USER MOD reduce.3.24.130724 H: found=0, std=0, add=571, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 572 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 25 ASN : amide:sc= -0.812 K(o=-1.6,f=-5!) USER MOD Set 1.2: A 29 LYS NZ :NH3+ -109:sc= -0.804 (180deg=-3.45!) USER MOD Set 2.1: A 7 THR OG1 : rot 125:sc= -0.589 USER MOD Set 2.2: A 9 THR OG1 : rot -118:sc= -0.383 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 142:sc= -0.15 (180deg=-1.57) USER MOD Single : A 2 GLN : amide:sc= 0.406 K(o=0.41,f=-0.36) USER MOD Single : A 6 LYS NZ :NH3+ -151:sc= -0.0273 (180deg=-0.442) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot 66:sc= -0.332 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 180:sc= 0.00537 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ 172:sc= -1.37 (180deg=-1.48) USER MOD Single : A 31 GLN : amide:sc= -0.482 X(o=-0.48,f=-0.93) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 GLN : amide:sc= -0.136 X(o=-0.14,f=-0.16) USER MOD Single : A 41 GLN : amide:sc= -1.67! X(o=-1.7!,f=-1.5) USER MOD Single : A 48 LYS NZ :NH3+ -162:sc= -0.0655 (180deg=-0.501) USER MOD Single : A 49 GLN : amide:sc= -0.478! C(o=-0.48!,f=-9.3!) USER MOD Single : A 55 THR OG1 : rot 170:sc= -2.58! USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 165:sc= -0.682 USER MOD Single : A 60 ASN : amide:sc= -0.431 X(o=-0.43,f=-0.49) USER MOD Single : A 68 HIS : no HD1:sc= -1.62 K(o=-1.6,f=-3.2!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 27.666 26.591 4.792 1.00 0.00 N ATOM 2 CA MET A 1 27.535 27.772 3.892 1.00 0.00 C ATOM 3 C MET A 1 26.715 28.858 4.591 1.00 0.00 C ATOM 4 O MET A 1 25.725 28.580 5.241 1.00 0.00 O ATOM 5 CB MET A 1 26.831 27.350 2.600 1.00 0.00 C ATOM 6 CG MET A 1 25.462 26.757 2.934 1.00 0.00 C ATOM 7 SD MET A 1 24.719 26.071 1.434 1.00 0.00 S ATOM 8 CE MET A 1 23.154 25.546 2.175 1.00 0.00 C ATOM 0 H1 MET A 1 27.606 25.718 4.230 1.00 0.00 H new ATOM 0 H2 MET A 1 28.584 26.626 5.279 1.00 0.00 H new ATOM 0 H3 MET A 1 26.900 26.604 5.495 1.00 0.00 H new ATOM 0 HA MET A 1 28.525 28.162 3.656 1.00 0.00 H new ATOM 0 HB2 MET A 1 26.715 28.209 1.939 1.00 0.00 H new ATOM 0 HB3 MET A 1 27.436 26.617 2.067 1.00 0.00 H new ATOM 0 HG2 MET A 1 25.566 25.979 3.690 1.00 0.00 H new ATOM 0 HG3 MET A 1 24.814 27.526 3.355 1.00 0.00 H new ATOM 0 HE1 MET A 1 22.527 25.085 1.412 1.00 0.00 H new ATOM 0 HE2 MET A 1 23.351 24.824 2.967 1.00 0.00 H new ATOM 0 HE3 MET A 1 22.641 26.412 2.593 1.00 0.00 H new ATOM 20 N GLN A 2 27.117 30.093 4.465 1.00 0.00 N ATOM 21 CA GLN A 2 26.360 31.194 5.123 1.00 0.00 C ATOM 22 C GLN A 2 26.122 30.840 6.592 1.00 0.00 C ATOM 23 O GLN A 2 24.998 30.731 7.041 1.00 0.00 O ATOM 24 CB GLN A 2 25.014 31.380 4.418 1.00 0.00 C ATOM 25 CG GLN A 2 24.367 32.686 4.883 1.00 0.00 C ATOM 26 CD GLN A 2 23.106 32.951 4.060 1.00 0.00 C ATOM 27 OE1 GLN A 2 23.127 32.870 2.848 1.00 0.00 O ATOM 28 NE2 GLN A 2 21.997 33.267 4.674 1.00 0.00 N ATOM 0 H GLN A 2 27.937 30.387 3.935 1.00 0.00 H new ATOM 0 HA GLN A 2 26.933 32.119 5.060 1.00 0.00 H new ATOM 0 HB2 GLN A 2 25.157 31.398 3.338 1.00 0.00 H new ATOM 0 HB3 GLN A 2 24.357 30.538 4.638 1.00 0.00 H new ATOM 0 HG2 GLN A 2 24.117 32.623 5.942 1.00 0.00 H new ATOM 0 HG3 GLN A 2 25.069 33.512 4.770 1.00 0.00 H new ATOM 0 HE21 GLN A 2 21.979 33.335 5.692 1.00 0.00 H new ATOM 0 HE22 GLN A 2 21.149 33.446 4.136 1.00 0.00 H new ATOM 37 N ILE A 3 27.172 30.658 7.347 1.00 0.00 N ATOM 38 CA ILE A 3 27.009 30.309 8.790 1.00 0.00 C ATOM 39 C ILE A 3 26.951 31.591 9.622 1.00 0.00 C ATOM 40 O ILE A 3 27.814 32.441 9.538 1.00 0.00 O ATOM 41 CB ILE A 3 28.193 29.460 9.247 1.00 0.00 C ATOM 42 CG1 ILE A 3 28.408 28.317 8.253 1.00 0.00 C ATOM 43 CG2 ILE A 3 27.897 28.880 10.633 1.00 0.00 C ATOM 44 CD1 ILE A 3 29.500 27.386 8.778 1.00 0.00 C ATOM 0 H ILE A 3 28.137 30.736 7.027 1.00 0.00 H new ATOM 0 HA ILE A 3 26.085 29.746 8.924 1.00 0.00 H new ATOM 0 HB ILE A 3 29.090 30.077 9.295 1.00 0.00 H new ATOM 0 HG12 ILE A 3 27.480 27.763 8.112 1.00 0.00 H new ATOM 0 HG13 ILE A 3 28.692 28.716 7.279 1.00 0.00 H new ATOM 0 HG21 ILE A 3 28.741 28.273 10.961 1.00 0.00 H new ATOM 0 HG22 ILE A 3 27.737 29.693 11.341 1.00 0.00 H new ATOM 0 HG23 ILE A 3 27.002 28.260 10.584 1.00 0.00 H new ATOM 0 HD11 ILE A 3 29.654 26.571 8.071 1.00 0.00 H new ATOM 0 HD12 ILE A 3 30.429 27.945 8.896 1.00 0.00 H new ATOM 0 HD13 ILE A 3 29.197 26.977 9.742 1.00 0.00 H new ATOM 56 N PHE A 4 25.930 31.735 10.422 1.00 0.00 N ATOM 57 CA PHE A 4 25.795 32.963 11.263 1.00 0.00 C ATOM 58 C PHE A 4 26.475 32.742 12.617 1.00 0.00 C ATOM 59 O PHE A 4 26.665 31.624 13.051 1.00 0.00 O ATOM 60 CB PHE A 4 24.312 33.265 11.485 1.00 0.00 C ATOM 61 CG PHE A 4 23.678 33.673 10.179 1.00 0.00 C ATOM 62 CD1 PHE A 4 23.038 32.717 9.381 1.00 0.00 C ATOM 63 CD2 PHE A 4 23.731 35.009 9.763 1.00 0.00 C ATOM 64 CE1 PHE A 4 22.450 33.096 8.169 1.00 0.00 C ATOM 65 CE2 PHE A 4 23.144 35.389 8.550 1.00 0.00 C ATOM 66 CZ PHE A 4 22.502 34.432 7.753 1.00 0.00 C ATOM 0 H PHE A 4 25.179 31.053 10.531 1.00 0.00 H new ATOM 0 HA PHE A 4 26.270 33.802 10.754 1.00 0.00 H new ATOM 0 HB2 PHE A 4 23.808 32.386 11.887 1.00 0.00 H new ATOM 0 HB3 PHE A 4 24.199 34.062 12.220 1.00 0.00 H new ATOM 0 HD1 PHE A 4 22.998 31.686 9.701 1.00 0.00 H new ATOM 0 HD2 PHE A 4 24.225 35.747 10.378 1.00 0.00 H new ATOM 0 HE1 PHE A 4 21.956 32.358 7.554 1.00 0.00 H new ATOM 0 HE2 PHE A 4 23.186 36.419 8.229 1.00 0.00 H new ATOM 0 HZ PHE A 4 22.047 34.725 6.818 1.00 0.00 H new ATOM 76 N VAL A 5 26.831 33.806 13.293 1.00 0.00 N ATOM 77 CA VAL A 5 27.491 33.673 14.630 1.00 0.00 C ATOM 78 C VAL A 5 26.938 34.749 15.566 1.00 0.00 C ATOM 79 O VAL A 5 27.301 35.905 15.476 1.00 0.00 O ATOM 80 CB VAL A 5 29.000 33.859 14.475 1.00 0.00 C ATOM 81 CG1 VAL A 5 29.675 33.728 15.842 1.00 0.00 C ATOM 82 CG2 VAL A 5 29.552 32.790 13.531 1.00 0.00 C ATOM 0 H VAL A 5 26.693 34.765 12.976 1.00 0.00 H new ATOM 0 HA VAL A 5 27.291 32.685 15.044 1.00 0.00 H new ATOM 0 HB VAL A 5 29.202 34.848 14.063 1.00 0.00 H new ATOM 0 HG11 VAL A 5 30.751 33.861 15.731 1.00 0.00 H new ATOM 0 HG12 VAL A 5 29.283 34.490 16.516 1.00 0.00 H new ATOM 0 HG13 VAL A 5 29.472 32.740 16.255 1.00 0.00 H new ATOM 0 HG21 VAL A 5 30.628 32.923 13.421 1.00 0.00 H new ATOM 0 HG22 VAL A 5 29.349 31.801 13.942 1.00 0.00 H new ATOM 0 HG23 VAL A 5 29.073 32.883 12.556 1.00 0.00 H new ATOM 92 N LYS A 6 26.051 34.384 16.458 1.00 0.00 N ATOM 93 CA LYS A 6 25.461 35.390 17.396 1.00 0.00 C ATOM 94 C LYS A 6 26.183 35.342 18.744 1.00 0.00 C ATOM 95 O LYS A 6 26.309 34.299 19.354 1.00 0.00 O ATOM 96 CB LYS A 6 23.981 35.060 17.613 1.00 0.00 C ATOM 97 CG LYS A 6 23.212 35.259 16.307 1.00 0.00 C ATOM 98 CD LYS A 6 21.773 34.771 16.481 1.00 0.00 C ATOM 99 CE LYS A 6 21.018 34.923 15.157 1.00 0.00 C ATOM 100 NZ LYS A 6 20.908 36.369 14.811 1.00 0.00 N ATOM 0 H LYS A 6 25.709 33.431 16.578 1.00 0.00 H new ATOM 0 HA LYS A 6 25.569 36.386 16.967 1.00 0.00 H new ATOM 0 HB2 LYS A 6 23.874 34.031 17.956 1.00 0.00 H new ATOM 0 HB3 LYS A 6 23.566 35.700 18.392 1.00 0.00 H new ATOM 0 HG2 LYS A 6 23.218 36.312 16.026 1.00 0.00 H new ATOM 0 HG3 LYS A 6 23.698 34.711 15.500 1.00 0.00 H new ATOM 0 HD2 LYS A 6 21.767 33.728 16.797 1.00 0.00 H new ATOM 0 HD3 LYS A 6 21.276 35.344 17.263 1.00 0.00 H new ATOM 0 HE2 LYS A 6 21.540 34.387 14.365 1.00 0.00 H new ATOM 0 HE3 LYS A 6 20.025 34.481 15.239 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 20.045 36.528 14.252 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 20.863 36.932 15.684 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 21.738 36.657 14.255 1.00 0.00 H new ATOM 114 N THR A 7 26.647 36.467 19.221 1.00 0.00 N ATOM 115 CA THR A 7 27.348 36.496 20.539 1.00 0.00 C ATOM 116 C THR A 7 26.328 36.817 21.635 1.00 0.00 C ATOM 117 O THR A 7 25.215 37.219 21.358 1.00 0.00 O ATOM 118 CB THR A 7 28.428 37.581 20.519 1.00 0.00 C ATOM 119 OG1 THR A 7 27.816 38.850 20.343 1.00 0.00 O ATOM 120 CG2 THR A 7 29.400 37.316 19.370 1.00 0.00 C ATOM 0 H THR A 7 26.570 37.370 18.753 1.00 0.00 H new ATOM 0 HA THR A 7 27.811 35.528 20.733 1.00 0.00 H new ATOM 0 HB THR A 7 28.975 37.568 21.462 1.00 0.00 H new ATOM 0 HG1 THR A 7 28.084 39.447 21.073 1.00 0.00 H new ATOM 0 HG21 THR A 7 30.168 38.089 19.357 1.00 0.00 H new ATOM 0 HG22 THR A 7 29.869 36.341 19.507 1.00 0.00 H new ATOM 0 HG23 THR A 7 28.858 37.328 18.425 1.00 0.00 H new ATOM 128 N LEU A 8 26.691 36.644 22.878 1.00 0.00 N ATOM 129 CA LEU A 8 25.731 36.944 23.979 1.00 0.00 C ATOM 130 C LEU A 8 25.526 38.457 24.077 1.00 0.00 C ATOM 131 O LEU A 8 24.499 38.927 24.527 1.00 0.00 O ATOM 132 CB LEU A 8 26.290 36.426 25.307 1.00 0.00 C ATOM 133 CG LEU A 8 26.569 34.921 25.211 1.00 0.00 C ATOM 134 CD1 LEU A 8 27.170 34.432 26.535 1.00 0.00 C ATOM 135 CD2 LEU A 8 25.261 34.160 24.923 1.00 0.00 C ATOM 0 H LEU A 8 27.607 36.309 23.177 1.00 0.00 H new ATOM 0 HA LEU A 8 24.780 36.455 23.769 1.00 0.00 H new ATOM 0 HB2 LEU A 8 27.208 36.959 25.556 1.00 0.00 H new ATOM 0 HB3 LEU A 8 25.580 36.621 26.110 1.00 0.00 H new ATOM 0 HG LEU A 8 27.272 34.736 24.399 1.00 0.00 H new ATOM 0 HD11 LEU A 8 27.370 33.362 26.471 1.00 0.00 H new ATOM 0 HD12 LEU A 8 28.101 34.964 26.730 1.00 0.00 H new ATOM 0 HD13 LEU A 8 26.467 34.622 27.346 1.00 0.00 H new ATOM 0 HD21 LEU A 8 25.469 33.092 24.856 1.00 0.00 H new ATOM 0 HD22 LEU A 8 24.549 34.342 25.728 1.00 0.00 H new ATOM 0 HD23 LEU A 8 24.838 34.507 23.980 1.00 0.00 H new ATOM 147 N THR A 9 26.496 39.225 23.661 1.00 0.00 N ATOM 148 CA THR A 9 26.358 40.707 23.732 1.00 0.00 C ATOM 149 C THR A 9 25.500 41.199 22.563 1.00 0.00 C ATOM 150 O THR A 9 25.288 42.383 22.392 1.00 0.00 O ATOM 151 CB THR A 9 27.744 41.352 23.654 1.00 0.00 C ATOM 152 OG1 THR A 9 28.373 40.971 22.438 1.00 0.00 O ATOM 153 CG2 THR A 9 28.592 40.885 24.838 1.00 0.00 C ATOM 0 H THR A 9 27.379 38.890 23.275 1.00 0.00 H new ATOM 0 HA THR A 9 25.880 40.982 24.672 1.00 0.00 H new ATOM 0 HB THR A 9 27.644 42.437 23.687 1.00 0.00 H new ATOM 0 HG1 THR A 9 29.191 40.469 22.636 1.00 0.00 H new ATOM 0 HG21 THR A 9 29.579 41.344 24.782 1.00 0.00 H new ATOM 0 HG22 THR A 9 28.108 41.177 25.770 1.00 0.00 H new ATOM 0 HG23 THR A 9 28.694 39.800 24.807 1.00 0.00 H new ATOM 161 N GLY A 10 25.007 40.299 21.756 1.00 0.00 N ATOM 162 CA GLY A 10 24.165 40.710 20.593 1.00 0.00 C ATOM 163 C GLY A 10 25.062 40.949 19.379 1.00 0.00 C ATOM 164 O GLY A 10 24.607 40.973 18.252 1.00 0.00 O ATOM 0 H GLY A 10 25.151 39.294 21.851 1.00 0.00 H new ATOM 0 HA2 GLY A 10 23.430 39.936 20.370 1.00 0.00 H new ATOM 0 HA3 GLY A 10 23.610 41.617 20.834 1.00 0.00 H new ATOM 168 N LYS A 11 26.336 41.127 19.598 1.00 0.00 N ATOM 169 CA LYS A 11 27.259 41.361 18.455 1.00 0.00 C ATOM 170 C LYS A 11 27.238 40.141 17.533 1.00 0.00 C ATOM 171 O LYS A 11 27.947 39.177 17.747 1.00 0.00 O ATOM 172 CB LYS A 11 28.682 41.588 18.974 1.00 0.00 C ATOM 173 CG LYS A 11 28.727 42.872 19.808 1.00 0.00 C ATOM 174 CD LYS A 11 30.179 43.322 19.992 1.00 0.00 C ATOM 175 CE LYS A 11 30.936 42.297 20.838 1.00 0.00 C ATOM 176 NZ LYS A 11 32.237 42.877 21.275 1.00 0.00 N ATOM 0 H LYS A 11 26.776 41.120 20.518 1.00 0.00 H new ATOM 0 HA LYS A 11 26.936 42.244 17.903 1.00 0.00 H new ATOM 0 HB2 LYS A 11 28.999 40.738 19.579 1.00 0.00 H new ATOM 0 HB3 LYS A 11 29.377 41.661 18.138 1.00 0.00 H new ATOM 0 HG2 LYS A 11 28.153 43.657 19.315 1.00 0.00 H new ATOM 0 HG3 LYS A 11 28.264 42.701 20.780 1.00 0.00 H new ATOM 0 HD2 LYS A 11 30.661 43.432 19.021 1.00 0.00 H new ATOM 0 HD3 LYS A 11 30.208 44.299 20.475 1.00 0.00 H new ATOM 0 HE2 LYS A 11 30.341 42.016 21.707 1.00 0.00 H new ATOM 0 HE3 LYS A 11 31.106 41.388 20.261 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 32.752 42.180 21.850 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 32.805 43.124 20.440 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 32.063 43.732 21.841 1.00 0.00 H new ATOM 190 N THR A 12 26.423 40.177 16.510 1.00 0.00 N ATOM 191 CA THR A 12 26.339 39.026 15.559 1.00 0.00 C ATOM 192 C THR A 12 27.109 39.368 14.285 1.00 0.00 C ATOM 193 O THR A 12 26.848 40.368 13.646 1.00 0.00 O ATOM 194 CB THR A 12 24.871 38.768 15.206 1.00 0.00 C ATOM 195 OG1 THR A 12 24.154 38.436 16.389 1.00 0.00 O ATOM 196 CG2 THR A 12 24.770 37.613 14.205 1.00 0.00 C ATOM 0 H THR A 12 25.807 40.960 16.291 1.00 0.00 H new ATOM 0 HA THR A 12 26.768 38.137 16.021 1.00 0.00 H new ATOM 0 HB THR A 12 24.445 39.666 14.758 1.00 0.00 H new ATOM 0 HG1 THR A 12 24.127 39.214 16.985 1.00 0.00 H new ATOM 0 HG21 THR A 12 23.723 37.435 13.959 1.00 0.00 H new ATOM 0 HG22 THR A 12 25.318 37.869 13.298 1.00 0.00 H new ATOM 0 HG23 THR A 12 25.197 36.712 14.645 1.00 0.00 H new ATOM 204 N ILE A 13 28.049 38.542 13.903 1.00 0.00 N ATOM 205 CA ILE A 13 28.839 38.799 12.662 1.00 0.00 C ATOM 206 C ILE A 13 28.392 37.814 11.581 1.00 0.00 C ATOM 207 O ILE A 13 27.899 36.739 11.877 1.00 0.00 O ATOM 208 CB ILE A 13 30.326 38.589 12.955 1.00 0.00 C ATOM 209 CG1 ILE A 13 30.786 39.607 14.001 1.00 0.00 C ATOM 210 CG2 ILE A 13 31.133 38.781 11.670 1.00 0.00 C ATOM 211 CD1 ILE A 13 32.192 39.245 14.483 1.00 0.00 C ATOM 0 H ILE A 13 28.305 37.691 14.404 1.00 0.00 H new ATOM 0 HA ILE A 13 28.677 39.822 12.323 1.00 0.00 H new ATOM 0 HB ILE A 13 30.482 37.579 13.334 1.00 0.00 H new ATOM 0 HG12 ILE A 13 30.784 40.610 13.573 1.00 0.00 H new ATOM 0 HG13 ILE A 13 30.093 39.618 14.842 1.00 0.00 H new ATOM 0 HG21 ILE A 13 32.192 38.631 11.880 1.00 0.00 H new ATOM 0 HG22 ILE A 13 30.805 38.058 10.923 1.00 0.00 H new ATOM 0 HG23 ILE A 13 30.978 39.791 11.290 1.00 0.00 H new ATOM 0 HD11 ILE A 13 32.519 39.970 15.228 1.00 0.00 H new ATOM 0 HD12 ILE A 13 32.179 38.250 14.927 1.00 0.00 H new ATOM 0 HD13 ILE A 13 32.881 39.257 13.638 1.00 0.00 H new ATOM 223 N THR A 14 28.568 38.160 10.332 1.00 0.00 N ATOM 224 CA THR A 14 28.165 37.239 9.228 1.00 0.00 C ATOM 225 C THR A 14 29.406 36.508 8.720 1.00 0.00 C ATOM 226 O THR A 14 30.322 37.115 8.198 1.00 0.00 O ATOM 227 CB THR A 14 27.553 38.055 8.084 1.00 0.00 C ATOM 228 OG1 THR A 14 26.403 38.743 8.560 1.00 0.00 O ATOM 229 CG2 THR A 14 27.156 37.120 6.943 1.00 0.00 C ATOM 0 H THR A 14 28.975 39.044 10.028 1.00 0.00 H new ATOM 0 HA THR A 14 27.432 36.519 9.592 1.00 0.00 H new ATOM 0 HB THR A 14 28.284 38.777 7.719 1.00 0.00 H new ATOM 0 HG1 THR A 14 26.010 39.267 7.831 1.00 0.00 H new ATOM 0 HG21 THR A 14 26.721 37.702 6.130 1.00 0.00 H new ATOM 0 HG22 THR A 14 28.039 36.593 6.580 1.00 0.00 H new ATOM 0 HG23 THR A 14 26.425 36.397 7.303 1.00 0.00 H new ATOM 237 N LEU A 15 29.445 35.206 8.869 1.00 0.00 N ATOM 238 CA LEU A 15 30.624 34.412 8.401 1.00 0.00 C ATOM 239 C LEU A 15 30.172 33.457 7.292 1.00 0.00 C ATOM 240 O LEU A 15 29.397 32.551 7.524 1.00 0.00 O ATOM 241 CB LEU A 15 31.174 33.606 9.595 1.00 0.00 C ATOM 242 CG LEU A 15 32.679 33.316 9.406 1.00 0.00 C ATOM 243 CD1 LEU A 15 33.509 34.503 9.917 1.00 0.00 C ATOM 244 CD2 LEU A 15 33.063 32.053 10.191 1.00 0.00 C ATOM 0 H LEU A 15 28.703 34.654 9.299 1.00 0.00 H new ATOM 0 HA LEU A 15 31.401 35.071 8.013 1.00 0.00 H new ATOM 0 HB2 LEU A 15 31.018 34.162 10.519 1.00 0.00 H new ATOM 0 HB3 LEU A 15 30.626 32.668 9.691 1.00 0.00 H new ATOM 0 HG LEU A 15 32.881 33.164 8.346 1.00 0.00 H new ATOM 0 HD11 LEU A 15 34.569 34.291 9.780 1.00 0.00 H new ATOM 0 HD12 LEU A 15 33.243 35.400 9.358 1.00 0.00 H new ATOM 0 HD13 LEU A 15 33.304 34.661 10.976 1.00 0.00 H new ATOM 0 HD21 LEU A 15 34.125 31.850 10.056 1.00 0.00 H new ATOM 0 HD22 LEU A 15 32.854 32.205 11.250 1.00 0.00 H new ATOM 0 HD23 LEU A 15 32.483 31.206 9.825 1.00 0.00 H new ATOM 256 N GLU A 16 30.652 33.651 6.089 1.00 0.00 N ATOM 257 CA GLU A 16 30.256 32.757 4.955 1.00 0.00 C ATOM 258 C GLU A 16 31.420 31.827 4.612 1.00 0.00 C ATOM 259 O GLU A 16 32.500 32.267 4.270 1.00 0.00 O ATOM 260 CB GLU A 16 29.920 33.613 3.731 1.00 0.00 C ATOM 261 CG GLU A 16 29.432 32.711 2.597 1.00 0.00 C ATOM 262 CD GLU A 16 29.010 33.570 1.403 1.00 0.00 C ATOM 263 OE1 GLU A 16 29.073 34.784 1.522 1.00 0.00 O ATOM 264 OE2 GLU A 16 28.634 33.002 0.392 1.00 0.00 O ATOM 0 H GLU A 16 31.305 34.394 5.841 1.00 0.00 H new ATOM 0 HA GLU A 16 29.386 32.166 5.242 1.00 0.00 H new ATOM 0 HB2 GLU A 16 29.152 34.344 3.985 1.00 0.00 H new ATOM 0 HB3 GLU A 16 30.800 34.172 3.412 1.00 0.00 H new ATOM 0 HG2 GLU A 16 30.223 32.022 2.301 1.00 0.00 H new ATOM 0 HG3 GLU A 16 28.592 32.105 2.937 1.00 0.00 H new ATOM 271 N VAL A 17 31.210 30.542 4.701 1.00 0.00 N ATOM 272 CA VAL A 17 32.305 29.585 4.381 1.00 0.00 C ATOM 273 C VAL A 17 31.705 28.221 4.037 1.00 0.00 C ATOM 274 O VAL A 17 30.676 27.834 4.553 1.00 0.00 O ATOM 275 CB VAL A 17 33.239 29.455 5.586 1.00 0.00 C ATOM 276 CG1 VAL A 17 32.416 29.145 6.838 1.00 0.00 C ATOM 277 CG2 VAL A 17 34.244 28.325 5.344 1.00 0.00 C ATOM 0 H VAL A 17 30.327 30.114 4.981 1.00 0.00 H new ATOM 0 HA VAL A 17 32.873 29.952 3.527 1.00 0.00 H new ATOM 0 HB VAL A 17 33.778 30.392 5.725 1.00 0.00 H new ATOM 0 HG11 VAL A 17 33.081 29.052 7.697 1.00 0.00 H new ATOM 0 HG12 VAL A 17 31.705 29.952 7.015 1.00 0.00 H new ATOM 0 HG13 VAL A 17 31.875 28.210 6.695 1.00 0.00 H new ATOM 0 HG21 VAL A 17 34.907 28.237 6.205 1.00 0.00 H new ATOM 0 HG22 VAL A 17 33.709 27.386 5.200 1.00 0.00 H new ATOM 0 HG23 VAL A 17 34.833 28.546 4.454 1.00 0.00 H new ATOM 287 N GLU A 18 32.344 27.496 3.163 1.00 0.00 N ATOM 288 CA GLU A 18 31.816 26.158 2.772 1.00 0.00 C ATOM 289 C GLU A 18 31.835 25.224 3.991 1.00 0.00 C ATOM 290 O GLU A 18 32.661 25.372 4.870 1.00 0.00 O ATOM 291 CB GLU A 18 32.702 25.575 1.667 1.00 0.00 C ATOM 292 CG GLU A 18 32.421 26.298 0.350 1.00 0.00 C ATOM 293 CD GLU A 18 33.339 25.750 -0.741 1.00 0.00 C ATOM 294 OE1 GLU A 18 34.158 24.900 -0.428 1.00 0.00 O ATOM 295 OE2 GLU A 18 33.211 26.188 -1.873 1.00 0.00 O ATOM 0 H GLU A 18 33.211 27.772 2.701 1.00 0.00 H new ATOM 0 HA GLU A 18 30.793 26.257 2.410 1.00 0.00 H new ATOM 0 HB2 GLU A 18 33.753 25.682 1.935 1.00 0.00 H new ATOM 0 HB3 GLU A 18 32.508 24.508 1.556 1.00 0.00 H new ATOM 0 HG2 GLU A 18 31.378 26.162 0.064 1.00 0.00 H new ATOM 0 HG3 GLU A 18 32.581 27.369 0.470 1.00 0.00 H new ATOM 302 N PRO A 19 30.937 24.268 4.053 1.00 0.00 N ATOM 303 CA PRO A 19 30.873 23.307 5.195 1.00 0.00 C ATOM 304 C PRO A 19 32.051 22.323 5.179 1.00 0.00 C ATOM 305 O PRO A 19 32.351 21.681 6.165 1.00 0.00 O ATOM 306 CB PRO A 19 29.538 22.577 4.981 1.00 0.00 C ATOM 307 CG PRO A 19 29.297 22.653 3.508 1.00 0.00 C ATOM 308 CD PRO A 19 29.888 23.990 3.053 1.00 0.00 C ATOM 0 HA PRO A 19 30.935 23.807 6.162 1.00 0.00 H new ATOM 0 HB2 PRO A 19 29.593 21.543 5.321 1.00 0.00 H new ATOM 0 HB3 PRO A 19 28.732 23.053 5.539 1.00 0.00 H new ATOM 0 HG2 PRO A 19 29.773 21.820 2.991 1.00 0.00 H new ATOM 0 HG3 PRO A 19 28.232 22.601 3.284 1.00 0.00 H new ATOM 0 HD2 PRO A 19 30.302 23.923 2.047 1.00 0.00 H new ATOM 0 HD3 PRO A 19 29.133 24.776 3.036 1.00 0.00 H new ATOM 316 N SER A 20 32.719 22.198 4.067 1.00 0.00 N ATOM 317 CA SER A 20 33.871 21.257 4.002 1.00 0.00 C ATOM 318 C SER A 20 35.067 21.876 4.725 1.00 0.00 C ATOM 319 O SER A 20 36.106 21.266 4.867 1.00 0.00 O ATOM 320 CB SER A 20 34.219 20.977 2.546 1.00 0.00 C ATOM 321 OG SER A 20 34.320 22.205 1.839 1.00 0.00 O ATOM 0 H SER A 20 32.519 22.704 3.204 1.00 0.00 H new ATOM 0 HA SER A 20 33.609 20.316 4.486 1.00 0.00 H new ATOM 0 HB2 SER A 20 35.160 20.431 2.484 1.00 0.00 H new ATOM 0 HB3 SER A 20 33.454 20.346 2.093 1.00 0.00 H new ATOM 0 HG SER A 20 34.546 22.026 0.902 1.00 0.00 H new ATOM 327 N ASP A 21 34.917 23.079 5.203 1.00 0.00 N ATOM 328 CA ASP A 21 36.020 23.733 5.938 1.00 0.00 C ATOM 329 C ASP A 21 36.187 23.021 7.285 1.00 0.00 C ATOM 330 O ASP A 21 35.288 22.349 7.749 1.00 0.00 O ATOM 331 CB ASP A 21 35.656 25.204 6.159 1.00 0.00 C ATOM 332 CG ASP A 21 35.994 26.015 4.904 1.00 0.00 C ATOM 333 OD1 ASP A 21 37.107 26.510 4.824 1.00 0.00 O ATOM 334 OD2 ASP A 21 35.138 26.120 4.041 1.00 0.00 O ATOM 0 H ASP A 21 34.068 23.637 5.112 1.00 0.00 H new ATOM 0 HA ASP A 21 36.953 23.676 5.377 1.00 0.00 H new ATOM 0 HB2 ASP A 21 34.594 25.295 6.387 1.00 0.00 H new ATOM 0 HB3 ASP A 21 36.201 25.599 7.016 1.00 0.00 H new ATOM 339 N THR A 22 37.321 23.151 7.919 1.00 0.00 N ATOM 340 CA THR A 22 37.528 22.473 9.231 1.00 0.00 C ATOM 341 C THR A 22 36.956 23.356 10.345 1.00 0.00 C ATOM 342 O THR A 22 36.636 24.508 10.126 1.00 0.00 O ATOM 343 CB THR A 22 39.037 22.271 9.440 1.00 0.00 C ATOM 344 OG1 THR A 22 39.639 21.943 8.197 1.00 0.00 O ATOM 345 CG2 THR A 22 39.285 21.137 10.434 1.00 0.00 C ATOM 0 H THR A 22 38.114 23.698 7.585 1.00 0.00 H new ATOM 0 HA THR A 22 37.023 21.507 9.249 1.00 0.00 H new ATOM 0 HB THR A 22 39.469 23.191 9.835 1.00 0.00 H new ATOM 0 HG1 THR A 22 40.602 21.815 8.324 1.00 0.00 H new ATOM 0 HG21 THR A 22 40.358 21.004 10.574 1.00 0.00 H new ATOM 0 HG22 THR A 22 38.823 21.383 11.390 1.00 0.00 H new ATOM 0 HG23 THR A 22 38.852 20.214 10.049 1.00 0.00 H new ATOM 353 N ILE A 23 36.851 22.847 11.545 1.00 0.00 N ATOM 354 CA ILE A 23 36.330 23.688 12.657 1.00 0.00 C ATOM 355 C ILE A 23 37.437 24.660 13.080 1.00 0.00 C ATOM 356 O ILE A 23 37.223 25.850 13.205 1.00 0.00 O ATOM 357 CB ILE A 23 35.939 22.779 13.835 1.00 0.00 C ATOM 358 CG1 ILE A 23 34.593 22.100 13.550 1.00 0.00 C ATOM 359 CG2 ILE A 23 35.814 23.603 15.123 1.00 0.00 C ATOM 360 CD1 ILE A 23 34.571 21.510 12.137 1.00 0.00 C ATOM 0 H ILE A 23 37.102 21.892 11.800 1.00 0.00 H new ATOM 0 HA ILE A 23 35.451 24.249 12.340 1.00 0.00 H new ATOM 0 HB ILE A 23 36.715 22.024 13.958 1.00 0.00 H new ATOM 0 HG12 ILE A 23 34.416 21.311 14.281 1.00 0.00 H new ATOM 0 HG13 ILE A 23 33.785 22.823 13.660 1.00 0.00 H new ATOM 0 HG21 ILE A 23 35.537 22.948 15.949 1.00 0.00 H new ATOM 0 HG22 ILE A 23 36.769 24.081 15.343 1.00 0.00 H new ATOM 0 HG23 ILE A 23 35.047 24.367 14.993 1.00 0.00 H new ATOM 0 HD11 ILE A 23 33.607 21.034 11.957 1.00 0.00 H new ATOM 0 HD12 ILE A 23 34.725 22.306 11.408 1.00 0.00 H new ATOM 0 HD13 ILE A 23 35.365 20.770 12.039 1.00 0.00 H new ATOM 372 N GLU A 24 38.622 24.157 13.293 1.00 0.00 N ATOM 373 CA GLU A 24 39.752 25.037 13.697 1.00 0.00 C ATOM 374 C GLU A 24 39.927 26.140 12.653 1.00 0.00 C ATOM 375 O GLU A 24 40.452 27.201 12.936 1.00 0.00 O ATOM 376 CB GLU A 24 41.036 24.204 13.786 1.00 0.00 C ATOM 377 CG GLU A 24 41.046 23.158 12.669 1.00 0.00 C ATOM 378 CD GLU A 24 42.455 22.576 12.530 1.00 0.00 C ATOM 379 OE1 GLU A 24 43.091 22.368 13.549 1.00 0.00 O ATOM 380 OE2 GLU A 24 42.871 22.347 11.407 1.00 0.00 O ATOM 0 H GLU A 24 38.856 23.168 13.204 1.00 0.00 H new ATOM 0 HA GLU A 24 39.543 25.485 14.669 1.00 0.00 H new ATOM 0 HB2 GLU A 24 41.909 24.852 13.700 1.00 0.00 H new ATOM 0 HB3 GLU A 24 41.097 23.714 14.758 1.00 0.00 H new ATOM 0 HG2 GLU A 24 40.333 22.364 12.893 1.00 0.00 H new ATOM 0 HG3 GLU A 24 40.733 23.611 11.728 1.00 0.00 H new ATOM 387 N ASN A 25 39.472 25.911 11.454 1.00 0.00 N ATOM 388 CA ASN A 25 39.595 26.956 10.404 1.00 0.00 C ATOM 389 C ASN A 25 38.626 28.082 10.743 1.00 0.00 C ATOM 390 O ASN A 25 38.996 29.235 10.813 1.00 0.00 O ATOM 391 CB ASN A 25 39.241 26.364 9.038 1.00 0.00 C ATOM 392 CG ASN A 25 39.480 27.410 7.949 1.00 0.00 C ATOM 393 OD1 ASN A 25 39.475 28.595 8.218 1.00 0.00 O ATOM 394 ND2 ASN A 25 39.692 27.021 6.721 1.00 0.00 N ATOM 0 H ASN A 25 39.021 25.046 11.157 1.00 0.00 H new ATOM 0 HA ASN A 25 40.617 27.333 10.365 1.00 0.00 H new ATOM 0 HB2 ASN A 25 39.847 25.479 8.846 1.00 0.00 H new ATOM 0 HB3 ASN A 25 38.199 26.045 9.028 1.00 0.00 H new ATOM 0 HD21 ASN A 25 39.853 27.712 5.988 1.00 0.00 H new ATOM 0 HD22 ASN A 25 39.696 26.026 6.495 1.00 0.00 H new ATOM 401 N VAL A 26 37.386 27.750 10.985 1.00 0.00 N ATOM 402 CA VAL A 26 36.395 28.797 11.350 1.00 0.00 C ATOM 403 C VAL A 26 36.953 29.580 12.535 1.00 0.00 C ATOM 404 O VAL A 26 37.215 30.762 12.444 1.00 0.00 O ATOM 405 CB VAL A 26 35.082 28.124 11.757 1.00 0.00 C ATOM 406 CG1 VAL A 26 34.024 29.189 12.042 1.00 0.00 C ATOM 407 CG2 VAL A 26 34.603 27.221 10.621 1.00 0.00 C ATOM 0 H VAL A 26 37.019 26.799 10.945 1.00 0.00 H new ATOM 0 HA VAL A 26 36.211 29.464 10.508 1.00 0.00 H new ATOM 0 HB VAL A 26 35.244 27.528 12.655 1.00 0.00 H new ATOM 0 HG11 VAL A 26 33.091 28.706 12.331 1.00 0.00 H new ATOM 0 HG12 VAL A 26 34.366 29.834 12.852 1.00 0.00 H new ATOM 0 HG13 VAL A 26 33.860 29.788 11.146 1.00 0.00 H new ATOM 0 HG21 VAL A 26 33.668 26.740 10.908 1.00 0.00 H new ATOM 0 HG22 VAL A 26 34.443 27.819 9.724 1.00 0.00 H new ATOM 0 HG23 VAL A 26 35.356 26.459 10.420 1.00 0.00 H new ATOM 417 N LYS A 27 37.129 28.911 13.645 1.00 0.00 N ATOM 418 CA LYS A 27 37.671 29.571 14.869 1.00 0.00 C ATOM 419 C LYS A 27 38.778 30.557 14.485 1.00 0.00 C ATOM 420 O LYS A 27 39.002 31.545 15.153 1.00 0.00 O ATOM 421 CB LYS A 27 38.245 28.496 15.792 1.00 0.00 C ATOM 422 CG LYS A 27 37.113 27.599 16.293 1.00 0.00 C ATOM 423 CD LYS A 27 37.674 26.579 17.288 1.00 0.00 C ATOM 424 CE LYS A 27 36.532 25.729 17.846 1.00 0.00 C ATOM 425 NZ LYS A 27 35.712 26.552 18.780 1.00 0.00 N ATOM 0 H LYS A 27 36.916 27.920 13.756 1.00 0.00 H new ATOM 0 HA LYS A 27 36.874 30.115 15.376 1.00 0.00 H new ATOM 0 HB2 LYS A 27 38.986 27.901 15.258 1.00 0.00 H new ATOM 0 HB3 LYS A 27 38.756 28.960 16.635 1.00 0.00 H new ATOM 0 HG2 LYS A 27 36.341 28.202 16.770 1.00 0.00 H new ATOM 0 HG3 LYS A 27 36.643 27.085 15.454 1.00 0.00 H new ATOM 0 HD2 LYS A 27 38.409 25.942 16.796 1.00 0.00 H new ATOM 0 HD3 LYS A 27 38.189 27.092 18.100 1.00 0.00 H new ATOM 0 HE2 LYS A 27 35.911 25.356 17.032 1.00 0.00 H new ATOM 0 HE3 LYS A 27 36.932 24.859 18.366 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 34.861 26.021 19.055 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 36.271 26.774 19.629 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 35.432 27.436 18.309 1.00 0.00 H new ATOM 439 N ALA A 28 39.471 30.293 13.412 1.00 0.00 N ATOM 440 CA ALA A 28 40.561 31.215 12.988 1.00 0.00 C ATOM 441 C ALA A 28 39.958 32.560 12.555 1.00 0.00 C ATOM 442 O ALA A 28 40.281 33.598 13.096 1.00 0.00 O ATOM 443 CB ALA A 28 41.327 30.586 11.820 1.00 0.00 C ATOM 0 H ALA A 28 39.330 29.480 12.812 1.00 0.00 H new ATOM 0 HA ALA A 28 41.245 31.384 13.820 1.00 0.00 H new ATOM 0 HB1 ALA A 28 42.126 31.257 11.506 1.00 0.00 H new ATOM 0 HB2 ALA A 28 41.755 29.635 12.136 1.00 0.00 H new ATOM 0 HB3 ALA A 28 40.645 30.418 10.986 1.00 0.00 H new ATOM 449 N LYS A 29 39.089 32.549 11.579 1.00 0.00 N ATOM 450 CA LYS A 29 38.475 33.829 11.114 1.00 0.00 C ATOM 451 C LYS A 29 37.851 34.558 12.306 1.00 0.00 C ATOM 452 O LYS A 29 37.742 35.764 12.320 1.00 0.00 O ATOM 453 CB LYS A 29 37.392 33.539 10.063 1.00 0.00 C ATOM 454 CG LYS A 29 38.026 33.015 8.744 1.00 0.00 C ATOM 455 CD LYS A 29 37.960 31.477 8.683 1.00 0.00 C ATOM 456 CE LYS A 29 36.595 31.033 8.148 1.00 0.00 C ATOM 457 NZ LYS A 29 36.537 29.544 8.111 1.00 0.00 N ATOM 0 H LYS A 29 38.778 31.713 11.085 1.00 0.00 H new ATOM 0 HA LYS A 29 39.247 34.455 10.667 1.00 0.00 H new ATOM 0 HB2 LYS A 29 36.690 32.801 10.452 1.00 0.00 H new ATOM 0 HB3 LYS A 29 36.822 34.446 9.862 1.00 0.00 H new ATOM 0 HG2 LYS A 29 37.502 33.441 7.888 1.00 0.00 H new ATOM 0 HG3 LYS A 29 39.064 33.343 8.678 1.00 0.00 H new ATOM 0 HD2 LYS A 29 38.753 31.096 8.040 1.00 0.00 H new ATOM 0 HD3 LYS A 29 38.125 31.058 9.676 1.00 0.00 H new ATOM 0 HE2 LYS A 29 35.799 31.423 8.783 1.00 0.00 H new ATOM 0 HE3 LYS A 29 36.434 31.439 7.149 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 36.562 29.220 7.123 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 37.352 29.152 8.625 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 35.656 29.220 8.559 1.00 0.00 H new ATOM 471 N ILE A 30 37.443 33.835 13.308 1.00 0.00 N ATOM 472 CA ILE A 30 36.834 34.490 14.497 1.00 0.00 C ATOM 473 C ILE A 30 37.948 35.013 15.415 1.00 0.00 C ATOM 474 O ILE A 30 38.098 36.200 15.615 1.00 0.00 O ATOM 475 CB ILE A 30 35.986 33.460 15.246 1.00 0.00 C ATOM 476 CG1 ILE A 30 34.776 33.079 14.389 1.00 0.00 C ATOM 477 CG2 ILE A 30 35.504 34.057 16.569 1.00 0.00 C ATOM 478 CD1 ILE A 30 34.080 31.862 14.999 1.00 0.00 C ATOM 0 H ILE A 30 37.505 32.818 13.356 1.00 0.00 H new ATOM 0 HA ILE A 30 36.207 35.325 14.185 1.00 0.00 H new ATOM 0 HB ILE A 30 36.586 32.573 15.447 1.00 0.00 H new ATOM 0 HG12 ILE A 30 34.081 33.917 14.330 1.00 0.00 H new ATOM 0 HG13 ILE A 30 35.094 32.856 13.371 1.00 0.00 H new ATOM 0 HG21 ILE A 30 34.900 33.322 17.101 1.00 0.00 H new ATOM 0 HG22 ILE A 30 36.364 34.330 17.180 1.00 0.00 H new ATOM 0 HG23 ILE A 30 34.903 34.945 16.370 1.00 0.00 H new ATOM 0 HD11 ILE A 30 33.219 31.591 14.388 1.00 0.00 H new ATOM 0 HD12 ILE A 30 34.777 31.025 15.035 1.00 0.00 H new ATOM 0 HD13 ILE A 30 33.748 32.101 16.009 1.00 0.00 H new ATOM 490 N GLN A 31 38.710 34.119 15.983 1.00 0.00 N ATOM 491 CA GLN A 31 39.808 34.512 16.909 1.00 0.00 C ATOM 492 C GLN A 31 40.541 35.764 16.400 1.00 0.00 C ATOM 493 O GLN A 31 40.828 36.670 17.154 1.00 0.00 O ATOM 494 CB GLN A 31 40.799 33.351 17.010 1.00 0.00 C ATOM 495 CG GLN A 31 41.734 33.585 18.193 1.00 0.00 C ATOM 496 CD GLN A 31 42.942 32.652 18.088 1.00 0.00 C ATOM 497 OE1 GLN A 31 42.833 31.551 17.587 1.00 0.00 O ATOM 498 NE2 GLN A 31 44.100 33.049 18.541 1.00 0.00 N ATOM 0 H GLN A 31 38.615 33.113 15.841 1.00 0.00 H new ATOM 0 HA GLN A 31 39.382 34.742 17.886 1.00 0.00 H new ATOM 0 HB2 GLN A 31 40.263 32.411 17.136 1.00 0.00 H new ATOM 0 HB3 GLN A 31 41.375 33.268 16.088 1.00 0.00 H new ATOM 0 HG2 GLN A 31 42.065 34.624 18.208 1.00 0.00 H new ATOM 0 HG3 GLN A 31 41.204 33.406 19.129 1.00 0.00 H new ATOM 0 HE21 GLN A 31 44.193 33.973 18.962 1.00 0.00 H new ATOM 0 HE22 GLN A 31 44.912 32.435 18.474 1.00 0.00 H new ATOM 507 N ASP A 32 40.859 35.814 15.137 1.00 0.00 N ATOM 508 CA ASP A 32 41.590 37.005 14.600 1.00 0.00 C ATOM 509 C ASP A 32 40.666 38.231 14.572 1.00 0.00 C ATOM 510 O ASP A 32 40.988 39.279 15.095 1.00 0.00 O ATOM 511 CB ASP A 32 42.073 36.704 13.180 1.00 0.00 C ATOM 512 CG ASP A 32 43.199 35.670 13.232 1.00 0.00 C ATOM 513 OD1 ASP A 32 43.716 35.439 14.312 1.00 0.00 O ATOM 514 OD2 ASP A 32 43.525 35.125 12.190 1.00 0.00 O ATOM 0 H ASP A 32 40.648 35.088 14.453 1.00 0.00 H new ATOM 0 HA ASP A 32 42.441 37.218 15.246 1.00 0.00 H new ATOM 0 HB2 ASP A 32 41.247 36.328 12.576 1.00 0.00 H new ATOM 0 HB3 ASP A 32 42.426 37.618 12.703 1.00 0.00 H new ATOM 519 N LYS A 33 39.536 38.107 13.942 1.00 0.00 N ATOM 520 CA LYS A 33 38.596 39.257 13.842 1.00 0.00 C ATOM 521 C LYS A 33 38.179 39.728 15.245 1.00 0.00 C ATOM 522 O LYS A 33 38.060 40.913 15.493 1.00 0.00 O ATOM 523 CB LYS A 33 37.369 38.822 13.043 1.00 0.00 C ATOM 524 CG LYS A 33 37.641 38.918 11.530 1.00 0.00 C ATOM 525 CD LYS A 33 39.027 38.358 11.163 1.00 0.00 C ATOM 526 CE LYS A 33 39.083 38.078 9.658 1.00 0.00 C ATOM 527 NZ LYS A 33 40.467 37.679 9.278 1.00 0.00 N ATOM 0 H LYS A 33 39.219 37.251 13.487 1.00 0.00 H new ATOM 0 HA LYS A 33 39.087 40.089 13.336 1.00 0.00 H new ATOM 0 HB2 LYS A 33 37.103 37.798 13.305 1.00 0.00 H new ATOM 0 HB3 LYS A 33 36.517 39.450 13.305 1.00 0.00 H new ATOM 0 HG2 LYS A 33 36.872 38.370 10.987 1.00 0.00 H new ATOM 0 HG3 LYS A 33 37.574 39.959 11.214 1.00 0.00 H new ATOM 0 HD2 LYS A 33 39.804 39.071 11.440 1.00 0.00 H new ATOM 0 HD3 LYS A 33 39.220 37.442 11.721 1.00 0.00 H new ATOM 0 HE2 LYS A 33 38.381 37.286 9.398 1.00 0.00 H new ATOM 0 HE3 LYS A 33 38.783 38.965 9.101 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 40.505 37.489 8.256 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 41.127 38.448 9.512 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 40.737 36.821 9.800 1.00 0.00 H new ATOM 541 N GLU A 34 37.956 38.827 16.165 1.00 0.00 N ATOM 542 CA GLU A 34 37.550 39.247 17.542 1.00 0.00 C ATOM 543 C GLU A 34 38.795 39.371 18.429 1.00 0.00 C ATOM 544 O GLU A 34 38.782 40.032 19.447 1.00 0.00 O ATOM 545 CB GLU A 34 36.604 38.200 18.134 1.00 0.00 C ATOM 546 CG GLU A 34 35.507 37.870 17.120 1.00 0.00 C ATOM 547 CD GLU A 34 34.380 37.106 17.816 1.00 0.00 C ATOM 548 OE1 GLU A 34 34.681 36.325 18.705 1.00 0.00 O ATOM 549 OE2 GLU A 34 33.235 37.315 17.451 1.00 0.00 O ATOM 0 H GLU A 34 38.037 37.820 16.025 1.00 0.00 H new ATOM 0 HA GLU A 34 37.043 40.211 17.493 1.00 0.00 H new ATOM 0 HB2 GLU A 34 37.159 37.298 18.392 1.00 0.00 H new ATOM 0 HB3 GLU A 34 36.160 38.576 19.056 1.00 0.00 H new ATOM 0 HG2 GLU A 34 35.119 38.787 16.677 1.00 0.00 H new ATOM 0 HG3 GLU A 34 35.917 37.272 16.306 1.00 0.00 H new ATOM 556 N GLY A 35 39.872 38.741 18.045 1.00 0.00 N ATOM 557 CA GLY A 35 41.120 38.823 18.860 1.00 0.00 C ATOM 558 C GLY A 35 40.909 38.106 20.192 1.00 0.00 C ATOM 559 O GLY A 35 41.704 38.218 21.106 1.00 0.00 O ATOM 0 H GLY A 35 39.943 38.172 17.201 1.00 0.00 H new ATOM 0 HA2 GLY A 35 41.950 38.370 18.319 1.00 0.00 H new ATOM 0 HA3 GLY A 35 41.385 39.866 19.035 1.00 0.00 H new ATOM 563 N ILE A 36 39.838 37.376 20.311 1.00 0.00 N ATOM 564 CA ILE A 36 39.548 36.649 21.569 1.00 0.00 C ATOM 565 C ILE A 36 40.211 35.259 21.532 1.00 0.00 C ATOM 566 O ILE A 36 39.840 34.432 20.723 1.00 0.00 O ATOM 567 CB ILE A 36 38.042 36.488 21.675 1.00 0.00 C ATOM 568 CG1 ILE A 36 37.412 37.880 21.662 1.00 0.00 C ATOM 569 CG2 ILE A 36 37.700 35.770 22.979 1.00 0.00 C ATOM 570 CD1 ILE A 36 35.897 37.755 21.693 1.00 0.00 C ATOM 0 H ILE A 36 39.142 37.252 19.576 1.00 0.00 H new ATOM 0 HA ILE A 36 39.938 37.200 22.425 1.00 0.00 H new ATOM 0 HB ILE A 36 37.659 35.900 20.841 1.00 0.00 H new ATOM 0 HG12 ILE A 36 37.757 38.454 22.522 1.00 0.00 H new ATOM 0 HG13 ILE A 36 37.724 38.423 20.770 1.00 0.00 H new ATOM 0 HG21 ILE A 36 36.619 35.653 23.057 1.00 0.00 H new ATOM 0 HG22 ILE A 36 38.173 34.788 22.988 1.00 0.00 H new ATOM 0 HG23 ILE A 36 38.064 36.356 23.823 1.00 0.00 H new ATOM 0 HD11 ILE A 36 35.450 38.749 21.684 1.00 0.00 H new ATOM 0 HD12 ILE A 36 35.560 37.197 20.819 1.00 0.00 H new ATOM 0 HD13 ILE A 36 35.594 37.229 22.598 1.00 0.00 H new ATOM 582 N PRO A 37 41.172 34.980 22.388 1.00 0.00 N ATOM 583 CA PRO A 37 41.844 33.647 22.406 1.00 0.00 C ATOM 584 C PRO A 37 40.826 32.499 22.309 1.00 0.00 C ATOM 585 O PRO A 37 39.672 32.666 22.646 1.00 0.00 O ATOM 586 CB PRO A 37 42.564 33.631 23.760 1.00 0.00 C ATOM 587 CG PRO A 37 42.872 35.066 24.043 1.00 0.00 C ATOM 588 CD PRO A 37 41.730 35.879 23.421 1.00 0.00 C ATOM 0 HA PRO A 37 42.517 33.505 21.560 1.00 0.00 H new ATOM 0 HB2 PRO A 37 41.934 33.200 24.538 1.00 0.00 H new ATOM 0 HB3 PRO A 37 43.473 33.032 23.718 1.00 0.00 H new ATOM 0 HG2 PRO A 37 42.938 35.246 25.116 1.00 0.00 H new ATOM 0 HG3 PRO A 37 43.832 35.350 23.612 1.00 0.00 H new ATOM 0 HD2 PRO A 37 40.979 36.147 24.165 1.00 0.00 H new ATOM 0 HD3 PRO A 37 42.094 36.810 22.986 1.00 0.00 H new ATOM 596 N PRO A 38 41.244 31.346 21.845 1.00 0.00 N ATOM 597 CA PRO A 38 40.347 30.160 21.696 1.00 0.00 C ATOM 598 C PRO A 38 40.027 29.486 23.038 1.00 0.00 C ATOM 599 O PRO A 38 39.101 28.708 23.145 1.00 0.00 O ATOM 600 CB PRO A 38 41.158 29.228 20.796 1.00 0.00 C ATOM 601 CG PRO A 38 42.561 29.521 21.176 1.00 0.00 C ATOM 602 CD PRO A 38 42.616 31.030 21.411 1.00 0.00 C ATOM 0 HA PRO A 38 39.372 30.430 21.289 1.00 0.00 H new ATOM 0 HB2 PRO A 38 40.905 28.182 20.968 1.00 0.00 H new ATOM 0 HB3 PRO A 38 40.977 29.430 19.740 1.00 0.00 H new ATOM 0 HG2 PRO A 38 42.846 28.974 22.074 1.00 0.00 H new ATOM 0 HG3 PRO A 38 43.251 29.222 20.388 1.00 0.00 H new ATOM 0 HD2 PRO A 38 43.351 31.294 22.171 1.00 0.00 H new ATOM 0 HD3 PRO A 38 42.887 31.570 20.504 1.00 0.00 H new ATOM 610 N ASP A 39 40.791 29.772 24.057 1.00 0.00 N ATOM 611 CA ASP A 39 40.535 29.142 25.387 1.00 0.00 C ATOM 612 C ASP A 39 39.516 29.973 26.169 1.00 0.00 C ATOM 613 O ASP A 39 38.965 29.526 27.156 1.00 0.00 O ATOM 614 CB ASP A 39 41.845 29.076 26.173 1.00 0.00 C ATOM 615 CG ASP A 39 42.773 28.040 25.535 1.00 0.00 C ATOM 616 OD1 ASP A 39 42.294 27.264 24.725 1.00 0.00 O ATOM 617 OD2 ASP A 39 43.946 28.041 25.867 1.00 0.00 O ATOM 0 H ASP A 39 41.582 30.415 24.027 1.00 0.00 H new ATOM 0 HA ASP A 39 40.140 28.137 25.240 1.00 0.00 H new ATOM 0 HB2 ASP A 39 42.326 30.054 26.181 1.00 0.00 H new ATOM 0 HB3 ASP A 39 41.645 28.810 27.211 1.00 0.00 H new ATOM 622 N GLN A 40 39.265 31.182 25.743 1.00 0.00 N ATOM 623 CA GLN A 40 38.288 32.053 26.462 1.00 0.00 C ATOM 624 C GLN A 40 36.926 31.995 25.761 1.00 0.00 C ATOM 625 O GLN A 40 36.025 32.742 26.084 1.00 0.00 O ATOM 626 CB GLN A 40 38.805 33.493 26.444 1.00 0.00 C ATOM 627 CG GLN A 40 39.941 33.640 27.458 1.00 0.00 C ATOM 628 CD GLN A 40 39.362 33.653 28.874 1.00 0.00 C ATOM 629 OE1 GLN A 40 39.469 32.681 29.595 1.00 0.00 O ATOM 630 NE2 GLN A 40 38.752 34.722 29.306 1.00 0.00 N ATOM 0 H GLN A 40 39.697 31.607 24.923 1.00 0.00 H new ATOM 0 HA GLN A 40 38.176 31.707 27.490 1.00 0.00 H new ATOM 0 HB2 GLN A 40 39.159 33.751 25.446 1.00 0.00 H new ATOM 0 HB3 GLN A 40 37.997 34.184 26.685 1.00 0.00 H new ATOM 0 HG2 GLN A 40 40.648 32.817 27.350 1.00 0.00 H new ATOM 0 HG3 GLN A 40 40.493 34.561 27.271 1.00 0.00 H new ATOM 0 HE21 GLN A 40 38.662 35.538 28.700 1.00 0.00 H new ATOM 0 HE22 GLN A 40 38.365 34.742 30.249 1.00 0.00 H new ATOM 639 N GLN A 41 36.775 31.127 24.792 1.00 0.00 N ATOM 640 CA GLN A 41 35.481 31.032 24.058 1.00 0.00 C ATOM 641 C GLN A 41 35.126 29.570 23.786 1.00 0.00 C ATOM 642 O GLN A 41 35.968 28.763 23.446 1.00 0.00 O ATOM 643 CB GLN A 41 35.619 31.763 22.726 1.00 0.00 C ATOM 644 CG GLN A 41 36.849 31.247 21.978 1.00 0.00 C ATOM 645 CD GLN A 41 37.033 32.049 20.688 1.00 0.00 C ATOM 646 OE1 GLN A 41 36.460 31.721 19.669 1.00 0.00 O ATOM 647 NE2 GLN A 41 37.814 33.094 20.690 1.00 0.00 N ATOM 0 H GLN A 41 37.497 30.478 24.478 1.00 0.00 H new ATOM 0 HA GLN A 41 34.693 31.480 24.664 1.00 0.00 H new ATOM 0 HB2 GLN A 41 34.724 31.610 22.122 1.00 0.00 H new ATOM 0 HB3 GLN A 41 35.709 32.836 22.897 1.00 0.00 H new ATOM 0 HG2 GLN A 41 37.735 31.339 22.606 1.00 0.00 H new ATOM 0 HG3 GLN A 41 36.730 30.188 21.747 1.00 0.00 H new ATOM 0 HE21 GLN A 41 38.295 33.369 21.546 1.00 0.00 H new ATOM 0 HE22 GLN A 41 37.943 33.636 19.835 1.00 0.00 H new ATOM 656 N ARG A 42 33.867 29.237 23.914 1.00 0.00 N ATOM 657 CA ARG A 42 33.400 27.844 23.646 1.00 0.00 C ATOM 658 C ARG A 42 32.179 27.939 22.736 1.00 0.00 C ATOM 659 O ARG A 42 31.251 28.674 23.014 1.00 0.00 O ATOM 660 CB ARG A 42 33.012 27.166 24.962 1.00 0.00 C ATOM 661 CG ARG A 42 34.275 26.819 25.764 1.00 0.00 C ATOM 662 CD ARG A 42 35.093 25.704 25.079 1.00 0.00 C ATOM 663 NE ARG A 42 34.192 24.748 24.372 1.00 0.00 N ATOM 664 CZ ARG A 42 34.658 23.999 23.409 1.00 0.00 C ATOM 665 NH1 ARG A 42 33.868 23.162 22.793 1.00 0.00 N ATOM 666 NH2 ARG A 42 35.915 24.082 23.065 1.00 0.00 N ATOM 0 H ARG A 42 33.131 29.883 24.198 1.00 0.00 H new ATOM 0 HA ARG A 42 34.188 27.257 23.175 1.00 0.00 H new ATOM 0 HB2 ARG A 42 32.370 27.826 25.546 1.00 0.00 H new ATOM 0 HB3 ARG A 42 32.439 26.261 24.760 1.00 0.00 H new ATOM 0 HG2 ARG A 42 34.893 27.710 25.874 1.00 0.00 H new ATOM 0 HG3 ARG A 42 33.994 26.501 26.768 1.00 0.00 H new ATOM 0 HD2 ARG A 42 35.794 26.144 24.369 1.00 0.00 H new ATOM 0 HD3 ARG A 42 35.685 25.171 25.823 1.00 0.00 H new ATOM 0 HE ARG A 42 33.211 24.679 24.641 1.00 0.00 H new ATOM 0 HH11 ARG A 42 32.887 23.093 23.064 1.00 0.00 H new ATOM 0 HH12 ARG A 42 34.232 22.577 22.041 1.00 0.00 H new ATOM 0 HH21 ARG A 42 36.534 24.732 23.549 1.00 0.00 H new ATOM 0 HH22 ARG A 42 36.278 23.496 22.313 1.00 0.00 H new ATOM 680 N LEU A 43 32.167 27.233 21.640 1.00 0.00 N ATOM 681 CA LEU A 43 31.002 27.330 20.716 1.00 0.00 C ATOM 682 C LEU A 43 29.920 26.324 21.102 1.00 0.00 C ATOM 683 O LEU A 43 30.197 25.218 21.518 1.00 0.00 O ATOM 684 CB LEU A 43 31.457 27.050 19.288 1.00 0.00 C ATOM 685 CG LEU A 43 32.727 27.842 18.969 1.00 0.00 C ATOM 686 CD1 LEU A 43 32.958 27.795 17.466 1.00 0.00 C ATOM 687 CD2 LEU A 43 32.562 29.302 19.401 1.00 0.00 C ATOM 0 H LEU A 43 32.908 26.597 21.345 1.00 0.00 H new ATOM 0 HA LEU A 43 30.590 28.337 20.787 1.00 0.00 H new ATOM 0 HB2 LEU A 43 31.644 25.984 19.161 1.00 0.00 H new ATOM 0 HB3 LEU A 43 30.667 27.320 18.588 1.00 0.00 H new ATOM 0 HG LEU A 43 33.571 27.407 19.504 1.00 0.00 H new ATOM 0 HD11 LEU A 43 33.860 28.355 17.219 1.00 0.00 H new ATOM 0 HD12 LEU A 43 33.075 26.759 17.148 1.00 0.00 H new ATOM 0 HD13 LEU A 43 32.104 28.237 16.953 1.00 0.00 H new ATOM 0 HD21 LEU A 43 33.472 29.855 19.169 1.00 0.00 H new ATOM 0 HD22 LEU A 43 31.721 29.746 18.868 1.00 0.00 H new ATOM 0 HD23 LEU A 43 32.375 29.345 20.474 1.00 0.00 H new ATOM 699 N ILE A 44 28.684 26.712 20.933 1.00 0.00 N ATOM 700 CA ILE A 44 27.531 25.811 21.249 1.00 0.00 C ATOM 701 C ILE A 44 26.691 25.656 19.983 1.00 0.00 C ATOM 702 O ILE A 44 26.415 26.620 19.294 1.00 0.00 O ATOM 703 CB ILE A 44 26.669 26.440 22.350 1.00 0.00 C ATOM 704 CG1 ILE A 44 27.508 26.653 23.623 1.00 0.00 C ATOM 705 CG2 ILE A 44 25.477 25.522 22.661 1.00 0.00 C ATOM 706 CD1 ILE A 44 28.148 25.334 24.090 1.00 0.00 C ATOM 0 H ILE A 44 28.418 27.632 20.583 1.00 0.00 H new ATOM 0 HA ILE A 44 27.895 24.842 21.592 1.00 0.00 H new ATOM 0 HB ILE A 44 26.301 27.406 22.004 1.00 0.00 H new ATOM 0 HG12 ILE A 44 28.287 27.391 23.430 1.00 0.00 H new ATOM 0 HG13 ILE A 44 26.877 27.056 24.415 1.00 0.00 H new ATOM 0 HG21 ILE A 44 24.866 25.972 23.444 1.00 0.00 H new ATOM 0 HG22 ILE A 44 24.875 25.390 21.762 1.00 0.00 H new ATOM 0 HG23 ILE A 44 25.843 24.552 22.998 1.00 0.00 H new ATOM 0 HD11 ILE A 44 28.735 25.513 24.991 1.00 0.00 H new ATOM 0 HD12 ILE A 44 27.366 24.606 24.306 1.00 0.00 H new ATOM 0 HD13 ILE A 44 28.797 24.947 23.305 1.00 0.00 H new ATOM 718 N PHE A 45 26.293 24.456 19.651 1.00 0.00 N ATOM 719 CA PHE A 45 25.487 24.248 18.413 1.00 0.00 C ATOM 720 C PHE A 45 24.469 23.124 18.644 1.00 0.00 C ATOM 721 O PHE A 45 24.808 21.957 18.651 1.00 0.00 O ATOM 722 CB PHE A 45 26.435 23.864 17.271 1.00 0.00 C ATOM 723 CG PHE A 45 25.643 23.386 16.078 1.00 0.00 C ATOM 724 CD1 PHE A 45 25.144 24.311 15.154 1.00 0.00 C ATOM 725 CD2 PHE A 45 25.409 22.020 15.900 1.00 0.00 C ATOM 726 CE1 PHE A 45 24.409 23.866 14.048 1.00 0.00 C ATOM 727 CE2 PHE A 45 24.676 21.574 14.795 1.00 0.00 C ATOM 728 CZ PHE A 45 24.174 22.497 13.869 1.00 0.00 C ATOM 0 H PHE A 45 26.492 23.610 20.185 1.00 0.00 H new ATOM 0 HA PHE A 45 24.951 25.162 18.158 1.00 0.00 H new ATOM 0 HB2 PHE A 45 27.046 24.722 16.991 1.00 0.00 H new ATOM 0 HB3 PHE A 45 27.117 23.081 17.602 1.00 0.00 H new ATOM 0 HD1 PHE A 45 25.325 25.366 15.294 1.00 0.00 H new ATOM 0 HD2 PHE A 45 25.794 21.308 16.615 1.00 0.00 H new ATOM 0 HE1 PHE A 45 24.024 24.578 13.333 1.00 0.00 H new ATOM 0 HE2 PHE A 45 24.497 20.518 14.656 1.00 0.00 H new ATOM 0 HZ PHE A 45 23.606 22.153 13.017 1.00 0.00 H new ATOM 738 N ALA A 46 23.225 23.472 18.811 1.00 0.00 N ATOM 739 CA ALA A 46 22.169 22.438 19.014 1.00 0.00 C ATOM 740 C ALA A 46 22.440 21.609 20.276 1.00 0.00 C ATOM 741 O ALA A 46 22.024 20.471 20.370 1.00 0.00 O ATOM 742 CB ALA A 46 22.130 21.511 17.795 1.00 0.00 C ATOM 0 H ALA A 46 22.890 24.435 18.816 1.00 0.00 H new ATOM 0 HA ALA A 46 21.211 22.943 19.136 1.00 0.00 H new ATOM 0 HB1 ALA A 46 21.360 20.753 17.939 1.00 0.00 H new ATOM 0 HB2 ALA A 46 21.904 22.094 16.902 1.00 0.00 H new ATOM 0 HB3 ALA A 46 23.099 21.026 17.676 1.00 0.00 H new ATOM 748 N GLY A 47 23.111 22.158 21.256 1.00 0.00 N ATOM 749 CA GLY A 47 23.371 21.379 22.507 1.00 0.00 C ATOM 750 C GLY A 47 24.691 20.609 22.399 1.00 0.00 C ATOM 751 O GLY A 47 25.058 19.876 23.296 1.00 0.00 O ATOM 0 H GLY A 47 23.488 23.106 21.246 1.00 0.00 H new ATOM 0 HA2 GLY A 47 23.407 22.055 23.362 1.00 0.00 H new ATOM 0 HA3 GLY A 47 22.551 20.683 22.685 1.00 0.00 H new ATOM 755 N LYS A 48 25.408 20.764 21.312 1.00 0.00 N ATOM 756 CA LYS A 48 26.710 20.040 21.143 1.00 0.00 C ATOM 757 C LYS A 48 27.791 21.043 20.738 1.00 0.00 C ATOM 758 O LYS A 48 27.511 22.041 20.110 1.00 0.00 O ATOM 759 CB LYS A 48 26.564 18.988 20.051 1.00 0.00 C ATOM 760 CG LYS A 48 25.497 17.969 20.457 1.00 0.00 C ATOM 761 CD LYS A 48 25.365 16.907 19.366 1.00 0.00 C ATOM 762 CE LYS A 48 24.255 15.923 19.743 1.00 0.00 C ATOM 763 NZ LYS A 48 24.620 15.223 21.005 1.00 0.00 N ATOM 0 H LYS A 48 25.147 21.364 20.530 1.00 0.00 H new ATOM 0 HA LYS A 48 26.987 19.557 22.080 1.00 0.00 H new ATOM 0 HB2 LYS A 48 26.288 19.463 19.110 1.00 0.00 H new ATOM 0 HB3 LYS A 48 27.517 18.485 19.887 1.00 0.00 H new ATOM 0 HG2 LYS A 48 25.767 17.501 21.404 1.00 0.00 H new ATOM 0 HG3 LYS A 48 24.541 18.469 20.610 1.00 0.00 H new ATOM 0 HD2 LYS A 48 25.138 17.379 18.410 1.00 0.00 H new ATOM 0 HD3 LYS A 48 26.309 16.377 19.244 1.00 0.00 H new ATOM 0 HE2 LYS A 48 23.311 16.454 19.869 1.00 0.00 H new ATOM 0 HE3 LYS A 48 24.109 15.198 18.942 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 24.045 14.362 21.103 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 25.627 14.966 20.980 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 24.443 15.852 21.814 1.00 0.00 H new ATOM 777 N GLN A 49 29.029 20.785 21.085 1.00 0.00 N ATOM 778 CA GLN A 49 30.128 21.719 20.715 1.00 0.00 C ATOM 779 C GLN A 49 30.869 21.171 19.493 1.00 0.00 C ATOM 780 O GLN A 49 30.692 20.029 19.116 1.00 0.00 O ATOM 781 CB GLN A 49 31.100 21.839 21.884 1.00 0.00 C ATOM 782 CG GLN A 49 30.318 22.071 23.178 1.00 0.00 C ATOM 783 CD GLN A 49 31.297 22.237 24.342 1.00 0.00 C ATOM 784 OE1 GLN A 49 31.971 23.241 24.447 1.00 0.00 O ATOM 785 NE2 GLN A 49 31.402 21.283 25.228 1.00 0.00 N ATOM 0 H GLN A 49 29.323 19.962 21.611 1.00 0.00 H new ATOM 0 HA GLN A 49 29.713 22.699 20.481 1.00 0.00 H new ATOM 0 HB2 GLN A 49 31.699 20.932 21.967 1.00 0.00 H new ATOM 0 HB3 GLN A 49 31.792 22.664 21.712 1.00 0.00 H new ATOM 0 HG2 GLN A 49 29.694 22.960 23.084 1.00 0.00 H new ATOM 0 HG3 GLN A 49 29.650 21.231 23.368 1.00 0.00 H new ATOM 0 HE21 GLN A 49 30.835 20.440 25.139 1.00 0.00 H new ATOM 0 HE22 GLN A 49 32.051 21.381 26.009 1.00 0.00 H new ATOM 794 N LEU A 50 31.700 21.971 18.873 1.00 0.00 N ATOM 795 CA LEU A 50 32.461 21.500 17.672 1.00 0.00 C ATOM 796 C LEU A 50 33.913 21.231 18.070 1.00 0.00 C ATOM 797 O LEU A 50 34.553 22.047 18.703 1.00 0.00 O ATOM 798 CB LEU A 50 32.430 22.587 16.595 1.00 0.00 C ATOM 799 CG LEU A 50 30.999 23.099 16.411 1.00 0.00 C ATOM 800 CD1 LEU A 50 30.987 24.197 15.347 1.00 0.00 C ATOM 801 CD2 LEU A 50 30.090 21.946 15.968 1.00 0.00 C ATOM 0 H LEU A 50 31.886 22.936 19.148 1.00 0.00 H new ATOM 0 HA LEU A 50 32.008 20.587 17.286 1.00 0.00 H new ATOM 0 HB2 LEU A 50 33.086 23.410 16.878 1.00 0.00 H new ATOM 0 HB3 LEU A 50 32.807 22.188 15.653 1.00 0.00 H new ATOM 0 HG LEU A 50 30.634 23.501 17.356 1.00 0.00 H new ATOM 0 HD11 LEU A 50 29.969 24.563 15.214 1.00 0.00 H new ATOM 0 HD12 LEU A 50 31.630 25.018 15.664 1.00 0.00 H new ATOM 0 HD13 LEU A 50 31.354 23.793 14.403 1.00 0.00 H new ATOM 0 HD21 LEU A 50 29.072 22.314 15.838 1.00 0.00 H new ATOM 0 HD22 LEU A 50 30.452 21.539 15.024 1.00 0.00 H new ATOM 0 HD23 LEU A 50 30.099 21.164 16.727 1.00 0.00 H new ATOM 813 N GLU A 51 34.442 20.090 17.709 1.00 0.00 N ATOM 814 CA GLU A 51 35.854 19.766 18.071 1.00 0.00 C ATOM 815 C GLU A 51 36.784 20.172 16.923 1.00 0.00 C ATOM 816 O GLU A 51 36.362 20.318 15.793 1.00 0.00 O ATOM 817 CB GLU A 51 35.981 18.262 18.316 1.00 0.00 C ATOM 818 CG GLU A 51 35.036 17.847 19.445 1.00 0.00 C ATOM 819 CD GLU A 51 35.226 16.361 19.752 1.00 0.00 C ATOM 820 OE1 GLU A 51 35.993 15.725 19.048 1.00 0.00 O ATOM 821 OE2 GLU A 51 34.601 15.884 20.685 1.00 0.00 O ATOM 0 H GLU A 51 33.956 19.368 17.178 1.00 0.00 H new ATOM 0 HA GLU A 51 36.131 20.311 18.974 1.00 0.00 H new ATOM 0 HB2 GLU A 51 35.740 17.713 17.406 1.00 0.00 H new ATOM 0 HB3 GLU A 51 37.009 18.011 18.577 1.00 0.00 H new ATOM 0 HG2 GLU A 51 35.235 18.441 20.337 1.00 0.00 H new ATOM 0 HG3 GLU A 51 34.003 18.040 19.157 1.00 0.00 H new ATOM 828 N ASP A 52 38.044 20.356 17.206 1.00 0.00 N ATOM 829 CA ASP A 52 39.002 20.751 16.134 1.00 0.00 C ATOM 830 C ASP A 52 39.149 19.606 15.130 1.00 0.00 C ATOM 831 O ASP A 52 38.910 18.456 15.445 1.00 0.00 O ATOM 832 CB ASP A 52 40.364 21.061 16.757 1.00 0.00 C ATOM 833 CG ASP A 52 40.219 22.208 17.760 1.00 0.00 C ATOM 834 OD1 ASP A 52 39.970 21.926 18.920 1.00 0.00 O ATOM 835 OD2 ASP A 52 40.359 23.349 17.349 1.00 0.00 O ATOM 0 H ASP A 52 38.453 20.250 18.135 1.00 0.00 H new ATOM 0 HA ASP A 52 38.626 21.636 15.621 1.00 0.00 H new ATOM 0 HB2 ASP A 52 40.757 20.175 17.256 1.00 0.00 H new ATOM 0 HB3 ASP A 52 41.078 21.332 15.979 1.00 0.00 H new ATOM 840 N GLY A 53 39.541 19.910 13.921 1.00 0.00 N ATOM 841 CA GLY A 53 39.702 18.840 12.895 1.00 0.00 C ATOM 842 C GLY A 53 38.338 18.509 12.288 1.00 0.00 C ATOM 843 O GLY A 53 37.332 19.070 12.673 1.00 0.00 O ATOM 0 H GLY A 53 39.757 20.854 13.600 1.00 0.00 H new ATOM 0 HA2 GLY A 53 40.389 19.169 12.115 1.00 0.00 H new ATOM 0 HA3 GLY A 53 40.137 17.949 13.348 1.00 0.00 H new ATOM 847 N ARG A 54 38.299 17.598 11.350 1.00 0.00 N ATOM 848 CA ARG A 54 37.003 17.217 10.711 1.00 0.00 C ATOM 849 C ARG A 54 36.311 18.462 10.145 1.00 0.00 C ATOM 850 O ARG A 54 36.621 19.579 10.513 1.00 0.00 O ATOM 851 CB ARG A 54 36.105 16.530 11.746 1.00 0.00 C ATOM 852 CG ARG A 54 36.711 15.172 12.115 1.00 0.00 C ATOM 853 CD ARG A 54 36.045 14.638 13.384 1.00 0.00 C ATOM 854 NE ARG A 54 36.576 13.281 13.692 1.00 0.00 N ATOM 855 CZ ARG A 54 36.357 12.742 14.859 1.00 0.00 C ATOM 856 NH1 ARG A 54 36.816 11.550 15.127 1.00 0.00 N ATOM 857 NH2 ARG A 54 35.676 13.395 15.762 1.00 0.00 N ATOM 0 H ARG A 54 39.115 17.098 10.997 1.00 0.00 H new ATOM 0 HA ARG A 54 37.193 16.525 9.891 1.00 0.00 H new ATOM 0 HB2 ARG A 54 36.011 17.154 12.635 1.00 0.00 H new ATOM 0 HB3 ARG A 54 35.101 16.396 11.343 1.00 0.00 H new ATOM 0 HG2 ARG A 54 36.573 14.467 11.296 1.00 0.00 H new ATOM 0 HG3 ARG A 54 37.785 15.273 12.271 1.00 0.00 H new ATOM 0 HD2 ARG A 54 36.236 15.313 14.219 1.00 0.00 H new ATOM 0 HD3 ARG A 54 34.964 14.595 13.249 1.00 0.00 H new ATOM 0 HE ARG A 54 37.112 12.772 12.989 1.00 0.00 H new ATOM 0 HH11 ARG A 54 37.347 11.038 14.423 1.00 0.00 H new ATOM 0 HH12 ARG A 54 36.643 11.131 16.041 1.00 0.00 H new ATOM 0 HH21 ARG A 54 35.316 14.326 15.554 1.00 0.00 H new ATOM 0 HH22 ARG A 54 35.504 12.974 16.675 1.00 0.00 H new ATOM 871 N THR A 55 35.384 18.275 9.234 1.00 0.00 N ATOM 872 CA THR A 55 34.660 19.434 8.616 1.00 0.00 C ATOM 873 C THR A 55 33.155 19.283 8.859 1.00 0.00 C ATOM 874 O THR A 55 32.681 18.217 9.202 1.00 0.00 O ATOM 875 CB THR A 55 34.921 19.441 7.110 1.00 0.00 C ATOM 876 OG1 THR A 55 34.374 18.265 6.530 1.00 0.00 O ATOM 877 CG2 THR A 55 36.429 19.492 6.839 1.00 0.00 C ATOM 0 H THR A 55 35.095 17.360 8.889 1.00 0.00 H new ATOM 0 HA THR A 55 35.013 20.364 9.061 1.00 0.00 H new ATOM 0 HB THR A 55 34.450 20.320 6.670 1.00 0.00 H new ATOM 0 HG1 THR A 55 34.396 18.341 5.553 1.00 0.00 H new ATOM 0 HG21 THR A 55 36.605 19.497 5.763 1.00 0.00 H new ATOM 0 HG22 THR A 55 36.847 20.397 7.279 1.00 0.00 H new ATOM 0 HG23 THR A 55 36.908 18.619 7.281 1.00 0.00 H new ATOM 885 N LEU A 56 32.395 20.333 8.680 1.00 0.00 N ATOM 886 CA LEU A 56 30.921 20.230 8.900 1.00 0.00 C ATOM 887 C LEU A 56 30.340 19.179 7.948 1.00 0.00 C ATOM 888 O LEU A 56 29.575 18.322 8.352 1.00 0.00 O ATOM 889 CB LEU A 56 30.253 21.589 8.635 1.00 0.00 C ATOM 890 CG LEU A 56 30.436 22.515 9.844 1.00 0.00 C ATOM 891 CD1 LEU A 56 31.913 22.874 10.002 1.00 0.00 C ATOM 892 CD2 LEU A 56 29.625 23.794 9.631 1.00 0.00 C ATOM 0 H LEU A 56 32.729 21.253 8.392 1.00 0.00 H new ATOM 0 HA LEU A 56 30.731 19.937 9.933 1.00 0.00 H new ATOM 0 HB2 LEU A 56 30.687 22.049 7.747 1.00 0.00 H new ATOM 0 HB3 LEU A 56 29.191 21.447 8.434 1.00 0.00 H new ATOM 0 HG LEU A 56 30.090 22.005 10.743 1.00 0.00 H new ATOM 0 HD11 LEU A 56 32.038 23.532 10.862 1.00 0.00 H new ATOM 0 HD12 LEU A 56 32.494 21.964 10.154 1.00 0.00 H new ATOM 0 HD13 LEU A 56 32.262 23.382 9.103 1.00 0.00 H new ATOM 0 HD21 LEU A 56 29.754 24.454 10.489 1.00 0.00 H new ATOM 0 HD22 LEU A 56 29.972 24.299 8.730 1.00 0.00 H new ATOM 0 HD23 LEU A 56 28.570 23.542 9.522 1.00 0.00 H new ATOM 904 N SER A 57 30.701 19.217 6.691 1.00 0.00 N ATOM 905 CA SER A 57 30.164 18.197 5.751 1.00 0.00 C ATOM 906 C SER A 57 30.629 16.822 6.227 1.00 0.00 C ATOM 907 O SER A 57 29.848 15.907 6.393 1.00 0.00 O ATOM 908 CB SER A 57 30.697 18.464 4.342 1.00 0.00 C ATOM 909 OG SER A 57 30.187 17.479 3.453 1.00 0.00 O ATOM 0 H SER A 57 31.336 19.902 6.282 1.00 0.00 H new ATOM 0 HA SER A 57 29.075 18.240 5.727 1.00 0.00 H new ATOM 0 HB2 SER A 57 30.399 19.459 4.010 1.00 0.00 H new ATOM 0 HB3 SER A 57 31.787 18.441 4.342 1.00 0.00 H new ATOM 0 HG SER A 57 30.525 17.648 2.549 1.00 0.00 H new ATOM 915 N ASP A 58 31.905 16.682 6.444 1.00 0.00 N ATOM 916 CA ASP A 58 32.449 15.379 6.909 1.00 0.00 C ATOM 917 C ASP A 58 31.625 14.869 8.097 1.00 0.00 C ATOM 918 O ASP A 58 31.453 13.678 8.270 1.00 0.00 O ATOM 919 CB ASP A 58 33.906 15.553 7.337 1.00 0.00 C ATOM 920 CG ASP A 58 34.792 15.718 6.098 1.00 0.00 C ATOM 921 OD1 ASP A 58 34.300 15.489 5.006 1.00 0.00 O ATOM 922 OD2 ASP A 58 35.948 16.067 6.265 1.00 0.00 O ATOM 0 H ASP A 58 32.599 17.419 6.318 1.00 0.00 H new ATOM 0 HA ASP A 58 32.394 14.657 6.094 1.00 0.00 H new ATOM 0 HB2 ASP A 58 34.003 16.425 7.984 1.00 0.00 H new ATOM 0 HB3 ASP A 58 34.231 14.688 7.916 1.00 0.00 H new ATOM 927 N TYR A 59 31.114 15.747 8.924 1.00 0.00 N ATOM 928 CA TYR A 59 30.313 15.266 10.088 1.00 0.00 C ATOM 929 C TYR A 59 28.947 14.776 9.594 1.00 0.00 C ATOM 930 O TYR A 59 28.277 14.018 10.265 1.00 0.00 O ATOM 931 CB TYR A 59 30.105 16.420 11.090 1.00 0.00 C ATOM 932 CG TYR A 59 31.282 16.517 12.040 1.00 0.00 C ATOM 933 CD1 TYR A 59 32.085 17.665 12.056 1.00 0.00 C ATOM 934 CD2 TYR A 59 31.558 15.460 12.916 1.00 0.00 C ATOM 935 CE1 TYR A 59 33.163 17.753 12.944 1.00 0.00 C ATOM 936 CE2 TYR A 59 32.637 15.549 13.804 1.00 0.00 C ATOM 937 CZ TYR A 59 33.438 16.695 13.817 1.00 0.00 C ATOM 938 OH TYR A 59 34.499 16.785 14.695 1.00 0.00 O ATOM 0 H TYR A 59 31.215 16.759 8.845 1.00 0.00 H new ATOM 0 HA TYR A 59 30.844 14.451 10.579 1.00 0.00 H new ATOM 0 HB2 TYR A 59 29.986 17.360 10.551 1.00 0.00 H new ATOM 0 HB3 TYR A 59 29.187 16.258 11.655 1.00 0.00 H new ATOM 0 HD1 TYR A 59 31.872 18.482 11.383 1.00 0.00 H new ATOM 0 HD2 TYR A 59 30.938 14.576 12.907 1.00 0.00 H new ATOM 0 HE1 TYR A 59 33.783 18.638 12.955 1.00 0.00 H new ATOM 0 HE2 TYR A 59 32.850 14.733 14.478 1.00 0.00 H new ATOM 0 HH TYR A 59 34.414 16.093 15.383 1.00 0.00 H new ATOM 948 N ASN A 60 28.520 15.210 8.436 1.00 0.00 N ATOM 949 CA ASN A 60 27.190 14.776 7.920 1.00 0.00 C ATOM 950 C ASN A 60 26.091 15.299 8.853 1.00 0.00 C ATOM 951 O ASN A 60 25.268 14.553 9.342 1.00 0.00 O ATOM 952 CB ASN A 60 27.130 13.244 7.846 1.00 0.00 C ATOM 953 CG ASN A 60 28.488 12.704 7.397 1.00 0.00 C ATOM 954 OD1 ASN A 60 29.129 11.962 8.115 1.00 0.00 O ATOM 955 ND2 ASN A 60 28.960 13.045 6.229 1.00 0.00 N ATOM 0 H ASN A 60 29.035 15.846 7.827 1.00 0.00 H new ATOM 0 HA ASN A 60 27.040 15.180 6.919 1.00 0.00 H new ATOM 0 HB2 ASN A 60 26.866 12.832 8.820 1.00 0.00 H new ATOM 0 HB3 ASN A 60 26.353 12.933 7.147 1.00 0.00 H new ATOM 0 HD21 ASN A 60 29.865 12.689 5.921 1.00 0.00 H new ATOM 0 HD22 ASN A 60 28.424 13.668 5.624 1.00 0.00 H new ATOM 962 N ILE A 61 26.080 16.582 9.105 1.00 0.00 N ATOM 963 CA ILE A 61 25.044 17.167 10.008 1.00 0.00 C ATOM 964 C ILE A 61 23.777 17.478 9.210 1.00 0.00 C ATOM 965 O ILE A 61 23.828 17.772 8.033 1.00 0.00 O ATOM 966 CB ILE A 61 25.581 18.459 10.625 1.00 0.00 C ATOM 967 CG1 ILE A 61 26.878 18.162 11.381 1.00 0.00 C ATOM 968 CG2 ILE A 61 24.546 19.030 11.596 1.00 0.00 C ATOM 969 CD1 ILE A 61 27.546 19.475 11.788 1.00 0.00 C ATOM 0 H ILE A 61 26.747 17.253 8.723 1.00 0.00 H new ATOM 0 HA ILE A 61 24.808 16.451 10.796 1.00 0.00 H new ATOM 0 HB ILE A 61 25.777 19.184 9.835 1.00 0.00 H new ATOM 0 HG12 ILE A 61 26.666 17.561 12.265 1.00 0.00 H new ATOM 0 HG13 ILE A 61 27.552 17.579 10.753 1.00 0.00 H new ATOM 0 HG21 ILE A 61 24.929 19.951 12.036 1.00 0.00 H new ATOM 0 HG22 ILE A 61 23.621 19.241 11.059 1.00 0.00 H new ATOM 0 HG23 ILE A 61 24.349 18.305 12.386 1.00 0.00 H new ATOM 0 HD11 ILE A 61 28.470 19.262 12.326 1.00 0.00 H new ATOM 0 HD12 ILE A 61 27.772 20.060 10.896 1.00 0.00 H new ATOM 0 HD13 ILE A 61 26.873 20.041 12.432 1.00 0.00 H new ATOM 1066 N LEU A 67 22.780 26.963 8.736 1.00 0.00 N ATOM 1067 CA LEU A 67 23.403 26.516 10.017 1.00 0.00 C ATOM 1068 C LEU A 67 23.570 27.716 10.953 1.00 0.00 C ATOM 1069 O LEU A 67 24.193 28.704 10.608 1.00 0.00 O ATOM 1070 CB LEU A 67 24.776 25.896 9.726 1.00 0.00 C ATOM 1071 CG LEU A 67 24.600 24.471 9.187 1.00 0.00 C ATOM 1072 CD1 LEU A 67 23.885 24.514 7.833 1.00 0.00 C ATOM 1073 CD2 LEU A 67 25.976 23.824 9.019 1.00 0.00 C ATOM 0 HA LEU A 67 22.762 25.774 10.494 1.00 0.00 H new ATOM 0 HB2 LEU A 67 25.314 26.505 9.000 1.00 0.00 H new ATOM 0 HB3 LEU A 67 25.377 25.879 10.635 1.00 0.00 H new ATOM 0 HG LEU A 67 24.003 23.888 9.888 1.00 0.00 H new ATOM 0 HD11 LEU A 67 23.762 23.499 7.454 1.00 0.00 H new ATOM 0 HD12 LEU A 67 22.906 24.977 7.953 1.00 0.00 H new ATOM 0 HD13 LEU A 67 24.478 25.096 7.127 1.00 0.00 H new ATOM 0 HD21 LEU A 67 25.857 22.810 8.636 1.00 0.00 H new ATOM 0 HD22 LEU A 67 26.570 24.410 8.318 1.00 0.00 H new ATOM 0 HD23 LEU A 67 26.482 23.790 9.984 1.00 0.00 H new ATOM 1085 N HIS A 68 23.021 27.631 12.139 1.00 0.00 N ATOM 1086 CA HIS A 68 23.139 28.753 13.123 1.00 0.00 C ATOM 1087 C HIS A 68 24.122 28.353 14.224 1.00 0.00 C ATOM 1088 O HIS A 68 24.063 27.261 14.751 1.00 0.00 O ATOM 1089 CB HIS A 68 21.767 29.028 13.743 1.00 0.00 C ATOM 1090 CG HIS A 68 21.207 27.752 14.308 1.00 0.00 C ATOM 1091 ND1 HIS A 68 21.589 27.261 15.549 1.00 0.00 N ATOM 1092 CD2 HIS A 68 20.294 26.854 13.813 1.00 0.00 C ATOM 1093 CE1 HIS A 68 20.913 26.116 15.758 1.00 0.00 C ATOM 1094 NE2 HIS A 68 20.111 25.826 14.731 1.00 0.00 N ATOM 0 H HIS A 68 22.491 26.825 12.471 1.00 0.00 H new ATOM 0 HA HIS A 68 23.498 29.650 12.618 1.00 0.00 H new ATOM 0 HB2 HIS A 68 21.855 29.778 14.529 1.00 0.00 H new ATOM 0 HB3 HIS A 68 21.090 29.433 12.990 1.00 0.00 H new ATOM 0 HD2 HIS A 68 19.795 26.934 12.858 1.00 0.00 H new ATOM 0 HE1 HIS A 68 21.008 25.508 16.646 1.00 0.00 H new ATOM 0 HE2 HIS A 68 19.493 25.019 14.639 1.00 0.00 H new ATOM 1103 N LEU A 69 25.019 29.239 14.582 1.00 0.00 N ATOM 1104 CA LEU A 69 26.015 28.935 15.661 1.00 0.00 C ATOM 1105 C LEU A 69 26.001 30.089 16.667 1.00 0.00 C ATOM 1106 O LEU A 69 25.697 31.213 16.319 1.00 0.00 O ATOM 1107 CB LEU A 69 27.423 28.817 15.049 1.00 0.00 C ATOM 1108 CG LEU A 69 27.635 27.418 14.441 1.00 0.00 C ATOM 1109 CD1 LEU A 69 26.768 27.224 13.172 1.00 0.00 C ATOM 1110 CD2 LEU A 69 29.122 27.259 14.094 1.00 0.00 C ATOM 0 H LEU A 69 25.106 30.168 14.170 1.00 0.00 H new ATOM 0 HA LEU A 69 25.758 27.996 16.152 1.00 0.00 H new ATOM 0 HB2 LEU A 69 27.556 29.578 14.280 1.00 0.00 H new ATOM 0 HB3 LEU A 69 28.175 29.004 15.815 1.00 0.00 H new ATOM 0 HG LEU A 69 27.333 26.661 15.165 1.00 0.00 H new ATOM 0 HD11 LEU A 69 26.938 26.228 12.764 1.00 0.00 H new ATOM 0 HD12 LEU A 69 25.715 27.336 13.430 1.00 0.00 H new ATOM 0 HD13 LEU A 69 27.040 27.972 12.428 1.00 0.00 H new ATOM 0 HD21 LEU A 69 29.291 26.273 13.662 1.00 0.00 H new ATOM 0 HD22 LEU A 69 29.412 28.025 13.375 1.00 0.00 H new ATOM 0 HD23 LEU A 69 29.720 27.366 14.999 1.00 0.00 H new ATOM 1122 N VAL A 70 26.327 29.828 17.910 1.00 0.00 N ATOM 1123 CA VAL A 70 26.333 30.918 18.937 1.00 0.00 C ATOM 1124 C VAL A 70 27.595 30.788 19.797 1.00 0.00 C ATOM 1125 O VAL A 70 27.836 29.772 20.416 1.00 0.00 O ATOM 1126 CB VAL A 70 25.084 30.786 19.819 1.00 0.00 C ATOM 1127 CG1 VAL A 70 25.178 29.522 20.686 1.00 0.00 C ATOM 1128 CG2 VAL A 70 24.961 32.022 20.720 1.00 0.00 C ATOM 0 H VAL A 70 26.590 28.906 18.258 1.00 0.00 H new ATOM 0 HA VAL A 70 26.327 31.893 18.449 1.00 0.00 H new ATOM 0 HB VAL A 70 24.204 30.710 19.180 1.00 0.00 H new ATOM 0 HG11 VAL A 70 24.286 29.440 21.307 1.00 0.00 H new ATOM 0 HG12 VAL A 70 25.255 28.645 20.043 1.00 0.00 H new ATOM 0 HG13 VAL A 70 26.060 29.583 21.324 1.00 0.00 H new ATOM 0 HG21 VAL A 70 24.074 31.929 21.347 1.00 0.00 H new ATOM 0 HG22 VAL A 70 25.845 32.101 21.352 1.00 0.00 H new ATOM 0 HG23 VAL A 70 24.876 32.916 20.102 1.00 0.00 H new ATOM 1138 N LEU A 71 28.406 31.811 19.832 1.00 0.00 N ATOM 1139 CA LEU A 71 29.655 31.752 20.645 1.00 0.00 C ATOM 1140 C LEU A 71 29.319 32.087 22.099 1.00 0.00 C ATOM 1141 O LEU A 71 28.444 32.886 22.366 1.00 0.00 O ATOM 1142 CB LEU A 71 30.662 32.774 20.087 1.00 0.00 C ATOM 1143 CG LEU A 71 32.058 32.602 20.750 1.00 0.00 C ATOM 1144 CD1 LEU A 71 33.164 32.895 19.728 1.00 0.00 C ATOM 1145 CD2 LEU A 71 32.216 33.577 21.928 1.00 0.00 C ATOM 0 H LEU A 71 28.257 32.687 19.331 1.00 0.00 H new ATOM 0 HA LEU A 71 30.091 30.754 20.598 1.00 0.00 H new ATOM 0 HB2 LEU A 71 30.751 32.650 19.008 1.00 0.00 H new ATOM 0 HB3 LEU A 71 30.294 33.785 20.263 1.00 0.00 H new ATOM 0 HG LEU A 71 32.139 31.576 21.108 1.00 0.00 H new ATOM 0 HD11 LEU A 71 34.138 32.772 20.201 1.00 0.00 H new ATOM 0 HD12 LEU A 71 33.078 32.203 18.890 1.00 0.00 H new ATOM 0 HD13 LEU A 71 33.063 33.918 19.366 1.00 0.00 H new ATOM 0 HD21 LEU A 71 33.198 33.444 22.381 1.00 0.00 H new ATOM 0 HD22 LEU A 71 32.118 34.601 21.568 1.00 0.00 H new ATOM 0 HD23 LEU A 71 31.444 33.378 22.671 1.00 0.00 H new ATOM 1157 N ARG A 72 30.006 31.485 23.042 1.00 0.00 N ATOM 1158 CA ARG A 72 29.739 31.763 24.489 1.00 0.00 C ATOM 1159 C ARG A 72 31.009 32.337 25.123 1.00 0.00 C ATOM 1160 O ARG A 72 32.102 32.129 24.636 1.00 0.00 O ATOM 1161 CB ARG A 72 29.369 30.446 25.193 1.00 0.00 C ATOM 1162 CG ARG A 72 28.668 30.735 26.535 1.00 0.00 C ATOM 1163 CD ARG A 72 27.159 30.911 26.320 1.00 0.00 C ATOM 1164 NE ARG A 72 26.513 29.570 26.236 1.00 0.00 N ATOM 1165 CZ ARG A 72 25.212 29.473 26.218 1.00 0.00 C ATOM 1166 NH1 ARG A 72 24.646 28.299 26.145 1.00 0.00 N ATOM 1167 NH2 ARG A 72 24.477 30.550 26.277 1.00 0.00 N ATOM 0 H ARG A 72 30.747 30.806 22.868 1.00 0.00 H new ATOM 0 HA ARG A 72 28.920 32.475 24.590 1.00 0.00 H new ATOM 0 HB2 ARG A 72 28.714 29.855 24.553 1.00 0.00 H new ATOM 0 HB3 ARG A 72 30.267 29.853 25.364 1.00 0.00 H new ATOM 0 HG2 ARG A 72 28.850 29.917 27.232 1.00 0.00 H new ATOM 0 HG3 ARG A 72 29.086 31.636 26.985 1.00 0.00 H new ATOM 0 HD2 ARG A 72 26.728 31.484 27.141 1.00 0.00 H new ATOM 0 HD3 ARG A 72 26.974 31.474 25.406 1.00 0.00 H new ATOM 0 HE ARG A 72 27.088 28.729 26.193 1.00 0.00 H new ATOM 0 HH11 ARG A 72 25.221 27.457 26.102 1.00 0.00 H new ATOM 0 HH12 ARG A 72 23.629 28.223 26.131 1.00 0.00 H new ATOM 0 HH21 ARG A 72 24.920 31.467 26.337 1.00 0.00 H new ATOM 0 HH22 ARG A 72 23.460 30.475 26.263 1.00 0.00 H new ATOM 1181 N LEU A 73 30.882 33.051 26.211 1.00 0.00 N ATOM 1182 CA LEU A 73 32.090 33.630 26.872 1.00 0.00 C ATOM 1183 C LEU A 73 32.637 32.627 27.892 1.00 0.00 C ATOM 1184 O LEU A 73 31.890 31.928 28.548 1.00 0.00 O ATOM 1185 CB LEU A 73 31.708 34.925 27.592 1.00 0.00 C ATOM 1186 CG LEU A 73 30.983 35.865 26.625 1.00 0.00 C ATOM 1187 CD1 LEU A 73 30.496 37.099 27.391 1.00 0.00 C ATOM 1188 CD2 LEU A 73 31.935 36.300 25.502 1.00 0.00 C ATOM 0 H LEU A 73 29.995 33.258 26.670 1.00 0.00 H new ATOM 0 HA LEU A 73 32.850 33.843 26.120 1.00 0.00 H new ATOM 0 HB2 LEU A 73 31.067 34.702 28.445 1.00 0.00 H new ATOM 0 HB3 LEU A 73 32.602 35.411 27.984 1.00 0.00 H new ATOM 0 HG LEU A 73 30.132 35.344 26.186 1.00 0.00 H new ATOM 0 HD11 LEU A 73 29.979 37.772 26.707 1.00 0.00 H new ATOM 0 HD12 LEU A 73 29.812 36.790 28.182 1.00 0.00 H new ATOM 0 HD13 LEU A 73 31.350 37.615 27.831 1.00 0.00 H new ATOM 0 HD21 LEU A 73 31.411 36.968 24.819 1.00 0.00 H new ATOM 0 HD22 LEU A 73 32.791 36.819 25.932 1.00 0.00 H new ATOM 0 HD23 LEU A 73 32.280 35.421 24.957 1.00 0.00 H new