USER MOD reduce.3.24.130724 H: found=0, std=0, add=547, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 547 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 55 THR OG1 : rot -53:sc= 1.28 USER MOD Set 1.2: A 57 SER OG : rot -85:sc= 0.62 USER MOD Set 2.1: A 22 THR OG1 : rot -71:sc= 1.41 USER MOD Set 2.2: A 25 ASN : amide:sc= 1.59 K(o=3,f=-6.3!) USER MOD Set 3.1: A 14 THR OG1 : rot 180:sc= -0.0185 USER MOD Set 3.2: A 33 LYS NZ :NH3+ 172:sc= 1.14 (180deg=1.11) USER MOD Single : A 1 MET CE :methyl -172:sc= 0 (180deg=-0.0466) USER MOD Single : A 1 MET N :NH3+ -171:sc= 2.44 (180deg=2.12) USER MOD Single : A 2 GLN : amide:sc= 0.608 K(o=0.61,f=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00626) USER MOD Single : A 12 THR OG1 : rot 180:sc=-0.000452 USER MOD Single : A 20 SER OG : rot 180:sc= 0.0426 USER MOD Single : A 27 LYS NZ :NH3+ -167:sc= 1.27 (180deg=1.15) USER MOD Single : A 29 LYS NZ :NH3+ 174:sc= 1.25 (180deg=1.14) USER MOD Single : A 31 GLN : amide:sc= -0.677 X(o=-0.68,f=-1) USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=-0.14) USER MOD Single : A 41 GLN : amide:sc= 0.952 K(o=0.95,f=-3!) USER MOD Single : A 48 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0343) USER MOD Single : A 49 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 59 TYR OH : rot 120:sc= 0.645 USER MOD Single : A 60 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 62 GLN : amide:sc= -0.0396 X(o=-0.04,f=-0.076) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot -67:sc= 1.25 USER MOD Single : A 66 THR OG1 : rot -60:sc= 0.593 USER MOD Single : A 68 HIS : no HD1:sc=-0.00537 X(o=-0.0054,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 33.012 51.773 19.405 1.00 0.00 N ATOM 2 CA MET A 1 33.246 52.113 20.817 1.00 0.00 C ATOM 3 C MET A 1 34.696 52.541 21.048 1.00 0.00 C ATOM 4 O MET A 1 35.611 52.036 20.402 1.00 0.00 O ATOM 5 CB MET A 1 32.848 50.995 21.777 1.00 0.00 C ATOM 6 CG MET A 1 33.723 49.746 21.743 1.00 0.00 C ATOM 7 SD MET A 1 33.374 48.553 23.059 1.00 0.00 S ATOM 8 CE MET A 1 34.595 47.286 22.632 1.00 0.00 C ATOM 0 H1 MET A 1 31.994 51.635 19.245 1.00 0.00 H new ATOM 0 H2 MET A 1 33.355 52.546 18.800 1.00 0.00 H new ATOM 0 H3 MET A 1 33.521 50.897 19.170 1.00 0.00 H new ATOM 0 HA MET A 1 32.594 52.957 21.039 1.00 0.00 H new ATOM 0 HB2 MET A 1 32.856 51.393 22.792 1.00 0.00 H new ATOM 0 HB3 MET A 1 31.821 50.702 21.558 1.00 0.00 H new ATOM 0 HG2 MET A 1 33.595 49.253 20.779 1.00 0.00 H new ATOM 0 HG3 MET A 1 34.768 50.047 21.810 1.00 0.00 H new ATOM 0 HE1 MET A 1 34.434 46.403 23.250 1.00 0.00 H new ATOM 0 HE2 MET A 1 34.488 47.017 21.581 1.00 0.00 H new ATOM 0 HE3 MET A 1 35.598 47.674 22.807 1.00 0.00 H new ATOM 20 N GLN A 2 34.907 53.432 22.013 1.00 0.00 N ATOM 21 CA GLN A 2 36.199 53.939 22.428 1.00 0.00 C ATOM 22 C GLN A 2 36.710 53.208 23.670 1.00 0.00 C ATOM 23 O GLN A 2 35.972 53.039 24.638 1.00 0.00 O ATOM 24 CB GLN A 2 36.049 55.440 22.659 1.00 0.00 C ATOM 25 CG GLN A 2 37.355 56.224 22.746 1.00 0.00 C ATOM 26 CD GLN A 2 37.864 56.661 21.370 1.00 0.00 C ATOM 27 OE1 GLN A 2 37.418 57.653 20.799 1.00 0.00 O ATOM 28 NE2 GLN A 2 38.782 55.923 20.751 1.00 0.00 N ATOM 0 H GLN A 2 34.139 53.836 22.549 1.00 0.00 H new ATOM 0 HA GLN A 2 36.947 53.762 21.656 1.00 0.00 H new ATOM 0 HB2 GLN A 2 35.449 55.856 21.850 1.00 0.00 H new ATOM 0 HB3 GLN A 2 35.491 55.594 23.582 1.00 0.00 H new ATOM 0 HG2 GLN A 2 37.207 57.104 23.372 1.00 0.00 H new ATOM 0 HG3 GLN A 2 38.113 55.610 23.233 1.00 0.00 H new ATOM 0 HE21 GLN A 2 39.165 55.096 21.209 1.00 0.00 H new ATOM 0 HE22 GLN A 2 39.103 56.185 19.819 1.00 0.00 H new ATOM 37 N ILE A 3 37.980 52.808 23.669 1.00 0.00 N ATOM 38 CA ILE A 3 38.674 52.174 24.771 1.00 0.00 C ATOM 39 C ILE A 3 40.077 52.758 24.952 1.00 0.00 C ATOM 40 O ILE A 3 40.547 53.518 24.109 1.00 0.00 O ATOM 41 CB ILE A 3 38.726 50.658 24.607 1.00 0.00 C ATOM 42 CG1 ILE A 3 39.478 50.223 23.353 1.00 0.00 C ATOM 43 CG2 ILE A 3 37.326 50.053 24.663 1.00 0.00 C ATOM 44 CD1 ILE A 3 39.787 48.730 23.303 1.00 0.00 C ATOM 0 H ILE A 3 38.578 52.927 22.852 1.00 0.00 H new ATOM 0 HA ILE A 3 38.105 52.384 25.676 1.00 0.00 H new ATOM 0 HB ILE A 3 39.297 50.270 25.451 1.00 0.00 H new ATOM 0 HG12 ILE A 3 38.888 50.491 22.476 1.00 0.00 H new ATOM 0 HG13 ILE A 3 40.413 50.780 23.291 1.00 0.00 H new ATOM 0 HG21 ILE A 3 37.392 48.972 24.544 1.00 0.00 H new ATOM 0 HG22 ILE A 3 36.868 50.285 25.624 1.00 0.00 H new ATOM 0 HG23 ILE A 3 36.717 50.470 23.861 1.00 0.00 H new ATOM 0 HD11 ILE A 3 40.322 48.500 22.382 1.00 0.00 H new ATOM 0 HD12 ILE A 3 40.404 48.457 24.159 1.00 0.00 H new ATOM 0 HD13 ILE A 3 38.856 48.165 23.332 1.00 0.00 H new ATOM 56 N PHE A 4 40.770 52.379 26.023 1.00 0.00 N ATOM 57 CA PHE A 4 42.144 52.755 26.287 1.00 0.00 C ATOM 58 C PHE A 4 43.115 51.580 26.158 1.00 0.00 C ATOM 59 O PHE A 4 42.733 50.420 26.297 1.00 0.00 O ATOM 60 CB PHE A 4 42.244 53.388 27.672 1.00 0.00 C ATOM 61 CG PHE A 4 41.428 54.641 27.883 1.00 0.00 C ATOM 62 CD1 PHE A 4 41.726 55.808 27.169 1.00 0.00 C ATOM 63 CD2 PHE A 4 40.388 54.650 28.820 1.00 0.00 C ATOM 64 CE1 PHE A 4 40.984 56.976 27.386 1.00 0.00 C ATOM 65 CE2 PHE A 4 39.657 55.821 29.050 1.00 0.00 C ATOM 66 CZ PHE A 4 39.949 56.984 28.329 1.00 0.00 C ATOM 0 H PHE A 4 40.373 51.783 26.750 1.00 0.00 H new ATOM 0 HA PHE A 4 42.438 53.480 25.528 1.00 0.00 H new ATOM 0 HB2 PHE A 4 41.937 52.649 28.412 1.00 0.00 H new ATOM 0 HB3 PHE A 4 43.290 53.621 27.869 1.00 0.00 H new ATOM 0 HD1 PHE A 4 42.531 55.808 26.449 1.00 0.00 H new ATOM 0 HD2 PHE A 4 40.149 53.750 29.367 1.00 0.00 H new ATOM 0 HE1 PHE A 4 41.210 57.871 26.826 1.00 0.00 H new ATOM 0 HE2 PHE A 4 38.866 55.827 29.785 1.00 0.00 H new ATOM 0 HZ PHE A 4 39.378 57.885 28.499 1.00 0.00 H new ATOM 76 N VAL A 5 44.394 51.874 25.942 1.00 0.00 N ATOM 77 CA VAL A 5 45.490 50.929 26.013 1.00 0.00 C ATOM 78 C VAL A 5 46.645 51.527 26.817 1.00 0.00 C ATOM 79 O VAL A 5 47.164 52.585 26.471 1.00 0.00 O ATOM 80 CB VAL A 5 45.974 50.481 24.636 1.00 0.00 C ATOM 81 CG1 VAL A 5 46.906 49.278 24.748 1.00 0.00 C ATOM 82 CG2 VAL A 5 44.844 50.107 23.682 1.00 0.00 C ATOM 0 H VAL A 5 44.701 52.817 25.703 1.00 0.00 H new ATOM 0 HA VAL A 5 45.115 50.039 26.518 1.00 0.00 H new ATOM 0 HB VAL A 5 46.496 51.346 24.227 1.00 0.00 H new ATOM 0 HG11 VAL A 5 47.236 48.979 23.753 1.00 0.00 H new ATOM 0 HG12 VAL A 5 47.773 49.544 25.353 1.00 0.00 H new ATOM 0 HG13 VAL A 5 46.376 48.450 25.218 1.00 0.00 H new ATOM 0 HG21 VAL A 5 45.263 49.799 22.724 1.00 0.00 H new ATOM 0 HG22 VAL A 5 44.267 49.286 24.106 1.00 0.00 H new ATOM 0 HG23 VAL A 5 44.193 50.969 23.533 1.00 0.00 H new ATOM 92 N LYS A 6 47.058 50.842 27.879 1.00 0.00 N ATOM 93 CA LYS A 6 48.168 51.202 28.740 1.00 0.00 C ATOM 94 C LYS A 6 49.446 50.480 28.310 1.00 0.00 C ATOM 95 O LYS A 6 49.489 49.252 28.288 1.00 0.00 O ATOM 96 CB LYS A 6 47.792 50.894 30.186 1.00 0.00 C ATOM 97 CG LYS A 6 48.862 51.199 31.230 1.00 0.00 C ATOM 98 CD LYS A 6 49.362 52.640 31.280 1.00 0.00 C ATOM 99 CE LYS A 6 48.298 53.669 31.655 1.00 0.00 C ATOM 100 NZ LYS A 6 47.999 53.669 33.096 1.00 0.00 N ATOM 0 H LYS A 6 46.601 49.978 28.173 1.00 0.00 H new ATOM 0 HA LYS A 6 48.372 52.269 28.655 1.00 0.00 H new ATOM 0 HB2 LYS A 6 46.895 51.460 30.437 1.00 0.00 H new ATOM 0 HB3 LYS A 6 47.533 49.838 30.257 1.00 0.00 H new ATOM 0 HG2 LYS A 6 48.467 50.939 32.212 1.00 0.00 H new ATOM 0 HG3 LYS A 6 49.715 50.546 31.047 1.00 0.00 H new ATOM 0 HD2 LYS A 6 50.179 52.703 31.999 1.00 0.00 H new ATOM 0 HD3 LYS A 6 49.774 52.902 30.306 1.00 0.00 H new ATOM 0 HE2 LYS A 6 48.636 54.662 31.357 1.00 0.00 H new ATOM 0 HE3 LYS A 6 47.384 53.462 31.097 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 47.272 54.384 33.300 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 47.651 52.731 33.378 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 48.863 53.893 33.630 1.00 0.00 H new ATOM 168 N LYS A 11 52.388 55.330 29.365 1.00 0.00 N ATOM 169 CA LYS A 11 51.535 55.923 28.354 1.00 0.00 C ATOM 170 C LYS A 11 50.150 55.278 28.263 1.00 0.00 C ATOM 171 O LYS A 11 50.039 54.083 28.001 1.00 0.00 O ATOM 172 CB LYS A 11 52.259 55.870 27.011 1.00 0.00 C ATOM 173 CG LYS A 11 51.505 56.500 25.843 1.00 0.00 C ATOM 174 CD LYS A 11 51.273 58.005 25.944 1.00 0.00 C ATOM 175 CE LYS A 11 52.546 58.842 26.032 1.00 0.00 C ATOM 176 NZ LYS A 11 53.437 58.646 24.878 1.00 0.00 N ATOM 0 HA LYS A 11 51.346 56.957 28.643 1.00 0.00 H new ATOM 0 HB2 LYS A 11 53.221 56.371 27.115 1.00 0.00 H new ATOM 0 HB3 LYS A 11 52.467 54.828 26.769 1.00 0.00 H new ATOM 0 HG2 LYS A 11 52.057 56.296 24.925 1.00 0.00 H new ATOM 0 HG3 LYS A 11 50.538 56.007 25.750 1.00 0.00 H new ATOM 0 HD2 LYS A 11 50.700 58.330 25.075 1.00 0.00 H new ATOM 0 HD3 LYS A 11 50.661 58.206 26.823 1.00 0.00 H new ATOM 0 HE2 LYS A 11 52.278 59.896 26.104 1.00 0.00 H new ATOM 0 HE3 LYS A 11 53.081 58.586 26.946 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 54.269 59.263 24.973 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 53.745 57.653 24.842 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 52.928 58.883 24.002 1.00 0.00 H new ATOM 190 N THR A 12 49.096 56.082 28.362 1.00 0.00 N ATOM 191 CA THR A 12 47.772 55.753 27.871 1.00 0.00 C ATOM 192 C THR A 12 47.615 56.242 26.429 1.00 0.00 C ATOM 193 O THR A 12 47.960 57.383 26.131 1.00 0.00 O ATOM 194 CB THR A 12 46.686 56.354 28.759 1.00 0.00 C ATOM 195 OG1 THR A 12 46.708 55.778 30.046 1.00 0.00 O ATOM 196 CG2 THR A 12 45.271 56.149 28.227 1.00 0.00 C ATOM 0 H THR A 12 49.146 57.003 28.798 1.00 0.00 H new ATOM 0 HA THR A 12 47.658 54.669 27.896 1.00 0.00 H new ATOM 0 HB THR A 12 46.914 57.420 28.779 1.00 0.00 H new ATOM 0 HG1 THR A 12 46.004 56.181 30.597 1.00 0.00 H new ATOM 0 HG21 THR A 12 44.555 56.603 28.912 1.00 0.00 H new ATOM 0 HG22 THR A 12 45.180 56.615 27.246 1.00 0.00 H new ATOM 0 HG23 THR A 12 45.065 55.082 28.143 1.00 0.00 H new ATOM 204 N ILE A 13 47.047 55.422 25.550 1.00 0.00 N ATOM 205 CA ILE A 13 46.534 55.809 24.252 1.00 0.00 C ATOM 206 C ILE A 13 45.058 55.426 24.125 1.00 0.00 C ATOM 207 O ILE A 13 44.587 54.545 24.839 1.00 0.00 O ATOM 208 CB ILE A 13 47.365 55.243 23.104 1.00 0.00 C ATOM 209 CG1 ILE A 13 47.293 53.721 23.017 1.00 0.00 C ATOM 210 CG2 ILE A 13 48.803 55.749 23.175 1.00 0.00 C ATOM 211 CD1 ILE A 13 48.062 53.116 21.846 1.00 0.00 C ATOM 0 H ILE A 13 46.929 54.426 25.737 1.00 0.00 H new ATOM 0 HA ILE A 13 46.614 56.893 24.178 1.00 0.00 H new ATOM 0 HB ILE A 13 46.927 55.612 22.177 1.00 0.00 H new ATOM 0 HG12 ILE A 13 47.678 53.298 23.945 1.00 0.00 H new ATOM 0 HG13 ILE A 13 46.247 53.423 22.941 1.00 0.00 H new ATOM 0 HG21 ILE A 13 49.377 55.333 22.347 1.00 0.00 H new ATOM 0 HG22 ILE A 13 48.809 56.837 23.110 1.00 0.00 H new ATOM 0 HG23 ILE A 13 49.251 55.439 24.119 1.00 0.00 H new ATOM 0 HD11 ILE A 13 47.956 52.031 21.862 1.00 0.00 H new ATOM 0 HD12 ILE A 13 47.664 53.506 20.909 1.00 0.00 H new ATOM 0 HD13 ILE A 13 49.117 53.378 21.929 1.00 0.00 H new ATOM 223 N THR A 14 44.339 56.048 23.195 1.00 0.00 N ATOM 224 CA THR A 14 42.998 55.644 22.821 1.00 0.00 C ATOM 225 C THR A 14 43.008 54.664 21.645 1.00 0.00 C ATOM 226 O THR A 14 43.836 54.781 20.746 1.00 0.00 O ATOM 227 CB THR A 14 42.107 56.823 22.443 1.00 0.00 C ATOM 228 OG1 THR A 14 42.739 57.636 21.479 1.00 0.00 O ATOM 229 CG2 THR A 14 41.742 57.684 23.650 1.00 0.00 C ATOM 0 H THR A 14 44.681 56.857 22.676 1.00 0.00 H new ATOM 0 HA THR A 14 42.591 55.162 23.710 1.00 0.00 H new ATOM 0 HB THR A 14 41.191 56.399 22.033 1.00 0.00 H new ATOM 0 HG1 THR A 14 42.152 58.386 21.248 1.00 0.00 H new ATOM 0 HG21 THR A 14 41.107 58.510 23.329 1.00 0.00 H new ATOM 0 HG22 THR A 14 41.207 57.078 24.381 1.00 0.00 H new ATOM 0 HG23 THR A 14 42.651 58.080 24.103 1.00 0.00 H new ATOM 237 N LEU A 15 42.044 53.748 21.620 1.00 0.00 N ATOM 238 CA LEU A 15 41.736 52.906 20.482 1.00 0.00 C ATOM 239 C LEU A 15 40.233 52.932 20.203 1.00 0.00 C ATOM 240 O LEU A 15 39.440 53.147 21.117 1.00 0.00 O ATOM 241 CB LEU A 15 42.262 51.496 20.733 1.00 0.00 C ATOM 242 CG LEU A 15 42.805 50.793 19.491 1.00 0.00 C ATOM 243 CD1 LEU A 15 44.146 51.376 19.056 1.00 0.00 C ATOM 244 CD2 LEU A 15 43.017 49.310 19.780 1.00 0.00 C ATOM 0 H LEU A 15 41.439 53.570 22.422 1.00 0.00 H new ATOM 0 HA LEU A 15 42.232 53.285 19.588 1.00 0.00 H new ATOM 0 HB2 LEU A 15 43.052 51.545 21.482 1.00 0.00 H new ATOM 0 HB3 LEU A 15 41.459 50.892 21.155 1.00 0.00 H new ATOM 0 HG LEU A 15 42.072 50.936 18.697 1.00 0.00 H new ATOM 0 HD11 LEU A 15 44.501 50.850 18.169 1.00 0.00 H new ATOM 0 HD12 LEU A 15 44.025 52.435 18.826 1.00 0.00 H new ATOM 0 HD13 LEU A 15 44.872 51.260 19.861 1.00 0.00 H new ATOM 0 HD21 LEU A 15 43.404 48.817 18.888 1.00 0.00 H new ATOM 0 HD22 LEU A 15 43.731 49.197 20.596 1.00 0.00 H new ATOM 0 HD23 LEU A 15 42.068 48.855 20.062 1.00 0.00 H new ATOM 256 N GLU A 16 39.828 52.721 18.953 1.00 0.00 N ATOM 257 CA GLU A 16 38.440 52.680 18.542 1.00 0.00 C ATOM 258 C GLU A 16 38.157 51.399 17.754 1.00 0.00 C ATOM 259 O GLU A 16 38.892 51.043 16.835 1.00 0.00 O ATOM 260 CB GLU A 16 38.092 53.956 17.781 1.00 0.00 C ATOM 261 CG GLU A 16 36.635 54.392 17.912 1.00 0.00 C ATOM 262 CD GLU A 16 35.635 53.491 17.185 1.00 0.00 C ATOM 263 OE1 GLU A 16 34.502 53.326 17.689 1.00 0.00 O ATOM 264 OE2 GLU A 16 35.949 52.980 16.089 1.00 0.00 O ATOM 0 H GLU A 16 40.479 52.571 18.182 1.00 0.00 H new ATOM 0 HA GLU A 16 37.788 52.647 19.415 1.00 0.00 H new ATOM 0 HB2 GLU A 16 38.733 54.763 18.137 1.00 0.00 H new ATOM 0 HB3 GLU A 16 38.321 53.809 16.726 1.00 0.00 H new ATOM 0 HG2 GLU A 16 36.373 54.425 18.969 1.00 0.00 H new ATOM 0 HG3 GLU A 16 36.537 55.407 17.527 1.00 0.00 H new ATOM 271 N VAL A 17 37.139 50.664 18.193 1.00 0.00 N ATOM 272 CA VAL A 17 36.882 49.273 17.883 1.00 0.00 C ATOM 273 C VAL A 17 35.385 48.965 17.973 1.00 0.00 C ATOM 274 O VAL A 17 34.644 49.703 18.620 1.00 0.00 O ATOM 275 CB VAL A 17 37.623 48.354 18.851 1.00 0.00 C ATOM 276 CG1 VAL A 17 39.126 48.318 18.590 1.00 0.00 C ATOM 277 CG2 VAL A 17 37.396 48.726 20.313 1.00 0.00 C ATOM 0 H VAL A 17 36.430 51.055 18.814 1.00 0.00 H new ATOM 0 HA VAL A 17 37.235 49.097 16.867 1.00 0.00 H new ATOM 0 HB VAL A 17 37.201 47.366 18.667 1.00 0.00 H new ATOM 0 HG11 VAL A 17 39.604 47.650 19.306 1.00 0.00 H new ATOM 0 HG12 VAL A 17 39.311 47.957 17.578 1.00 0.00 H new ATOM 0 HG13 VAL A 17 39.538 49.321 18.699 1.00 0.00 H new ATOM 0 HG21 VAL A 17 37.948 48.038 20.953 1.00 0.00 H new ATOM 0 HG22 VAL A 17 37.745 49.744 20.488 1.00 0.00 H new ATOM 0 HG23 VAL A 17 36.333 48.663 20.544 1.00 0.00 H new ATOM 287 N GLU A 18 34.926 47.854 17.405 1.00 0.00 N ATOM 288 CA GLU A 18 33.629 47.278 17.695 1.00 0.00 C ATOM 289 C GLU A 18 33.771 46.102 18.664 1.00 0.00 C ATOM 290 O GLU A 18 34.812 45.448 18.650 1.00 0.00 O ATOM 291 CB GLU A 18 32.930 46.819 16.418 1.00 0.00 C ATOM 292 CG GLU A 18 32.754 47.888 15.344 1.00 0.00 C ATOM 293 CD GLU A 18 32.037 49.153 15.818 1.00 0.00 C ATOM 294 OE1 GLU A 18 30.975 49.057 16.470 1.00 0.00 O ATOM 295 OE2 GLU A 18 32.517 50.257 15.480 1.00 0.00 O ATOM 0 H GLU A 18 35.460 47.323 16.717 1.00 0.00 H new ATOM 0 HA GLU A 18 33.018 48.052 18.160 1.00 0.00 H new ATOM 0 HB2 GLU A 18 33.497 45.991 15.992 1.00 0.00 H new ATOM 0 HB3 GLU A 18 31.947 46.430 16.683 1.00 0.00 H new ATOM 0 HG2 GLU A 18 33.736 48.165 14.961 1.00 0.00 H new ATOM 0 HG3 GLU A 18 32.196 47.460 14.511 1.00 0.00 H new ATOM 302 N PRO A 19 32.761 45.730 19.446 1.00 0.00 N ATOM 303 CA PRO A 19 32.824 44.565 20.305 1.00 0.00 C ATOM 304 C PRO A 19 33.056 43.230 19.594 1.00 0.00 C ATOM 305 O PRO A 19 33.397 42.239 20.237 1.00 0.00 O ATOM 306 CB PRO A 19 31.519 44.554 21.096 1.00 0.00 C ATOM 307 CG PRO A 19 31.041 46.002 21.042 1.00 0.00 C ATOM 308 CD PRO A 19 31.535 46.466 19.675 1.00 0.00 C ATOM 0 HA PRO A 19 33.705 44.654 20.941 1.00 0.00 H new ATOM 0 HB2 PRO A 19 30.789 43.876 20.653 1.00 0.00 H new ATOM 0 HB3 PRO A 19 31.678 44.224 22.123 1.00 0.00 H new ATOM 0 HG2 PRO A 19 29.957 46.074 21.127 1.00 0.00 H new ATOM 0 HG3 PRO A 19 31.464 46.599 21.850 1.00 0.00 H new ATOM 0 HD2 PRO A 19 30.799 46.257 18.898 1.00 0.00 H new ATOM 0 HD3 PRO A 19 31.713 47.541 19.665 1.00 0.00 H new ATOM 316 N SER A 20 32.894 43.197 18.275 1.00 0.00 N ATOM 317 CA SER A 20 33.137 42.078 17.386 1.00 0.00 C ATOM 318 C SER A 20 34.524 42.061 16.743 1.00 0.00 C ATOM 319 O SER A 20 34.831 41.095 16.048 1.00 0.00 O ATOM 320 CB SER A 20 32.043 42.021 16.323 1.00 0.00 C ATOM 321 OG SER A 20 31.633 43.302 15.902 1.00 0.00 O ATOM 0 H SER A 20 32.564 44.017 17.766 1.00 0.00 H new ATOM 0 HA SER A 20 33.109 41.184 18.009 1.00 0.00 H new ATOM 0 HB2 SER A 20 32.405 41.458 15.463 1.00 0.00 H new ATOM 0 HB3 SER A 20 31.184 41.480 16.719 1.00 0.00 H new ATOM 0 HG SER A 20 30.934 43.214 15.221 1.00 0.00 H new ATOM 327 N ASP A 21 35.378 43.060 16.951 1.00 0.00 N ATOM 328 CA ASP A 21 36.747 43.016 16.480 1.00 0.00 C ATOM 329 C ASP A 21 37.549 41.933 17.206 1.00 0.00 C ATOM 330 O ASP A 21 37.372 41.713 18.402 1.00 0.00 O ATOM 331 CB ASP A 21 37.428 44.374 16.621 1.00 0.00 C ATOM 332 CG ASP A 21 37.082 45.350 15.494 1.00 0.00 C ATOM 333 OD1 ASP A 21 37.068 44.949 14.310 1.00 0.00 O ATOM 334 OD2 ASP A 21 36.850 46.549 15.765 1.00 0.00 O ATOM 0 H ASP A 21 35.136 43.916 17.449 1.00 0.00 H new ATOM 0 HA ASP A 21 36.717 42.763 15.420 1.00 0.00 H new ATOM 0 HB2 ASP A 21 37.143 44.817 17.575 1.00 0.00 H new ATOM 0 HB3 ASP A 21 38.508 44.229 16.647 1.00 0.00 H new ATOM 339 N THR A 22 38.446 41.266 16.486 1.00 0.00 N ATOM 340 CA THR A 22 39.342 40.270 17.038 1.00 0.00 C ATOM 341 C THR A 22 40.582 40.896 17.678 1.00 0.00 C ATOM 342 O THR A 22 40.936 42.036 17.385 1.00 0.00 O ATOM 343 CB THR A 22 39.796 39.227 16.021 1.00 0.00 C ATOM 344 OG1 THR A 22 40.660 39.797 15.063 1.00 0.00 O ATOM 345 CG2 THR A 22 38.664 38.527 15.274 1.00 0.00 C ATOM 0 H THR A 22 38.568 41.410 15.484 1.00 0.00 H new ATOM 0 HA THR A 22 38.747 39.769 17.802 1.00 0.00 H new ATOM 0 HB THR A 22 40.306 38.474 16.622 1.00 0.00 H new ATOM 0 HG1 THR A 22 40.150 40.392 14.475 1.00 0.00 H new ATOM 0 HG21 THR A 22 39.083 37.804 14.574 1.00 0.00 H new ATOM 0 HG22 THR A 22 38.022 38.011 15.988 1.00 0.00 H new ATOM 0 HG23 THR A 22 38.078 39.265 14.726 1.00 0.00 H new ATOM 353 N ILE A 23 41.324 40.126 18.469 1.00 0.00 N ATOM 354 CA ILE A 23 42.631 40.521 18.955 1.00 0.00 C ATOM 355 C ILE A 23 43.603 40.802 17.807 1.00 0.00 C ATOM 356 O ILE A 23 44.430 41.703 17.931 1.00 0.00 O ATOM 357 CB ILE A 23 43.135 39.497 19.969 1.00 0.00 C ATOM 358 CG1 ILE A 23 42.673 39.806 21.391 1.00 0.00 C ATOM 359 CG2 ILE A 23 44.655 39.372 20.030 1.00 0.00 C ATOM 360 CD1 ILE A 23 41.165 39.853 21.617 1.00 0.00 C ATOM 0 H ILE A 23 41.028 39.204 18.790 1.00 0.00 H new ATOM 0 HA ILE A 23 42.552 41.472 19.482 1.00 0.00 H new ATOM 0 HB ILE A 23 42.706 38.563 19.606 1.00 0.00 H new ATOM 0 HG12 ILE A 23 43.096 39.055 22.059 1.00 0.00 H new ATOM 0 HG13 ILE A 23 43.093 40.768 21.686 1.00 0.00 H new ATOM 0 HG21 ILE A 23 44.929 38.624 20.774 1.00 0.00 H new ATOM 0 HG22 ILE A 23 45.035 39.069 19.054 1.00 0.00 H new ATOM 0 HG23 ILE A 23 45.088 40.334 20.305 1.00 0.00 H new ATOM 0 HD11 ILE A 23 40.961 40.081 22.663 1.00 0.00 H new ATOM 0 HD12 ILE A 23 40.726 40.625 20.985 1.00 0.00 H new ATOM 0 HD13 ILE A 23 40.729 38.887 21.364 1.00 0.00 H new ATOM 372 N GLU A 24 43.479 40.156 16.652 1.00 0.00 N ATOM 373 CA GLU A 24 44.288 40.484 15.495 1.00 0.00 C ATOM 374 C GLU A 24 43.932 41.837 14.875 1.00 0.00 C ATOM 375 O GLU A 24 44.828 42.556 14.440 1.00 0.00 O ATOM 376 CB GLU A 24 44.220 39.388 14.436 1.00 0.00 C ATOM 377 CG GLU A 24 44.810 38.082 14.960 1.00 0.00 C ATOM 378 CD GLU A 24 45.021 37.058 13.843 1.00 0.00 C ATOM 379 OE1 GLU A 24 44.397 35.977 13.886 1.00 0.00 O ATOM 380 OE2 GLU A 24 45.807 37.345 12.915 1.00 0.00 O ATOM 0 H GLU A 24 42.817 39.395 16.497 1.00 0.00 H new ATOM 0 HA GLU A 24 45.311 40.558 15.864 1.00 0.00 H new ATOM 0 HB2 GLU A 24 43.184 39.229 14.138 1.00 0.00 H new ATOM 0 HB3 GLU A 24 44.762 39.704 13.545 1.00 0.00 H new ATOM 0 HG2 GLU A 24 45.762 38.285 15.450 1.00 0.00 H new ATOM 0 HG3 GLU A 24 44.146 37.662 15.716 1.00 0.00 H new ATOM 387 N ASN A 25 42.658 42.222 14.906 1.00 0.00 N ATOM 388 CA ASN A 25 42.234 43.554 14.523 1.00 0.00 C ATOM 389 C ASN A 25 42.765 44.607 15.497 1.00 0.00 C ATOM 390 O ASN A 25 43.199 45.675 15.069 1.00 0.00 O ATOM 391 CB ASN A 25 40.715 43.614 14.390 1.00 0.00 C ATOM 392 CG ASN A 25 40.143 42.637 13.361 1.00 0.00 C ATOM 393 OD1 ASN A 25 39.387 41.726 13.691 1.00 0.00 O ATOM 394 ND2 ASN A 25 40.503 42.779 12.089 1.00 0.00 N ATOM 0 H ASN A 25 41.894 41.613 15.199 1.00 0.00 H new ATOM 0 HA ASN A 25 42.661 43.783 13.547 1.00 0.00 H new ATOM 0 HB2 ASN A 25 40.267 43.407 15.362 1.00 0.00 H new ATOM 0 HB3 ASN A 25 40.424 44.628 14.115 1.00 0.00 H new ATOM 0 HD21 ASN A 25 40.152 42.131 11.384 1.00 0.00 H new ATOM 0 HD22 ASN A 25 41.131 43.536 11.818 1.00 0.00 H new ATOM 401 N VAL A 26 42.830 44.309 16.791 1.00 0.00 N ATOM 402 CA VAL A 26 43.461 45.165 17.775 1.00 0.00 C ATOM 403 C VAL A 26 44.961 45.304 17.509 1.00 0.00 C ATOM 404 O VAL A 26 45.455 46.428 17.457 1.00 0.00 O ATOM 405 CB VAL A 26 43.204 44.681 19.200 1.00 0.00 C ATOM 406 CG1 VAL A 26 43.913 45.529 20.252 1.00 0.00 C ATOM 407 CG2 VAL A 26 41.716 44.721 19.537 1.00 0.00 C ATOM 0 H VAL A 26 42.439 43.453 17.185 1.00 0.00 H new ATOM 0 HA VAL A 26 43.006 46.151 17.678 1.00 0.00 H new ATOM 0 HB VAL A 26 43.591 43.663 19.226 1.00 0.00 H new ATOM 0 HG11 VAL A 26 43.693 45.136 21.245 1.00 0.00 H new ATOM 0 HG12 VAL A 26 44.989 45.498 20.080 1.00 0.00 H new ATOM 0 HG13 VAL A 26 43.565 46.560 20.184 1.00 0.00 H new ATOM 0 HG21 VAL A 26 41.565 44.371 20.558 1.00 0.00 H new ATOM 0 HG22 VAL A 26 41.350 45.744 19.446 1.00 0.00 H new ATOM 0 HG23 VAL A 26 41.169 44.077 18.848 1.00 0.00 H new ATOM 417 N LYS A 27 45.673 44.207 17.267 1.00 0.00 N ATOM 418 CA LYS A 27 47.087 44.234 16.949 1.00 0.00 C ATOM 419 C LYS A 27 47.387 45.055 15.694 1.00 0.00 C ATOM 420 O LYS A 27 48.347 45.822 15.695 1.00 0.00 O ATOM 421 CB LYS A 27 47.645 42.819 16.819 1.00 0.00 C ATOM 422 CG LYS A 27 47.803 42.092 18.152 1.00 0.00 C ATOM 423 CD LYS A 27 48.271 40.652 17.963 1.00 0.00 C ATOM 424 CE LYS A 27 48.571 40.006 19.313 1.00 0.00 C ATOM 425 NZ LYS A 27 48.889 38.578 19.171 1.00 0.00 N ATOM 0 H LYS A 27 45.275 43.268 17.288 1.00 0.00 H new ATOM 0 HA LYS A 27 47.588 44.729 17.781 1.00 0.00 H new ATOM 0 HB2 LYS A 27 46.986 42.237 16.175 1.00 0.00 H new ATOM 0 HB3 LYS A 27 48.615 42.865 16.324 1.00 0.00 H new ATOM 0 HG2 LYS A 27 48.519 42.628 18.775 1.00 0.00 H new ATOM 0 HG3 LYS A 27 46.851 42.098 18.684 1.00 0.00 H new ATOM 0 HD2 LYS A 27 47.504 40.079 17.442 1.00 0.00 H new ATOM 0 HD3 LYS A 27 49.163 40.633 17.337 1.00 0.00 H new ATOM 0 HE2 LYS A 27 49.408 40.520 19.785 1.00 0.00 H new ATOM 0 HE3 LYS A 27 47.711 40.124 19.973 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 48.871 38.124 20.106 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 48.186 38.126 18.552 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 49.836 38.473 18.754 1.00 0.00 H new ATOM 439 N ALA A 28 46.550 44.960 14.664 1.00 0.00 N ATOM 440 CA ALA A 28 46.674 45.741 13.450 1.00 0.00 C ATOM 441 C ALA A 28 46.406 47.231 13.666 1.00 0.00 C ATOM 442 O ALA A 28 47.144 48.064 13.145 1.00 0.00 O ATOM 443 CB ALA A 28 45.743 45.157 12.392 1.00 0.00 C ATOM 0 H ALA A 28 45.753 44.324 14.656 1.00 0.00 H new ATOM 0 HA ALA A 28 47.708 45.679 13.111 1.00 0.00 H new ATOM 0 HB1 ALA A 28 45.827 45.737 11.473 1.00 0.00 H new ATOM 0 HB2 ALA A 28 46.021 44.122 12.195 1.00 0.00 H new ATOM 0 HB3 ALA A 28 44.715 45.195 12.751 1.00 0.00 H new ATOM 449 N LYS A 29 45.418 47.585 14.484 1.00 0.00 N ATOM 450 CA LYS A 29 45.115 48.945 14.880 1.00 0.00 C ATOM 451 C LYS A 29 46.220 49.572 15.732 1.00 0.00 C ATOM 452 O LYS A 29 46.469 50.769 15.613 1.00 0.00 O ATOM 453 CB LYS A 29 43.790 48.975 15.638 1.00 0.00 C ATOM 454 CG LYS A 29 42.591 48.914 14.698 1.00 0.00 C ATOM 455 CD LYS A 29 41.286 48.681 15.453 1.00 0.00 C ATOM 456 CE LYS A 29 40.086 48.821 14.520 1.00 0.00 C ATOM 457 NZ LYS A 29 39.748 50.235 14.294 1.00 0.00 N ATOM 0 H LYS A 29 44.786 46.902 14.901 1.00 0.00 H new ATOM 0 HA LYS A 29 45.041 49.540 13.969 1.00 0.00 H new ATOM 0 HB2 LYS A 29 43.750 48.135 16.331 1.00 0.00 H new ATOM 0 HB3 LYS A 29 43.735 49.885 16.236 1.00 0.00 H new ATOM 0 HG2 LYS A 29 42.523 49.845 14.135 1.00 0.00 H new ATOM 0 HG3 LYS A 29 42.739 48.114 13.973 1.00 0.00 H new ATOM 0 HD2 LYS A 29 41.291 47.686 15.899 1.00 0.00 H new ATOM 0 HD3 LYS A 29 41.201 49.396 16.271 1.00 0.00 H new ATOM 0 HE2 LYS A 29 40.306 48.340 13.567 1.00 0.00 H new ATOM 0 HE3 LYS A 29 39.227 48.303 14.948 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 38.996 50.302 13.579 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 39.418 50.660 15.184 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 40.591 50.744 13.959 1.00 0.00 H new ATOM 471 N ILE A 30 46.902 48.778 16.554 1.00 0.00 N ATOM 472 CA ILE A 30 48.072 49.181 17.310 1.00 0.00 C ATOM 473 C ILE A 30 49.297 49.313 16.403 1.00 0.00 C ATOM 474 O ILE A 30 50.051 50.269 16.563 1.00 0.00 O ATOM 475 CB ILE A 30 48.270 48.255 18.507 1.00 0.00 C ATOM 476 CG1 ILE A 30 47.156 48.488 19.524 1.00 0.00 C ATOM 477 CG2 ILE A 30 49.632 48.450 19.167 1.00 0.00 C ATOM 478 CD1 ILE A 30 47.136 47.498 20.685 1.00 0.00 C ATOM 0 H ILE A 30 46.642 47.805 16.713 1.00 0.00 H new ATOM 0 HA ILE A 30 47.918 50.178 17.722 1.00 0.00 H new ATOM 0 HB ILE A 30 48.232 47.228 18.143 1.00 0.00 H new ATOM 0 HG12 ILE A 30 47.254 49.496 19.926 1.00 0.00 H new ATOM 0 HG13 ILE A 30 46.197 48.442 19.009 1.00 0.00 H new ATOM 0 HG21 ILE A 30 49.727 47.770 20.013 1.00 0.00 H new ATOM 0 HG22 ILE A 30 50.420 48.241 18.444 1.00 0.00 H new ATOM 0 HG23 ILE A 30 49.723 49.479 19.516 1.00 0.00 H new ATOM 0 HD11 ILE A 30 46.312 47.741 21.356 1.00 0.00 H new ATOM 0 HD12 ILE A 30 47.004 46.487 20.299 1.00 0.00 H new ATOM 0 HD13 ILE A 30 48.078 47.558 21.230 1.00 0.00 H new ATOM 490 N GLN A 31 49.476 48.473 15.387 1.00 0.00 N ATOM 491 CA GLN A 31 50.502 48.689 14.389 1.00 0.00 C ATOM 492 C GLN A 31 50.258 49.987 13.617 1.00 0.00 C ATOM 493 O GLN A 31 51.205 50.711 13.317 1.00 0.00 O ATOM 494 CB GLN A 31 50.608 47.487 13.455 1.00 0.00 C ATOM 495 CG GLN A 31 51.860 47.557 12.586 1.00 0.00 C ATOM 496 CD GLN A 31 52.002 46.381 11.617 1.00 0.00 C ATOM 497 OE1 GLN A 31 51.037 45.733 11.216 1.00 0.00 O ATOM 498 NE2 GLN A 31 53.217 46.067 11.178 1.00 0.00 N ATOM 0 H GLN A 31 48.916 47.633 15.239 1.00 0.00 H new ATOM 0 HA GLN A 31 51.459 48.795 14.901 1.00 0.00 H new ATOM 0 HB2 GLN A 31 50.624 46.569 14.043 1.00 0.00 H new ATOM 0 HB3 GLN A 31 49.725 47.442 12.818 1.00 0.00 H new ATOM 0 HG2 GLN A 31 51.845 48.486 12.016 1.00 0.00 H new ATOM 0 HG3 GLN A 31 52.738 47.593 13.231 1.00 0.00 H new ATOM 0 HE21 GLN A 31 54.028 46.595 11.501 1.00 0.00 H new ATOM 0 HE22 GLN A 31 53.338 45.298 10.518 1.00 0.00 H new ATOM 507 N ASP A 32 49.005 50.339 13.339 1.00 0.00 N ATOM 508 CA ASP A 32 48.667 51.613 12.737 1.00 0.00 C ATOM 509 C ASP A 32 48.984 52.801 13.647 1.00 0.00 C ATOM 510 O ASP A 32 49.641 53.741 13.202 1.00 0.00 O ATOM 511 CB ASP A 32 47.200 51.626 12.315 1.00 0.00 C ATOM 512 CG ASP A 32 46.891 52.814 11.402 1.00 0.00 C ATOM 513 OD1 ASP A 32 47.495 52.899 10.311 1.00 0.00 O ATOM 514 OD2 ASP A 32 46.007 53.628 11.746 1.00 0.00 O ATOM 0 H ASP A 32 48.199 49.743 13.528 1.00 0.00 H new ATOM 0 HA ASP A 32 49.294 51.726 11.853 1.00 0.00 H new ATOM 0 HB2 ASP A 32 46.960 50.697 11.798 1.00 0.00 H new ATOM 0 HB3 ASP A 32 46.566 51.671 13.200 1.00 0.00 H new ATOM 519 N LYS A 33 48.544 52.776 14.902 1.00 0.00 N ATOM 520 CA LYS A 33 48.608 53.923 15.784 1.00 0.00 C ATOM 521 C LYS A 33 49.922 54.090 16.551 1.00 0.00 C ATOM 522 O LYS A 33 50.258 55.219 16.903 1.00 0.00 O ATOM 523 CB LYS A 33 47.376 53.916 16.683 1.00 0.00 C ATOM 524 CG LYS A 33 47.139 55.264 17.356 1.00 0.00 C ATOM 525 CD LYS A 33 45.755 55.360 17.992 1.00 0.00 C ATOM 526 CE LYS A 33 45.580 56.763 18.563 1.00 0.00 C ATOM 527 NZ LYS A 33 44.214 57.006 19.051 1.00 0.00 N ATOM 0 H LYS A 33 48.131 51.949 15.333 1.00 0.00 H new ATOM 0 HA LYS A 33 48.600 54.816 15.159 1.00 0.00 H new ATOM 0 HB2 LYS A 33 46.500 53.649 16.092 1.00 0.00 H new ATOM 0 HB3 LYS A 33 47.491 53.147 17.447 1.00 0.00 H new ATOM 0 HG2 LYS A 33 47.899 55.424 18.120 1.00 0.00 H new ATOM 0 HG3 LYS A 33 47.254 56.060 16.620 1.00 0.00 H new ATOM 0 HD2 LYS A 33 44.983 55.154 17.251 1.00 0.00 H new ATOM 0 HD3 LYS A 33 45.648 54.614 18.780 1.00 0.00 H new ATOM 0 HE2 LYS A 33 46.286 56.910 19.380 1.00 0.00 H new ATOM 0 HE3 LYS A 33 45.824 57.497 17.795 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 44.181 57.918 19.550 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 43.556 57.027 18.246 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 43.938 56.245 19.703 1.00 0.00 H new ATOM 541 N GLU A 34 50.678 53.020 16.781 1.00 0.00 N ATOM 542 CA GLU A 34 51.940 53.003 17.494 1.00 0.00 C ATOM 543 C GLU A 34 53.135 52.487 16.690 1.00 0.00 C ATOM 544 O GLU A 34 54.266 52.724 17.108 1.00 0.00 O ATOM 545 CB GLU A 34 51.786 52.196 18.780 1.00 0.00 C ATOM 546 CG GLU A 34 51.323 53.026 19.973 1.00 0.00 C ATOM 547 CD GLU A 34 52.469 53.847 20.567 1.00 0.00 C ATOM 548 OE1 GLU A 34 52.648 55.019 20.172 1.00 0.00 O ATOM 549 OE2 GLU A 34 53.226 53.321 21.412 1.00 0.00 O ATOM 0 H GLU A 34 50.406 52.093 16.454 1.00 0.00 H new ATOM 0 HA GLU A 34 52.173 54.046 17.707 1.00 0.00 H new ATOM 0 HB2 GLU A 34 51.071 51.391 18.610 1.00 0.00 H new ATOM 0 HB3 GLU A 34 52.741 51.729 19.022 1.00 0.00 H new ATOM 0 HG2 GLU A 34 50.519 53.694 19.662 1.00 0.00 H new ATOM 0 HG3 GLU A 34 50.912 52.367 20.738 1.00 0.00 H new ATOM 556 N GLY A 35 52.954 51.811 15.558 1.00 0.00 N ATOM 557 CA GLY A 35 54.056 51.372 14.727 1.00 0.00 C ATOM 558 C GLY A 35 54.850 50.177 15.261 1.00 0.00 C ATOM 559 O GLY A 35 56.051 50.096 15.014 1.00 0.00 O ATOM 0 H GLY A 35 52.035 51.555 15.197 1.00 0.00 H new ATOM 0 HA2 GLY A 35 53.666 51.115 13.742 1.00 0.00 H new ATOM 0 HA3 GLY A 35 54.741 52.209 14.590 1.00 0.00 H new ATOM 563 N ILE A 36 54.205 49.268 15.987 1.00 0.00 N ATOM 564 CA ILE A 36 54.781 48.058 16.538 1.00 0.00 C ATOM 565 C ILE A 36 54.175 46.819 15.876 1.00 0.00 C ATOM 566 O ILE A 36 52.957 46.669 15.924 1.00 0.00 O ATOM 567 CB ILE A 36 54.685 48.084 18.061 1.00 0.00 C ATOM 568 CG1 ILE A 36 55.391 46.917 18.742 1.00 0.00 C ATOM 569 CG2 ILE A 36 53.258 48.177 18.594 1.00 0.00 C ATOM 570 CD1 ILE A 36 56.913 46.993 18.661 1.00 0.00 C ATOM 0 H ILE A 36 53.216 49.366 16.215 1.00 0.00 H new ATOM 0 HA ILE A 36 55.845 48.005 16.308 1.00 0.00 H new ATOM 0 HB ILE A 36 55.207 49.005 18.319 1.00 0.00 H new ATOM 0 HG12 ILE A 36 55.092 46.884 19.790 1.00 0.00 H new ATOM 0 HG13 ILE A 36 55.057 45.985 18.286 1.00 0.00 H new ATOM 0 HG21 ILE A 36 53.277 48.190 19.684 1.00 0.00 H new ATOM 0 HG22 ILE A 36 52.792 49.092 18.228 1.00 0.00 H new ATOM 0 HG23 ILE A 36 52.685 47.315 18.252 1.00 0.00 H new ATOM 0 HD11 ILE A 36 57.348 46.131 19.166 1.00 0.00 H new ATOM 0 HD12 ILE A 36 57.222 46.995 17.616 1.00 0.00 H new ATOM 0 HD13 ILE A 36 57.258 47.908 19.143 1.00 0.00 H new ATOM 582 N PRO A 37 54.937 45.932 15.243 1.00 0.00 N ATOM 583 CA PRO A 37 54.390 44.798 14.526 1.00 0.00 C ATOM 584 C PRO A 37 53.618 43.788 15.376 1.00 0.00 C ATOM 585 O PRO A 37 54.051 43.503 16.491 1.00 0.00 O ATOM 586 CB PRO A 37 55.562 44.113 13.828 1.00 0.00 C ATOM 587 CG PRO A 37 56.582 45.235 13.665 1.00 0.00 C ATOM 588 CD PRO A 37 56.338 46.089 14.905 1.00 0.00 C ATOM 0 HA PRO A 37 53.641 45.180 13.832 1.00 0.00 H new ATOM 0 HB2 PRO A 37 55.960 43.292 14.424 1.00 0.00 H new ATOM 0 HB3 PRO A 37 55.268 43.695 12.865 1.00 0.00 H new ATOM 0 HG2 PRO A 37 57.602 44.853 13.630 1.00 0.00 H new ATOM 0 HG3 PRO A 37 56.421 45.799 12.746 1.00 0.00 H new ATOM 0 HD2 PRO A 37 56.974 45.767 15.729 1.00 0.00 H new ATOM 0 HD3 PRO A 37 56.575 47.135 14.709 1.00 0.00 H new ATOM 596 N PRO A 38 52.532 43.195 14.888 1.00 0.00 N ATOM 597 CA PRO A 38 51.722 42.239 15.617 1.00 0.00 C ATOM 598 C PRO A 38 52.487 41.081 16.261 1.00 0.00 C ATOM 599 O PRO A 38 52.221 40.753 17.416 1.00 0.00 O ATOM 600 CB PRO A 38 50.710 41.701 14.610 1.00 0.00 C ATOM 601 CG PRO A 38 50.481 42.901 13.696 1.00 0.00 C ATOM 602 CD PRO A 38 51.874 43.521 13.640 1.00 0.00 C ATOM 0 HA PRO A 38 51.270 42.753 16.465 1.00 0.00 H new ATOM 0 HB2 PRO A 38 51.100 40.843 14.063 1.00 0.00 H new ATOM 0 HB3 PRO A 38 49.788 41.378 15.094 1.00 0.00 H new ATOM 0 HG2 PRO A 38 50.127 42.602 12.710 1.00 0.00 H new ATOM 0 HG3 PRO A 38 49.742 43.591 14.104 1.00 0.00 H new ATOM 0 HD2 PRO A 38 52.437 43.129 12.793 1.00 0.00 H new ATOM 0 HD3 PRO A 38 51.811 44.601 13.508 1.00 0.00 H new ATOM 610 N ASP A 39 53.463 40.504 15.566 1.00 0.00 N ATOM 611 CA ASP A 39 54.155 39.308 15.997 1.00 0.00 C ATOM 612 C ASP A 39 55.105 39.527 17.178 1.00 0.00 C ATOM 613 O ASP A 39 55.716 38.580 17.667 1.00 0.00 O ATOM 614 CB ASP A 39 54.867 38.688 14.798 1.00 0.00 C ATOM 615 CG ASP A 39 55.241 37.219 15.016 1.00 0.00 C ATOM 616 OD1 ASP A 39 56.443 36.880 14.978 1.00 0.00 O ATOM 617 OD2 ASP A 39 54.316 36.387 15.143 1.00 0.00 O ATOM 0 H ASP A 39 53.796 40.866 14.673 1.00 0.00 H new ATOM 0 HA ASP A 39 53.406 38.615 16.381 1.00 0.00 H new ATOM 0 HB2 ASP A 39 54.225 38.767 13.921 1.00 0.00 H new ATOM 0 HB3 ASP A 39 55.770 39.259 14.584 1.00 0.00 H new ATOM 622 N GLN A 40 55.238 40.758 17.662 1.00 0.00 N ATOM 623 CA GLN A 40 55.960 41.094 18.873 1.00 0.00 C ATOM 624 C GLN A 40 55.135 41.851 19.915 1.00 0.00 C ATOM 625 O GLN A 40 55.689 42.318 20.906 1.00 0.00 O ATOM 626 CB GLN A 40 57.284 41.769 18.522 1.00 0.00 C ATOM 627 CG GLN A 40 57.127 43.174 17.944 1.00 0.00 C ATOM 628 CD GLN A 40 58.470 43.783 17.538 1.00 0.00 C ATOM 629 OE1 GLN A 40 58.756 43.985 16.360 1.00 0.00 O ATOM 630 NE2 GLN A 40 59.349 44.098 18.485 1.00 0.00 N ATOM 0 H GLN A 40 54.831 41.573 17.203 1.00 0.00 H new ATOM 0 HA GLN A 40 56.186 40.158 19.383 1.00 0.00 H new ATOM 0 HB2 GLN A 40 57.902 41.822 19.418 1.00 0.00 H new ATOM 0 HB3 GLN A 40 57.818 41.148 17.803 1.00 0.00 H new ATOM 0 HG2 GLN A 40 56.469 43.137 17.076 1.00 0.00 H new ATOM 0 HG3 GLN A 40 56.646 43.817 18.681 1.00 0.00 H new ATOM 0 HE21 GLN A 40 59.122 43.935 19.466 1.00 0.00 H new ATOM 0 HE22 GLN A 40 60.250 44.503 18.230 1.00 0.00 H new ATOM 639 N GLN A 41 53.821 41.955 19.731 1.00 0.00 N ATOM 640 CA GLN A 41 52.901 42.468 20.725 1.00 0.00 C ATOM 641 C GLN A 41 52.429 41.358 21.668 1.00 0.00 C ATOM 642 O GLN A 41 52.291 40.213 21.245 1.00 0.00 O ATOM 643 CB GLN A 41 51.688 43.106 20.054 1.00 0.00 C ATOM 644 CG GLN A 41 51.974 44.369 19.246 1.00 0.00 C ATOM 645 CD GLN A 41 50.713 44.927 18.583 1.00 0.00 C ATOM 646 OE1 GLN A 41 49.623 44.893 19.147 1.00 0.00 O ATOM 647 NE2 GLN A 41 50.781 45.465 17.368 1.00 0.00 N ATOM 0 H GLN A 41 53.362 41.676 18.864 1.00 0.00 H new ATOM 0 HA GLN A 41 53.434 43.221 21.306 1.00 0.00 H new ATOM 0 HB2 GLN A 41 51.230 42.369 19.394 1.00 0.00 H new ATOM 0 HB3 GLN A 41 50.953 43.346 20.823 1.00 0.00 H new ATOM 0 HG2 GLN A 41 52.405 45.127 19.900 1.00 0.00 H new ATOM 0 HG3 GLN A 41 52.718 44.148 18.481 1.00 0.00 H new ATOM 0 HE21 GLN A 41 51.674 45.506 16.878 1.00 0.00 H new ATOM 0 HE22 GLN A 41 49.940 45.837 16.927 1.00 0.00 H new ATOM 656 N ARG A 42 52.124 41.682 22.921 1.00 0.00 N ATOM 657 CA ARG A 42 51.350 40.878 23.845 1.00 0.00 C ATOM 658 C ARG A 42 50.248 41.726 24.483 1.00 0.00 C ATOM 659 O ARG A 42 50.547 42.731 25.124 1.00 0.00 O ATOM 660 CB ARG A 42 52.238 40.282 24.933 1.00 0.00 C ATOM 661 CG ARG A 42 53.219 39.238 24.409 1.00 0.00 C ATOM 662 CD ARG A 42 53.994 38.580 25.547 1.00 0.00 C ATOM 663 NE ARG A 42 55.011 39.462 26.120 1.00 0.00 N ATOM 664 CZ ARG A 42 55.877 39.127 27.087 1.00 0.00 C ATOM 665 NH1 ARG A 42 55.805 37.971 27.761 1.00 0.00 N ATOM 666 NH2 ARG A 42 56.877 39.959 27.406 1.00 0.00 N ATOM 0 H ARG A 42 52.430 42.562 23.336 1.00 0.00 H new ATOM 0 HA ARG A 42 50.899 40.059 23.284 1.00 0.00 H new ATOM 0 HB2 ARG A 42 52.796 41.084 25.416 1.00 0.00 H new ATOM 0 HB3 ARG A 42 51.608 39.827 25.697 1.00 0.00 H new ATOM 0 HG2 ARG A 42 52.677 38.477 23.848 1.00 0.00 H new ATOM 0 HG3 ARG A 42 53.917 39.708 23.716 1.00 0.00 H new ATOM 0 HD2 ARG A 42 53.297 38.279 26.329 1.00 0.00 H new ATOM 0 HD3 ARG A 42 54.472 37.672 25.179 1.00 0.00 H new ATOM 0 HE ARG A 42 55.066 40.412 25.753 1.00 0.00 H new ATOM 0 HH11 ARG A 42 55.067 37.300 27.546 1.00 0.00 H new ATOM 0 HH12 ARG A 42 56.488 37.762 28.489 1.00 0.00 H new ATOM 0 HH21 ARG A 42 56.979 40.846 26.913 1.00 0.00 H new ATOM 0 HH22 ARG A 42 57.537 39.705 28.142 1.00 0.00 H new ATOM 680 N LEU A 43 48.992 41.320 24.318 1.00 0.00 N ATOM 681 CA LEU A 43 47.822 41.995 24.841 1.00 0.00 C ATOM 682 C LEU A 43 47.255 41.297 26.079 1.00 0.00 C ATOM 683 O LEU A 43 47.136 40.075 26.116 1.00 0.00 O ATOM 684 CB LEU A 43 46.776 42.121 23.738 1.00 0.00 C ATOM 685 CG LEU A 43 47.110 43.197 22.708 1.00 0.00 C ATOM 686 CD1 LEU A 43 46.289 42.985 21.439 1.00 0.00 C ATOM 687 CD2 LEU A 43 46.821 44.601 23.233 1.00 0.00 C ATOM 0 H LEU A 43 48.759 40.477 23.794 1.00 0.00 H new ATOM 0 HA LEU A 43 48.117 42.992 25.168 1.00 0.00 H new ATOM 0 HB2 LEU A 43 46.676 41.161 23.231 1.00 0.00 H new ATOM 0 HB3 LEU A 43 45.809 42.346 24.188 1.00 0.00 H new ATOM 0 HG LEU A 43 48.176 43.111 22.497 1.00 0.00 H new ATOM 0 HD11 LEU A 43 46.536 43.759 20.712 1.00 0.00 H new ATOM 0 HD12 LEU A 43 46.516 42.006 21.018 1.00 0.00 H new ATOM 0 HD13 LEU A 43 45.227 43.039 21.679 1.00 0.00 H new ATOM 0 HD21 LEU A 43 47.073 45.335 22.467 1.00 0.00 H new ATOM 0 HD22 LEU A 43 45.763 44.686 23.482 1.00 0.00 H new ATOM 0 HD23 LEU A 43 47.420 44.786 24.125 1.00 0.00 H new ATOM 699 N ILE A 44 46.894 42.102 27.074 1.00 0.00 N ATOM 700 CA ILE A 44 46.385 41.690 28.366 1.00 0.00 C ATOM 701 C ILE A 44 45.116 42.467 28.721 1.00 0.00 C ATOM 702 O ILE A 44 45.046 43.676 28.514 1.00 0.00 O ATOM 703 CB ILE A 44 47.474 41.813 29.429 1.00 0.00 C ATOM 704 CG1 ILE A 44 48.629 40.851 29.165 1.00 0.00 C ATOM 705 CG2 ILE A 44 46.935 41.604 30.841 1.00 0.00 C ATOM 706 CD1 ILE A 44 49.854 41.061 30.048 1.00 0.00 C ATOM 0 H ILE A 44 46.955 43.117 26.989 1.00 0.00 H new ATOM 0 HA ILE A 44 46.102 40.638 28.322 1.00 0.00 H new ATOM 0 HB ILE A 44 47.847 42.835 29.361 1.00 0.00 H new ATOM 0 HG12 ILE A 44 48.271 39.831 29.302 1.00 0.00 H new ATOM 0 HG13 ILE A 44 48.931 40.946 28.122 1.00 0.00 H new ATOM 0 HG21 ILE A 44 47.749 41.702 31.559 1.00 0.00 H new ATOM 0 HG22 ILE A 44 46.172 42.352 31.054 1.00 0.00 H new ATOM 0 HG23 ILE A 44 46.499 40.608 30.920 1.00 0.00 H new ATOM 0 HD11 ILE A 44 50.620 40.331 29.787 1.00 0.00 H new ATOM 0 HD12 ILE A 44 50.244 42.067 29.896 1.00 0.00 H new ATOM 0 HD13 ILE A 44 49.575 40.935 31.094 1.00 0.00 H new ATOM 718 N PHE A 45 44.126 41.787 29.292 1.00 0.00 N ATOM 719 CA PHE A 45 42.956 42.383 29.904 1.00 0.00 C ATOM 720 C PHE A 45 42.546 41.666 31.191 1.00 0.00 C ATOM 721 O PHE A 45 42.480 40.439 31.228 1.00 0.00 O ATOM 722 CB PHE A 45 41.789 42.403 28.920 1.00 0.00 C ATOM 723 CG PHE A 45 40.547 43.064 29.469 1.00 0.00 C ATOM 724 CD1 PHE A 45 40.514 44.457 29.615 1.00 0.00 C ATOM 725 CD2 PHE A 45 39.423 42.305 29.814 1.00 0.00 C ATOM 726 CE1 PHE A 45 39.355 45.089 30.080 1.00 0.00 C ATOM 727 CE2 PHE A 45 38.261 42.935 30.275 1.00 0.00 C ATOM 728 CZ PHE A 45 38.226 44.329 30.405 1.00 0.00 C ATOM 0 H PHE A 45 44.122 40.768 29.340 1.00 0.00 H new ATOM 0 HA PHE A 45 43.221 43.406 30.170 1.00 0.00 H new ATOM 0 HB2 PHE A 45 42.098 42.924 28.014 1.00 0.00 H new ATOM 0 HB3 PHE A 45 41.549 41.379 28.633 1.00 0.00 H new ATOM 0 HD1 PHE A 45 41.386 45.045 29.368 1.00 0.00 H new ATOM 0 HD2 PHE A 45 39.452 41.229 29.724 1.00 0.00 H new ATOM 0 HE1 PHE A 45 39.332 46.163 30.188 1.00 0.00 H new ATOM 0 HE2 PHE A 45 37.392 42.346 30.530 1.00 0.00 H new ATOM 0 HZ PHE A 45 37.329 44.817 30.756 1.00 0.00 H new ATOM 738 N ALA A 46 42.264 42.430 32.242 1.00 0.00 N ATOM 739 CA ALA A 46 42.000 41.955 33.587 1.00 0.00 C ATOM 740 C ALA A 46 43.003 40.910 34.076 1.00 0.00 C ATOM 741 O ALA A 46 42.640 39.914 34.696 1.00 0.00 O ATOM 742 CB ALA A 46 40.533 41.552 33.702 1.00 0.00 C ATOM 0 H ALA A 46 42.212 43.446 32.170 1.00 0.00 H new ATOM 0 HA ALA A 46 42.163 42.773 34.289 1.00 0.00 H new ATOM 0 HB1 ALA A 46 40.332 41.195 34.712 1.00 0.00 H new ATOM 0 HB2 ALA A 46 39.901 42.414 33.490 1.00 0.00 H new ATOM 0 HB3 ALA A 46 40.316 40.759 32.987 1.00 0.00 H new ATOM 748 N GLY A 47 44.280 41.098 33.754 1.00 0.00 N ATOM 749 CA GLY A 47 45.372 40.211 34.105 1.00 0.00 C ATOM 750 C GLY A 47 45.532 38.951 33.253 1.00 0.00 C ATOM 751 O GLY A 47 46.477 38.200 33.484 1.00 0.00 O ATOM 0 H GLY A 47 44.589 41.909 33.218 1.00 0.00 H new ATOM 0 HA2 GLY A 47 46.302 40.778 34.053 1.00 0.00 H new ATOM 0 HA3 GLY A 47 45.243 39.906 35.143 1.00 0.00 H new ATOM 755 N LYS A 48 44.668 38.697 32.275 1.00 0.00 N ATOM 756 CA LYS A 48 44.723 37.556 31.383 1.00 0.00 C ATOM 757 C LYS A 48 45.351 37.919 30.037 1.00 0.00 C ATOM 758 O LYS A 48 44.986 38.941 29.458 1.00 0.00 O ATOM 759 CB LYS A 48 43.309 37.008 31.204 1.00 0.00 C ATOM 760 CG LYS A 48 43.300 35.643 30.522 1.00 0.00 C ATOM 761 CD LYS A 48 41.894 35.051 30.485 1.00 0.00 C ATOM 762 CE LYS A 48 41.886 33.665 29.846 1.00 0.00 C ATOM 763 NZ LYS A 48 42.531 32.648 30.691 1.00 0.00 N ATOM 0 H LYS A 48 43.878 39.311 32.078 1.00 0.00 H new ATOM 0 HA LYS A 48 45.360 36.789 31.823 1.00 0.00 H new ATOM 0 HB2 LYS A 48 42.826 36.928 32.178 1.00 0.00 H new ATOM 0 HB3 LYS A 48 42.721 37.711 30.614 1.00 0.00 H new ATOM 0 HG2 LYS A 48 43.683 35.739 29.506 1.00 0.00 H new ATOM 0 HG3 LYS A 48 43.969 34.965 31.052 1.00 0.00 H new ATOM 0 HD2 LYS A 48 41.498 34.987 31.499 1.00 0.00 H new ATOM 0 HD3 LYS A 48 41.234 35.714 29.926 1.00 0.00 H new ATOM 0 HE2 LYS A 48 40.857 33.367 29.647 1.00 0.00 H new ATOM 0 HE3 LYS A 48 42.397 33.710 28.884 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 42.409 31.710 30.259 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 43.545 32.861 30.777 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 42.095 32.654 31.635 1.00 0.00 H new ATOM 777 N GLN A 49 46.250 37.087 29.519 1.00 0.00 N ATOM 778 CA GLN A 49 46.819 37.235 28.195 1.00 0.00 C ATOM 779 C GLN A 49 45.892 36.626 27.140 1.00 0.00 C ATOM 780 O GLN A 49 45.331 35.553 27.351 1.00 0.00 O ATOM 781 CB GLN A 49 48.221 36.634 28.150 1.00 0.00 C ATOM 782 CG GLN A 49 49.044 37.183 26.989 1.00 0.00 C ATOM 783 CD GLN A 49 50.458 36.602 26.938 1.00 0.00 C ATOM 784 OE1 GLN A 49 50.828 35.874 26.019 1.00 0.00 O ATOM 785 NE2 GLN A 49 51.318 36.894 27.909 1.00 0.00 N ATOM 0 H GLN A 49 46.607 36.276 30.024 1.00 0.00 H new ATOM 0 HA GLN A 49 46.914 38.296 27.963 1.00 0.00 H new ATOM 0 HB2 GLN A 49 48.735 36.843 29.088 1.00 0.00 H new ATOM 0 HB3 GLN A 49 48.148 35.550 28.061 1.00 0.00 H new ATOM 0 HG2 GLN A 49 48.532 36.965 26.052 1.00 0.00 H new ATOM 0 HG3 GLN A 49 49.105 38.268 27.074 1.00 0.00 H new ATOM 0 HE21 GLN A 49 51.031 37.496 28.681 1.00 0.00 H new ATOM 0 HE22 GLN A 49 52.265 36.516 27.882 1.00 0.00 H new ATOM 794 N LEU A 50 45.709 37.308 26.012 1.00 0.00 N ATOM 795 CA LEU A 50 44.607 37.056 25.106 1.00 0.00 C ATOM 796 C LEU A 50 44.973 36.196 23.896 1.00 0.00 C ATOM 797 O LEU A 50 46.134 36.095 23.508 1.00 0.00 O ATOM 798 CB LEU A 50 43.966 38.386 24.719 1.00 0.00 C ATOM 799 CG LEU A 50 43.648 39.353 25.855 1.00 0.00 C ATOM 800 CD1 LEU A 50 42.977 40.609 25.301 1.00 0.00 C ATOM 801 CD2 LEU A 50 42.738 38.781 26.937 1.00 0.00 C ATOM 0 H LEU A 50 46.330 38.056 25.704 1.00 0.00 H new ATOM 0 HA LEU A 50 43.875 36.447 25.636 1.00 0.00 H new ATOM 0 HB2 LEU A 50 44.630 38.892 24.018 1.00 0.00 H new ATOM 0 HB3 LEU A 50 43.040 38.174 24.184 1.00 0.00 H new ATOM 0 HG LEU A 50 44.611 39.571 26.318 1.00 0.00 H new ATOM 0 HD11 LEU A 50 42.754 41.293 26.119 1.00 0.00 H new ATOM 0 HD12 LEU A 50 43.646 41.097 24.592 1.00 0.00 H new ATOM 0 HD13 LEU A 50 42.051 40.334 24.795 1.00 0.00 H new ATOM 0 HD21 LEU A 50 42.565 39.536 27.704 1.00 0.00 H new ATOM 0 HD22 LEU A 50 41.786 38.489 26.494 1.00 0.00 H new ATOM 0 HD23 LEU A 50 43.212 37.909 27.387 1.00 0.00 H new ATOM 813 N GLU A 51 43.978 35.550 23.295 1.00 0.00 N ATOM 814 CA GLU A 51 44.073 34.713 22.115 1.00 0.00 C ATOM 815 C GLU A 51 43.543 35.429 20.870 1.00 0.00 C ATOM 816 O GLU A 51 42.604 36.219 20.931 1.00 0.00 O ATOM 817 CB GLU A 51 43.380 33.381 22.386 1.00 0.00 C ATOM 818 CG GLU A 51 43.327 32.371 21.242 1.00 0.00 C ATOM 819 CD GLU A 51 44.698 31.848 20.807 1.00 0.00 C ATOM 820 OE1 GLU A 51 45.068 30.708 21.158 1.00 0.00 O ATOM 821 OE2 GLU A 51 45.419 32.575 20.092 1.00 0.00 O ATOM 0 H GLU A 51 43.022 35.605 23.647 1.00 0.00 H new ATOM 0 HA GLU A 51 45.121 34.505 21.899 1.00 0.00 H new ATOM 0 HB2 GLU A 51 43.880 32.907 23.231 1.00 0.00 H new ATOM 0 HB3 GLU A 51 42.357 33.591 22.698 1.00 0.00 H new ATOM 0 HG2 GLU A 51 42.707 31.527 21.545 1.00 0.00 H new ATOM 0 HG3 GLU A 51 42.838 32.834 20.385 1.00 0.00 H new ATOM 828 N ASP A 52 44.136 35.135 19.716 1.00 0.00 N ATOM 829 CA ASP A 52 44.032 35.918 18.501 1.00 0.00 C ATOM 830 C ASP A 52 42.718 35.755 17.734 1.00 0.00 C ATOM 831 O ASP A 52 42.236 36.712 17.133 1.00 0.00 O ATOM 832 CB ASP A 52 45.246 35.592 17.636 1.00 0.00 C ATOM 833 CG ASP A 52 46.515 36.256 18.172 1.00 0.00 C ATOM 834 OD1 ASP A 52 46.791 37.424 17.821 1.00 0.00 O ATOM 835 OD2 ASP A 52 47.257 35.616 18.948 1.00 0.00 O ATOM 0 H ASP A 52 44.725 34.310 19.604 1.00 0.00 H new ATOM 0 HA ASP A 52 44.021 36.971 18.782 1.00 0.00 H new ATOM 0 HB2 ASP A 52 45.388 34.512 17.599 1.00 0.00 H new ATOM 0 HB3 ASP A 52 45.065 35.924 16.614 1.00 0.00 H new ATOM 840 N GLY A 53 42.095 34.581 17.777 1.00 0.00 N ATOM 841 CA GLY A 53 40.805 34.324 17.168 1.00 0.00 C ATOM 842 C GLY A 53 39.603 34.890 17.928 1.00 0.00 C ATOM 843 O GLY A 53 38.488 34.855 17.414 1.00 0.00 O ATOM 0 H GLY A 53 42.487 33.766 18.249 1.00 0.00 H new ATOM 0 HA2 GLY A 53 40.807 34.740 16.161 1.00 0.00 H new ATOM 0 HA3 GLY A 53 40.677 33.246 17.067 1.00 0.00 H new ATOM 847 N ARG A 54 39.814 35.388 19.143 1.00 0.00 N ATOM 848 CA ARG A 54 38.793 35.816 20.079 1.00 0.00 C ATOM 849 C ARG A 54 38.422 37.288 19.889 1.00 0.00 C ATOM 850 O ARG A 54 39.250 38.064 19.415 1.00 0.00 O ATOM 851 CB ARG A 54 39.313 35.500 21.478 1.00 0.00 C ATOM 852 CG ARG A 54 38.254 35.336 22.564 1.00 0.00 C ATOM 853 CD ARG A 54 37.256 34.206 22.333 1.00 0.00 C ATOM 854 NE ARG A 54 37.928 32.943 22.029 1.00 0.00 N ATOM 855 CZ ARG A 54 38.036 32.364 20.825 1.00 0.00 C ATOM 856 NH1 ARG A 54 37.283 32.687 19.765 1.00 0.00 N ATOM 857 NH2 ARG A 54 38.968 31.426 20.608 1.00 0.00 N ATOM 0 H ARG A 54 40.756 35.508 19.516 1.00 0.00 H new ATOM 0 HA ARG A 54 37.859 35.281 19.908 1.00 0.00 H new ATOM 0 HB2 ARG A 54 39.898 34.582 21.428 1.00 0.00 H new ATOM 0 HB3 ARG A 54 39.994 36.296 21.779 1.00 0.00 H new ATOM 0 HG2 ARG A 54 38.756 35.166 23.516 1.00 0.00 H new ATOM 0 HG3 ARG A 54 37.703 36.272 22.656 1.00 0.00 H new ATOM 0 HD2 ARG A 54 36.634 34.083 23.220 1.00 0.00 H new ATOM 0 HD3 ARG A 54 36.590 34.471 21.511 1.00 0.00 H new ATOM 0 HE ARG A 54 38.358 32.453 22.813 1.00 0.00 H new ATOM 0 HH11 ARG A 54 36.574 33.415 19.846 1.00 0.00 H new ATOM 0 HH12 ARG A 54 37.419 32.204 18.877 1.00 0.00 H new ATOM 0 HH21 ARG A 54 39.599 31.150 21.361 1.00 0.00 H new ATOM 0 HH22 ARG A 54 39.047 30.988 19.690 1.00 0.00 H new ATOM 871 N THR A 55 37.207 37.677 20.263 1.00 0.00 N ATOM 872 CA THR A 55 36.704 39.028 20.112 1.00 0.00 C ATOM 873 C THR A 55 36.569 39.775 21.441 1.00 0.00 C ATOM 874 O THR A 55 36.507 39.167 22.506 1.00 0.00 O ATOM 875 CB THR A 55 35.389 39.096 19.338 1.00 0.00 C ATOM 876 OG1 THR A 55 34.309 38.567 20.073 1.00 0.00 O ATOM 877 CG2 THR A 55 35.429 38.375 17.994 1.00 0.00 C ATOM 0 H THR A 55 36.532 37.042 20.689 1.00 0.00 H new ATOM 0 HA THR A 55 37.467 39.534 19.521 1.00 0.00 H new ATOM 0 HB THR A 55 35.245 40.162 19.162 1.00 0.00 H new ATOM 0 HG1 THR A 55 34.535 37.665 20.383 1.00 0.00 H new ATOM 0 HG21 THR A 55 34.460 38.467 17.503 1.00 0.00 H new ATOM 0 HG22 THR A 55 36.199 38.821 17.364 1.00 0.00 H new ATOM 0 HG23 THR A 55 35.657 37.321 18.153 1.00 0.00 H new ATOM 885 N LEU A 56 36.502 41.102 21.383 1.00 0.00 N ATOM 886 CA LEU A 56 36.428 41.949 22.556 1.00 0.00 C ATOM 887 C LEU A 56 35.237 41.640 23.466 1.00 0.00 C ATOM 888 O LEU A 56 35.386 41.594 24.686 1.00 0.00 O ATOM 889 CB LEU A 56 36.406 43.410 22.118 1.00 0.00 C ATOM 890 CG LEU A 56 37.649 43.890 21.375 1.00 0.00 C ATOM 891 CD1 LEU A 56 37.511 45.383 21.082 1.00 0.00 C ATOM 892 CD2 LEU A 56 38.934 43.698 22.176 1.00 0.00 C ATOM 0 H LEU A 56 36.498 41.621 20.505 1.00 0.00 H new ATOM 0 HA LEU A 56 37.314 41.744 23.156 1.00 0.00 H new ATOM 0 HB2 LEU A 56 35.538 43.567 21.478 1.00 0.00 H new ATOM 0 HB3 LEU A 56 36.268 44.034 23.001 1.00 0.00 H new ATOM 0 HG LEU A 56 37.719 43.294 20.465 1.00 0.00 H new ATOM 0 HD11 LEU A 56 38.396 45.733 20.551 1.00 0.00 H new ATOM 0 HD12 LEU A 56 36.628 45.553 20.466 1.00 0.00 H new ATOM 0 HD13 LEU A 56 37.410 45.930 22.019 1.00 0.00 H new ATOM 0 HD21 LEU A 56 39.783 44.058 21.594 1.00 0.00 H new ATOM 0 HD22 LEU A 56 38.869 44.259 23.108 1.00 0.00 H new ATOM 0 HD23 LEU A 56 39.070 42.640 22.398 1.00 0.00 H new ATOM 904 N SER A 57 34.072 41.368 22.886 1.00 0.00 N ATOM 905 CA SER A 57 32.870 40.983 23.598 1.00 0.00 C ATOM 906 C SER A 57 32.994 39.652 24.343 1.00 0.00 C ATOM 907 O SER A 57 32.344 39.485 25.372 1.00 0.00 O ATOM 908 CB SER A 57 31.679 40.925 22.647 1.00 0.00 C ATOM 909 OG SER A 57 31.958 40.113 21.529 1.00 0.00 O ATOM 0 H SER A 57 33.940 41.412 21.876 1.00 0.00 H new ATOM 0 HA SER A 57 32.714 41.754 24.352 1.00 0.00 H new ATOM 0 HB2 SER A 57 30.808 40.536 23.174 1.00 0.00 H new ATOM 0 HB3 SER A 57 31.427 41.932 22.314 1.00 0.00 H new ATOM 0 HG SER A 57 32.423 40.642 20.848 1.00 0.00 H new ATOM 915 N ASP A 58 33.839 38.727 23.895 1.00 0.00 N ATOM 916 CA ASP A 58 34.034 37.455 24.561 1.00 0.00 C ATOM 917 C ASP A 58 34.773 37.607 25.891 1.00 0.00 C ATOM 918 O ASP A 58 34.413 36.959 26.872 1.00 0.00 O ATOM 919 CB ASP A 58 34.822 36.484 23.685 1.00 0.00 C ATOM 920 CG ASP A 58 34.182 36.160 22.334 1.00 0.00 C ATOM 921 OD1 ASP A 58 33.016 35.709 22.318 1.00 0.00 O ATOM 922 OD2 ASP A 58 34.864 36.322 21.299 1.00 0.00 O ATOM 0 H ASP A 58 34.407 38.845 23.056 1.00 0.00 H new ATOM 0 HA ASP A 58 33.035 37.061 24.750 1.00 0.00 H new ATOM 0 HB2 ASP A 58 35.813 36.901 23.509 1.00 0.00 H new ATOM 0 HB3 ASP A 58 34.961 35.554 24.236 1.00 0.00 H new ATOM 927 N TYR A 59 35.774 38.482 25.935 1.00 0.00 N ATOM 928 CA TYR A 59 36.525 38.823 27.126 1.00 0.00 C ATOM 929 C TYR A 59 35.837 39.880 27.992 1.00 0.00 C ATOM 930 O TYR A 59 36.395 40.282 29.010 1.00 0.00 O ATOM 931 CB TYR A 59 37.933 39.260 26.731 1.00 0.00 C ATOM 932 CG TYR A 59 38.830 38.172 26.189 1.00 0.00 C ATOM 933 CD1 TYR A 59 39.162 37.080 27.000 1.00 0.00 C ATOM 934 CD2 TYR A 59 39.391 38.292 24.912 1.00 0.00 C ATOM 935 CE1 TYR A 59 40.047 36.098 26.541 1.00 0.00 C ATOM 936 CE2 TYR A 59 40.302 37.332 24.455 1.00 0.00 C ATOM 937 CZ TYR A 59 40.629 36.226 25.264 1.00 0.00 C ATOM 938 OH TYR A 59 41.517 35.294 24.816 1.00 0.00 O ATOM 0 H TYR A 59 36.091 38.988 25.108 1.00 0.00 H new ATOM 0 HA TYR A 59 36.580 37.929 27.747 1.00 0.00 H new ATOM 0 HB2 TYR A 59 37.852 40.046 25.980 1.00 0.00 H new ATOM 0 HB3 TYR A 59 38.415 39.701 27.604 1.00 0.00 H new ATOM 0 HD1 TYR A 59 38.732 36.995 27.987 1.00 0.00 H new ATOM 0 HD2 TYR A 59 39.121 39.125 24.280 1.00 0.00 H new ATOM 0 HE1 TYR A 59 40.283 35.247 27.162 1.00 0.00 H new ATOM 0 HE2 TYR A 59 40.755 37.440 23.480 1.00 0.00 H new ATOM 0 HH TYR A 59 41.173 34.882 23.996 1.00 0.00 H new ATOM 948 N ASN A 60 34.647 40.342 27.617 1.00 0.00 N ATOM 949 CA ASN A 60 33.930 41.418 28.271 1.00 0.00 C ATOM 950 C ASN A 60 34.729 42.723 28.323 1.00 0.00 C ATOM 951 O ASN A 60 34.709 43.433 29.326 1.00 0.00 O ATOM 952 CB ASN A 60 33.360 40.959 29.611 1.00 0.00 C ATOM 953 CG ASN A 60 32.622 39.621 29.536 1.00 0.00 C ATOM 954 OD1 ASN A 60 33.042 38.627 30.123 1.00 0.00 O ATOM 955 ND2 ASN A 60 31.521 39.547 28.794 1.00 0.00 N ATOM 0 H ASN A 60 34.142 39.958 26.818 1.00 0.00 H new ATOM 0 HA ASN A 60 33.068 41.674 27.654 1.00 0.00 H new ATOM 0 HB2 ASN A 60 34.172 40.876 30.333 1.00 0.00 H new ATOM 0 HB3 ASN A 60 32.677 41.721 29.986 1.00 0.00 H new ATOM 0 HD21 ASN A 60 31.021 38.662 28.710 1.00 0.00 H new ATOM 0 HD22 ASN A 60 31.176 40.375 28.309 1.00 0.00 H new ATOM 962 N ILE A 61 35.444 43.054 27.253 1.00 0.00 N ATOM 963 CA ILE A 61 36.162 44.305 27.113 1.00 0.00 C ATOM 964 C ILE A 61 35.147 45.382 26.727 1.00 0.00 C ATOM 965 O ILE A 61 34.656 45.409 25.600 1.00 0.00 O ATOM 966 CB ILE A 61 37.318 44.155 26.128 1.00 0.00 C ATOM 967 CG1 ILE A 61 38.368 43.185 26.663 1.00 0.00 C ATOM 968 CG2 ILE A 61 37.968 45.507 25.848 1.00 0.00 C ATOM 969 CD1 ILE A 61 39.246 42.536 25.596 1.00 0.00 C ATOM 0 H ILE A 61 35.539 42.442 26.443 1.00 0.00 H new ATOM 0 HA ILE A 61 36.631 44.606 28.050 1.00 0.00 H new ATOM 0 HB ILE A 61 36.910 43.756 25.199 1.00 0.00 H new ATOM 0 HG12 ILE A 61 39.009 43.717 27.366 1.00 0.00 H new ATOM 0 HG13 ILE A 61 37.863 42.399 27.225 1.00 0.00 H new ATOM 0 HG21 ILE A 61 38.790 45.377 25.144 1.00 0.00 H new ATOM 0 HG22 ILE A 61 37.229 46.185 25.422 1.00 0.00 H new ATOM 0 HG23 ILE A 61 38.351 45.926 26.778 1.00 0.00 H new ATOM 0 HD11 ILE A 61 39.960 41.864 26.072 1.00 0.00 H new ATOM 0 HD12 ILE A 61 38.621 41.971 24.905 1.00 0.00 H new ATOM 0 HD13 ILE A 61 39.785 43.309 25.048 1.00 0.00 H new ATOM 981 N GLN A 62 34.790 46.228 27.689 1.00 0.00 N ATOM 982 CA GLN A 62 33.746 47.225 27.573 1.00 0.00 C ATOM 983 C GLN A 62 34.299 48.596 27.177 1.00 0.00 C ATOM 984 O GLN A 62 35.477 48.887 27.372 1.00 0.00 O ATOM 985 CB GLN A 62 32.966 47.319 28.881 1.00 0.00 C ATOM 986 CG GLN A 62 32.289 46.026 29.329 1.00 0.00 C ATOM 987 CD GLN A 62 31.365 45.422 28.270 1.00 0.00 C ATOM 988 OE1 GLN A 62 31.755 44.572 27.473 1.00 0.00 O ATOM 989 NE2 GLN A 62 30.109 45.852 28.184 1.00 0.00 N ATOM 0 H GLN A 62 35.241 46.233 28.604 1.00 0.00 H new ATOM 0 HA GLN A 62 33.074 46.909 26.775 1.00 0.00 H new ATOM 0 HB2 GLN A 62 33.646 47.646 29.668 1.00 0.00 H new ATOM 0 HB3 GLN A 62 32.204 48.092 28.776 1.00 0.00 H new ATOM 0 HG2 GLN A 62 33.055 45.296 29.590 1.00 0.00 H new ATOM 0 HG3 GLN A 62 31.713 46.221 30.234 1.00 0.00 H new ATOM 0 HE21 GLN A 62 29.766 46.557 28.836 1.00 0.00 H new ATOM 0 HE22 GLN A 62 29.489 45.476 27.466 1.00 0.00 H new ATOM 998 N LYS A 63 33.419 49.474 26.703 1.00 0.00 N ATOM 999 CA LYS A 63 33.676 50.887 26.512 1.00 0.00 C ATOM 1000 C LYS A 63 34.346 51.505 27.741 1.00 0.00 C ATOM 1001 O LYS A 63 34.003 51.179 28.876 1.00 0.00 O ATOM 1002 CB LYS A 63 32.342 51.556 26.193 1.00 0.00 C ATOM 1003 CG LYS A 63 32.425 53.062 25.958 1.00 0.00 C ATOM 1004 CD LYS A 63 31.066 53.612 25.533 1.00 0.00 C ATOM 1005 CE LYS A 63 31.118 55.136 25.466 1.00 0.00 C ATOM 1006 NZ LYS A 63 29.876 55.698 24.917 1.00 0.00 N ATOM 0 H LYS A 63 32.473 49.204 26.433 1.00 0.00 H new ATOM 0 HA LYS A 63 34.373 51.038 25.688 1.00 0.00 H new ATOM 0 HB2 LYS A 63 31.918 51.086 25.305 1.00 0.00 H new ATOM 0 HB3 LYS A 63 31.651 51.368 27.014 1.00 0.00 H new ATOM 0 HG2 LYS A 63 32.757 53.560 26.869 1.00 0.00 H new ATOM 0 HG3 LYS A 63 33.167 53.276 25.189 1.00 0.00 H new ATOM 0 HD2 LYS A 63 30.788 53.206 24.560 1.00 0.00 H new ATOM 0 HD3 LYS A 63 30.299 53.297 26.241 1.00 0.00 H new ATOM 0 HE2 LYS A 63 31.290 55.539 26.464 1.00 0.00 H new ATOM 0 HE3 LYS A 63 31.961 55.445 24.848 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 29.948 56.735 24.887 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 29.725 55.333 23.955 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 29.075 55.424 25.521 1.00 0.00 H new ATOM 1020 N GLU A 64 35.313 52.391 27.521 1.00 0.00 N ATOM 1021 CA GLU A 64 36.080 53.106 28.521 1.00 0.00 C ATOM 1022 C GLU A 64 37.011 52.262 29.396 1.00 0.00 C ATOM 1023 O GLU A 64 37.786 52.827 30.164 1.00 0.00 O ATOM 1024 CB GLU A 64 35.162 54.021 29.325 1.00 0.00 C ATOM 1025 CG GLU A 64 35.800 55.322 29.801 1.00 0.00 C ATOM 1026 CD GLU A 64 34.810 56.170 30.602 1.00 0.00 C ATOM 1027 OE1 GLU A 64 33.699 56.444 30.101 1.00 0.00 O ATOM 1028 OE2 GLU A 64 35.127 56.543 31.753 1.00 0.00 O ATOM 0 H GLU A 64 35.596 52.641 26.573 1.00 0.00 H new ATOM 0 HA GLU A 64 36.794 53.713 27.964 1.00 0.00 H new ATOM 0 HB2 GLU A 64 34.292 54.263 28.715 1.00 0.00 H new ATOM 0 HB3 GLU A 64 34.799 53.473 30.195 1.00 0.00 H new ATOM 0 HG2 GLU A 64 36.671 55.098 30.417 1.00 0.00 H new ATOM 0 HG3 GLU A 64 36.156 55.890 28.941 1.00 0.00 H new ATOM 1035 N SER A 65 37.008 50.938 29.279 1.00 0.00 N ATOM 1036 CA SER A 65 37.987 50.085 29.922 1.00 0.00 C ATOM 1037 C SER A 65 39.371 50.198 29.282 1.00 0.00 C ATOM 1038 O SER A 65 39.501 50.687 28.163 1.00 0.00 O ATOM 1039 CB SER A 65 37.498 48.641 30.004 1.00 0.00 C ATOM 1040 OG SER A 65 37.555 47.974 28.764 1.00 0.00 O ATOM 0 H SER A 65 36.317 50.427 28.729 1.00 0.00 H new ATOM 0 HA SER A 65 38.102 50.443 30.945 1.00 0.00 H new ATOM 0 HB2 SER A 65 38.102 48.098 30.731 1.00 0.00 H new ATOM 0 HB3 SER A 65 36.472 48.630 30.370 1.00 0.00 H new ATOM 0 HG SER A 65 36.912 48.379 28.145 1.00 0.00 H new ATOM 1046 N THR A 66 40.416 49.763 29.982 1.00 0.00 N ATOM 1047 CA THR A 66 41.773 49.736 29.476 1.00 0.00 C ATOM 1048 C THR A 66 42.273 48.316 29.202 1.00 0.00 C ATOM 1049 O THR A 66 42.195 47.431 30.050 1.00 0.00 O ATOM 1050 CB THR A 66 42.737 50.546 30.338 1.00 0.00 C ATOM 1051 OG1 THR A 66 43.917 50.846 29.627 1.00 0.00 O ATOM 1052 CG2 THR A 66 43.167 49.907 31.654 1.00 0.00 C ATOM 0 H THR A 66 40.334 49.413 30.937 1.00 0.00 H new ATOM 0 HA THR A 66 41.744 50.235 28.507 1.00 0.00 H new ATOM 0 HB THR A 66 42.152 51.432 30.586 1.00 0.00 H new ATOM 0 HG1 THR A 66 44.359 50.013 29.360 1.00 0.00 H new ATOM 0 HG21 THR A 66 43.850 50.576 32.177 1.00 0.00 H new ATOM 0 HG22 THR A 66 42.289 49.727 32.275 1.00 0.00 H new ATOM 0 HG23 THR A 66 43.669 48.961 31.452 1.00 0.00 H new ATOM 1060 N LEU A 67 42.870 48.133 28.027 1.00 0.00 N ATOM 1061 CA LEU A 67 43.797 47.055 27.744 1.00 0.00 C ATOM 1062 C LEU A 67 45.175 47.399 28.312 1.00 0.00 C ATOM 1063 O LEU A 67 45.459 48.564 28.584 1.00 0.00 O ATOM 1064 CB LEU A 67 43.881 46.834 26.236 1.00 0.00 C ATOM 1065 CG LEU A 67 42.569 46.505 25.531 1.00 0.00 C ATOM 1066 CD1 LEU A 67 42.802 46.346 24.031 1.00 0.00 C ATOM 1067 CD2 LEU A 67 41.951 45.212 26.057 1.00 0.00 C ATOM 0 H LEU A 67 42.715 48.749 27.229 1.00 0.00 H new ATOM 0 HA LEU A 67 43.444 46.137 28.214 1.00 0.00 H new ATOM 0 HB2 LEU A 67 44.299 47.732 25.781 1.00 0.00 H new ATOM 0 HB3 LEU A 67 44.585 46.023 26.047 1.00 0.00 H new ATOM 0 HG LEU A 67 41.886 47.331 25.729 1.00 0.00 H new ATOM 0 HD11 LEU A 67 41.858 46.111 23.539 1.00 0.00 H new ATOM 0 HD12 LEU A 67 43.202 47.275 23.624 1.00 0.00 H new ATOM 0 HD13 LEU A 67 43.513 45.538 23.857 1.00 0.00 H new ATOM 0 HD21 LEU A 67 41.018 45.014 25.529 1.00 0.00 H new ATOM 0 HD22 LEU A 67 42.643 44.386 25.894 1.00 0.00 H new ATOM 0 HD23 LEU A 67 41.750 45.312 27.124 1.00 0.00 H new ATOM 1079 N HIS A 68 46.051 46.405 28.422 1.00 0.00 N ATOM 1080 CA HIS A 68 47.476 46.574 28.623 1.00 0.00 C ATOM 1081 C HIS A 68 48.250 45.935 27.468 1.00 0.00 C ATOM 1082 O HIS A 68 47.843 44.893 26.957 1.00 0.00 O ATOM 1083 CB HIS A 68 47.899 45.990 29.967 1.00 0.00 C ATOM 1084 CG HIS A 68 47.379 46.727 31.171 1.00 0.00 C ATOM 1085 ND1 HIS A 68 48.172 47.425 32.081 1.00 0.00 N ATOM 1086 CD2 HIS A 68 46.089 46.719 31.633 1.00 0.00 C ATOM 1087 CE1 HIS A 68 47.354 47.845 33.049 1.00 0.00 C ATOM 1088 NE2 HIS A 68 46.097 47.432 32.815 1.00 0.00 N ATOM 0 H HIS A 68 45.772 45.425 28.371 1.00 0.00 H new ATOM 0 HA HIS A 68 47.709 47.639 28.637 1.00 0.00 H new ATOM 0 HB2 HIS A 68 47.561 44.955 30.019 1.00 0.00 H new ATOM 0 HB3 HIS A 68 48.988 45.973 30.012 1.00 0.00 H new ATOM 0 HD2 HIS A 68 45.236 46.249 31.166 1.00 0.00 H new ATOM 0 HE1 HIS A 68 47.660 48.434 33.901 1.00 0.00 H new ATOM 0 HE2 HIS A 68 45.288 47.614 33.409 1.00 0.00 H new ATOM 1096 N LEU A 69 49.354 46.554 27.063 1.00 0.00 N ATOM 1097 CA LEU A 69 50.197 46.141 25.959 1.00 0.00 C ATOM 1098 C LEU A 69 51.651 46.023 26.424 1.00 0.00 C ATOM 1099 O LEU A 69 52.197 46.949 27.017 1.00 0.00 O ATOM 1100 CB LEU A 69 50.001 47.140 24.823 1.00 0.00 C ATOM 1101 CG LEU A 69 50.748 46.951 23.506 1.00 0.00 C ATOM 1102 CD1 LEU A 69 52.215 47.374 23.541 1.00 0.00 C ATOM 1103 CD2 LEU A 69 50.665 45.530 22.955 1.00 0.00 C ATOM 0 H LEU A 69 49.697 47.398 27.522 1.00 0.00 H new ATOM 0 HA LEU A 69 49.923 45.152 25.591 1.00 0.00 H new ATOM 0 HB2 LEU A 69 48.936 47.164 24.592 1.00 0.00 H new ATOM 0 HB3 LEU A 69 50.265 48.125 25.208 1.00 0.00 H new ATOM 0 HG LEU A 69 50.217 47.627 22.836 1.00 0.00 H new ATOM 0 HD11 LEU A 69 52.666 47.205 22.563 1.00 0.00 H new ATOM 0 HD12 LEU A 69 52.283 48.432 23.793 1.00 0.00 H new ATOM 0 HD13 LEU A 69 52.745 46.788 24.292 1.00 0.00 H new ATOM 0 HD21 LEU A 69 51.219 45.470 22.018 1.00 0.00 H new ATOM 0 HD22 LEU A 69 51.095 44.835 23.676 1.00 0.00 H new ATOM 0 HD23 LEU A 69 49.622 45.269 22.777 1.00 0.00 H new ATOM 1115 N VAL A 70 52.286 44.891 26.135 1.00 0.00 N ATOM 1116 CA VAL A 70 53.674 44.608 26.440 1.00 0.00 C ATOM 1117 C VAL A 70 54.368 44.071 25.186 1.00 0.00 C ATOM 1118 O VAL A 70 53.756 43.370 24.384 1.00 0.00 O ATOM 1119 CB VAL A 70 53.797 43.616 27.594 1.00 0.00 C ATOM 1120 CG1 VAL A 70 55.209 43.588 28.171 1.00 0.00 C ATOM 1121 CG2 VAL A 70 52.860 43.929 28.758 1.00 0.00 C ATOM 0 H VAL A 70 51.822 44.116 25.661 1.00 0.00 H new ATOM 0 HA VAL A 70 54.160 45.532 26.754 1.00 0.00 H new ATOM 0 HB VAL A 70 53.531 42.656 27.152 1.00 0.00 H new ATOM 0 HG11 VAL A 70 55.253 42.870 28.990 1.00 0.00 H new ATOM 0 HG12 VAL A 70 55.914 43.296 27.393 1.00 0.00 H new ATOM 0 HG13 VAL A 70 55.470 44.579 28.543 1.00 0.00 H new ATOM 0 HG21 VAL A 70 52.997 43.187 29.545 1.00 0.00 H new ATOM 0 HG22 VAL A 70 53.086 44.920 29.151 1.00 0.00 H new ATOM 0 HG23 VAL A 70 51.827 43.903 28.411 1.00 0.00 H new