 33.605 20.726 1.00 0.00 H new ATOM 0 HD23 LEU A 96 30.581 32.718 22.269 1.00 0.00 H new ATOM 1302 N GLU A 97 28.535 32.399 19.408 1.00 0.00 N ATOM 1303 CA GLU A 97 27.623 33.500 19.416 1.00 0.00 C ATOM 1304 C GLU A 97 27.418 33.970 20.815 1.00 0.00 C ATOM 1305 O GLU A 97 27.312 33.175 21.748 1.00 0.00 O ATOM 1306 CB GLU A 97 26.297 33.059 18.772 1.00 0.00 C ATOM 1307 CG GLU A 97 25.239 34.137 18.532 1.00 0.00 C ATOM 1308 CD GLU A 97 23.998 33.575 17.853 1.00 0.00 C ATOM 1309 OE1 GLU A 97 24.114 32.706 16.948 1.00 0.00 O ATOM 1310 OE2 GLU A 97 22.870 34.006 18.211 1.00 0.00 O ATOM 0 H GLU A 97 28.257 31.657 20.051 1.00 0.00 H new ATOM 0 HA GLU A 97 28.028 34.331 18.839 1.00 0.00 H new ATOM 0 HB2 GLU A 97 26.526 32.593 17.814 1.00 0.00 H new ATOM 0 HB3 GLU A 97 25.855 32.288 19.404 1.00 0.00 H new ATOM 0 HG2 GLU A 97 24.959 34.589 19.484 1.00 0.00 H new ATOM 0 HG3 GLU A 97 25.662 34.930 17.915 1.00 0.00 H new ATOM 1317 N LYS A 98 27.343 35.296 21.029 1.00 0.00 N ATOM 1318 CA LYS A 98 27.348 35.897 22.326 1.00 0.00 C ATOM 1319 C LYS A 98 26.044 35.808 23.041 1.00 0.00 C ATOM 1320 O LYS A 98 24.997 36.231 22.555 1.00 0.00 O ATOM 1321 CB LYS A 98 27.710 37.388 22.226 1.00 0.00 C ATOM 1322 CG LYS A 98 27.984 38.075 23.565 1.00 0.00 C ATOM 1323 CD LYS A 98 29.460 38.397 23.803 1.00 0.00 C ATOM 1324 CE LYS A 98 30.426 37.212 23.864 1.00 0.00 C ATOM 1325 NZ LYS A 98 30.241 36.446 25.117 1.00 0.00 N ATOM 0 H LYS A 98 27.276 35.974 20.270 1.00 0.00 H new ATOM 0 HA LYS A 98 28.089 35.333 22.893 1.00 0.00 H new ATOM 0 HB2 LYS A 98 28.592 37.491 21.594 1.00 0.00 H new ATOM 0 HB3 LYS A 98 26.896 37.912 21.725 1.00 0.00 H new ATOM 0 HG2 LYS A 98 27.408 38.999 23.613 1.00 0.00 H new ATOM 0 HG3 LYS A 98 27.627 37.434 24.371 1.00 0.00 H new ATOM 0 HD2 LYS A 98 29.793 39.066 23.010 1.00 0.00 H new ATOM 0 HD3 LYS A 98 29.540 38.949 24.740 1.00 0.00 H new ATOM 0 HE2 LYS A 98 30.263 36.560 23.006 1.00 0.00 H new ATOM 0 HE3 LYS A 98 31.453 37.571 23.800 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 30.695 35.515 25.025 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 30.672 36.965 25.908 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 29.225 36.319 25.299 1.00 0.00 H new ATOM 1339 N GLY A 99 26.082 35.256 24.267 1.00 0.00 N ATOM 1340 CA GLY A 99 24.968 35.112 25.152 1.00 0.00 C ATOM 1341 C GLY A 99 24.609 36.339 25.918 1.00 0.00 C ATOM 1342 O GLY A 99 25.269 37.375 25.856 1.00 0.00 O ATOM 0 H GLY A 99 26.946 34.887 24.665 1.00 0.00 H new ATOM 0 HA2 GLY A 99 24.101 34.797 24.572 1.00 0.00 H new ATOM 0 HA3 GLY A 99 25.186 34.311 25.859 1.00 0.00 H new ATOM 1346 N GLN A 100 23.495 36.267 26.668 1.00 0.00 N ATOM 1347 CA GLN A 100 22.848 37.385 27.282 1.00 0.00 C ATOM 1348 C GLN A 100 23.269 37.602 28.695 1.00 0.00 C ATOM 1349 O GLN A 100 23.899 38.605 29.026 1.00 0.00 O ATOM 1350 CB GLN A 100 21.317 37.246 27.227 1.00 0.00 C ATOM 1351 CG GLN A 100 20.809 36.760 25.868 1.00 0.00 C ATOM 1352 CD GLN A 100 19.293 36.822 25.760 1.00 0.00 C ATOM 1353 OE1 GLN A 100 18.607 37.568 26.458 1.00 0.00 O ATOM 1354 NE2 GLN A 100 18.725 36.000 24.836 1.00 0.00 N ATOM 0 H GLN A 100 23.021 35.383 26.856 1.00 0.00 H new ATOM 0 HA GLN A 100 23.160 38.255 26.704 1.00 0.00 H new ATOM 0 HB2 GLN A 100 20.993 36.549 28.000 1.00 0.00 H new ATOM 0 HB3 GLN A 100 20.862 38.210 27.455 1.00 0.00 H new ATOM 0 HG2 GLN A 100 21.252 37.368 25.079 1.00 0.00 H new ATOM 0 HG3 GLN A 100 21.141 35.735 25.705 1.00 0.00 H new ATOM 0 HE21 GLN A 100 19.312 35.389 24.267 1.00 0.00 H new ATOM 0 HE22 GLN A 100 17.713 35.995 24.712 1.00 0.00 H new ATOM 1363 N VAL A 101 22.903 36.691 29.614 1.00 0.00 N ATOM 1364 CA VAL A 101 23.000 36.926 31.022 1.00 0.00 C ATOM 1365 C VAL A 101 24.373 36.734 31.567 1.00 0.00 C ATOM 1366 O VAL A 101 24.952 35.671 31.347 1.00 0.00 O ATOM 1367 CB VAL A 101 21.992 36.145 31.813 1.00 0.00 C ATOM 1368 CG1 VAL A 101 20.581 36.649 31.466 1.00 0.00 C ATOM 1369 CG2 VAL A 101 22.070 34.629 31.566 1.00 0.00 C ATOM 0 H VAL A 101 22.532 35.772 29.374 1.00 0.00 H new ATOM 0 HA VAL A 101 22.763 37.983 31.140 1.00 0.00 H new ATOM 0 HB VAL A 101 22.217 36.304 32.868 1.00 0.00 H new ATOM 0 HG11 VAL A 101 19.843 36.086 32.037 1.00 0.00 H new ATOM 0 HG12 VAL A 101 20.501 37.707 31.714 1.00 0.00 H new ATOM 0 HG13 VAL A 101 20.397 36.511 30.400 1.00 0.00 H new ATOM 0 HG21 VAL A 101 21.315 34.123 32.168 1.00 0.00 H new ATOM 0 HG22 VAL A 101 21.891 34.423 30.511 1.00 0.00 H new ATOM 0 HG23 VAL A 101 23.059 34.265 31.844 1.00 0.00 H new ATOM 1379 N PRO A 102 24.985 37.647 32.261 1.00 0.00 N ATOM 1380 CA PRO A 102 26.250 37.411 32.893 1.00 0.00 C ATOM 1381 C PRO A 102 26.119 36.709 34.201 1.00 0.00 C ATOM 1382 O PRO A 102 27.068 35.961 34.560 1.00 0.00 O ATOM 1383 CB PRO A 102 26.856 38.802 33.064 1.00 0.00 C ATOM 1384 CG PRO A 102 25.636 39.716 33.254 1.00 0.00 C ATOM 1385 CD PRO A 102 24.577 39.040 32.367 1.00 0.00 C ATOM 1386 OXT PRO A 102 25.096 36.844 34.925 1.00 0.00 O ATOM 0 HA PRO A 102 26.876 36.751 32.293 1.00 0.00 H new ATOM 0 HB2 PRO A 102 27.524 38.844 33.924 1.00 0.00 H new ATOM 0 HB3 PRO A 102 27.441 39.093 32.192 1.00 0.00 H new ATOM 0 HG2 PRO A 102 25.322 39.764 34.297 1.00 0.00 H new ATOM 0 HG3 PRO A 102 25.840 40.738 32.936 1.00 0.00 H new ATOM 0 HD2 PRO A 102 23.584 39.125 32.809 1.00 0.00 H new ATOM 0 HD3 PRO A 102 24.530 39.510 31.385 1.00 0.00 H new TER 1394 PRO A 102