USER MOD reduce.3.24.130724 H: found=0, std=0, add=523, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 523 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 20 LYS NZ :NH3+ 159:sc= 1.97 (180deg=0.928) USER MOD Set 1.2: A 27 TYR OH : rot 180:sc= 0.991 USER MOD Set 2.1: A 14 LYS NZ :NH3+ -162:sc= 1.61 (180deg=0.0492) USER MOD Set 2.2: A 15 TYR OH : rot 180:sc= 0.923 USER MOD Set 3.1: A 13 TYR OH : rot -42:sc= 1.53 USER MOD Set 3.2: A 23 TYR OH : rot -15:sc= 0.948 USER MOD Set 4.1: A 12 LYS NZ :NH3+ 155:sc= 3.52 (180deg=3.17) USER MOD Set 4.2: A 46 LYS NZ :NH3+ 168:sc= 1.07 (180deg=0.833) USER MOD Set 4.3: A 49 LYS NZ :NH3+ -175:sc= 2.36 (180deg=2.15) USER MOD Set 5.1: A 3 GLN : amide:sc= 2.1 K(o=4.3,f=-13!) USER MOD Set 5.2: A 4 LYS NZ :NH3+ 176:sc= 2.16 (180deg=1.17) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 158:sc= 1.03 (180deg=0.452) USER MOD Single : A 5 LYS NZ :NH3+ -159:sc= 1.28 (180deg=1.18) USER MOD Single : A 17 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ -160:sc= 0.00998 (180deg=0) USER MOD Single : A 29 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 33 THR OG1 : rot 180:sc= -0.0841 USER MOD Single : A 42 LYS NZ :NH3+ 177:sc= 1 (180deg=0.986) USER MOD Single : A 52 LYS NZ :NH3+ 157:sc= 1.29 (180deg=1.19) USER MOD Single : A 56 TYR OH : rot -14:sc= 1.26 USER MOD Single : A 59 ASN : amide:sc= -0.0528 X(o=-0.053,f=0) USER MOD Single : A 60 GLN : amide:sc= 0 X(o=0,f=-0.0014) USER MOD Single : A 65 GLN : amide:sc= 1.16 K(o=1.2,f=-0.16) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 18.582 -37.756 -6.715 1.00 0.00 N ATOM 2 CA MET A 1 20.034 -37.774 -6.541 1.00 0.00 C ATOM 3 C MET A 1 20.640 -39.185 -6.366 1.00 0.00 C ATOM 4 O MET A 1 21.703 -39.470 -6.923 1.00 0.00 O ATOM 5 CB MET A 1 20.443 -36.792 -5.409 1.00 0.00 C ATOM 6 CG MET A 1 19.814 -37.049 -4.017 1.00 0.00 C ATOM 7 SD MET A 1 20.259 -35.776 -2.807 1.00 0.00 S ATOM 8 CE MET A 1 18.841 -34.659 -2.956 1.00 0.00 C ATOM 0 H1 MET A 1 18.213 -36.819 -6.456 1.00 0.00 H new ATOM 0 H2 MET A 1 18.349 -37.958 -7.708 1.00 0.00 H new ATOM 0 H3 MET A 1 18.150 -38.479 -6.104 1.00 0.00 H new ATOM 0 HA MET A 1 20.471 -37.426 -7.477 1.00 0.00 H new ATOM 0 HB2 MET A 1 21.528 -36.822 -5.305 1.00 0.00 H new ATOM 0 HB3 MET A 1 20.181 -35.781 -5.722 1.00 0.00 H new ATOM 0 HG2 MET A 1 18.729 -37.089 -4.114 1.00 0.00 H new ATOM 0 HG3 MET A 1 20.138 -38.023 -3.650 1.00 0.00 H new ATOM 0 HE1 MET A 1 18.965 -33.820 -2.272 1.00 0.00 H new ATOM 0 HE2 MET A 1 18.777 -34.287 -3.978 1.00 0.00 H new ATOM 0 HE3 MET A 1 17.926 -35.197 -2.708 1.00 0.00 H new ATOM 20 N LEU A 2 19.981 -40.090 -5.628 1.00 0.00 N ATOM 21 CA LEU A 2 20.464 -41.453 -5.416 1.00 0.00 C ATOM 22 C LEU A 2 19.991 -42.414 -6.529 1.00 0.00 C ATOM 23 O LEU A 2 18.824 -42.825 -6.615 1.00 0.00 O ATOM 24 CB LEU A 2 20.035 -41.955 -4.009 1.00 0.00 C ATOM 25 CG LEU A 2 20.682 -41.210 -2.815 1.00 0.00 C ATOM 26 CD1 LEU A 2 19.947 -41.575 -1.517 1.00 0.00 C ATOM 27 CD2 LEU A 2 22.172 -41.564 -2.638 1.00 0.00 C ATOM 0 H LEU A 2 19.096 -39.892 -5.162 1.00 0.00 H new ATOM 0 HA LEU A 2 21.553 -41.438 -5.463 1.00 0.00 H new ATOM 0 HB2 LEU A 2 18.952 -41.869 -3.925 1.00 0.00 H new ATOM 0 HB3 LEU A 2 20.278 -43.015 -3.930 1.00 0.00 H new ATOM 0 HG LEU A 2 20.603 -40.144 -3.028 1.00 0.00 H new ATOM 0 HD11 LEU A 2 20.405 -41.049 -0.679 1.00 0.00 H new ATOM 0 HD12 LEU A 2 18.899 -41.285 -1.598 1.00 0.00 H new ATOM 0 HD13 LEU A 2 20.014 -42.650 -1.351 1.00 0.00 H new ATOM 0 HD21 LEU A 2 22.578 -41.015 -1.788 1.00 0.00 H new ATOM 0 HD22 LEU A 2 22.273 -42.635 -2.461 1.00 0.00 H new ATOM 0 HD23 LEU A 2 22.720 -41.293 -3.540 1.00 0.00 H new ATOM 39 N GLN A 3 20.966 -42.749 -7.388 1.00 0.00 N ATOM 40 CA GLN A 3 20.841 -43.777 -8.428 1.00 0.00 C ATOM 41 C GLN A 3 20.397 -45.132 -7.844 1.00 0.00 C ATOM 42 O GLN A 3 19.537 -45.797 -8.423 1.00 0.00 O ATOM 43 CB GLN A 3 22.210 -43.871 -9.174 1.00 0.00 C ATOM 44 CG GLN A 3 22.253 -44.738 -10.478 1.00 0.00 C ATOM 45 CD GLN A 3 22.419 -46.247 -10.236 1.00 0.00 C ATOM 46 OE1 GLN A 3 23.251 -46.703 -9.457 1.00 0.00 O ATOM 47 NE2 GLN A 3 21.650 -47.093 -10.895 1.00 0.00 N ATOM 0 H GLN A 3 21.883 -42.302 -7.377 1.00 0.00 H new ATOM 0 HA GLN A 3 20.060 -43.500 -9.136 1.00 0.00 H new ATOM 0 HB2 GLN A 3 22.526 -42.860 -9.429 1.00 0.00 H new ATOM 0 HB3 GLN A 3 22.948 -44.270 -8.478 1.00 0.00 H new ATOM 0 HG2 GLN A 3 21.334 -44.572 -11.040 1.00 0.00 H new ATOM 0 HG3 GLN A 3 23.076 -44.391 -11.103 1.00 0.00 H new ATOM 0 HE21 GLN A 3 20.950 -46.743 -11.549 1.00 0.00 H new ATOM 0 HE22 GLN A 3 21.756 -48.097 -10.750 1.00 0.00 H new ATOM 56 N LYS A 4 20.950 -45.506 -6.680 1.00 0.00 N ATOM 57 CA LYS A 4 20.543 -46.690 -5.923 1.00 0.00 C ATOM 58 C LYS A 4 19.072 -46.683 -5.464 1.00 0.00 C ATOM 59 O LYS A 4 18.471 -47.756 -5.406 1.00 0.00 O ATOM 60 CB LYS A 4 21.516 -46.972 -4.743 1.00 0.00 C ATOM 61 CG LYS A 4 22.727 -47.847 -5.161 1.00 0.00 C ATOM 62 CD LYS A 4 23.818 -47.112 -5.973 1.00 0.00 C ATOM 63 CE LYS A 4 24.760 -48.071 -6.706 1.00 0.00 C ATOM 64 NZ LYS A 4 24.093 -48.546 -7.917 1.00 0.00 N ATOM 0 H LYS A 4 21.704 -44.983 -6.235 1.00 0.00 H new ATOM 0 HA LYS A 4 20.609 -47.518 -6.629 1.00 0.00 H new ATOM 0 HB2 LYS A 4 21.878 -46.025 -4.342 1.00 0.00 H new ATOM 0 HB3 LYS A 4 20.972 -47.471 -3.941 1.00 0.00 H new ATOM 0 HG2 LYS A 4 23.183 -48.262 -4.262 1.00 0.00 H new ATOM 0 HG3 LYS A 4 22.362 -48.688 -5.751 1.00 0.00 H new ATOM 0 HD2 LYS A 4 23.342 -46.452 -6.699 1.00 0.00 H new ATOM 0 HD3 LYS A 4 24.400 -46.480 -5.302 1.00 0.00 H new ATOM 0 HE2 LYS A 4 25.691 -47.565 -6.961 1.00 0.00 H new ATOM 0 HE3 LYS A 4 25.020 -48.912 -6.063 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 24.746 -49.146 -8.461 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 23.252 -49.099 -7.656 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 23.806 -47.732 -8.497 1.00 0.00 H new ATOM 78 N LYS A 5 18.448 -45.537 -5.149 1.00 0.00 N ATOM 79 CA LYS A 5 17.009 -45.486 -4.865 1.00 0.00 C ATOM 80 C LYS A 5 16.112 -45.511 -6.116 1.00 0.00 C ATOM 81 O LYS A 5 15.015 -46.082 -6.047 1.00 0.00 O ATOM 82 CB LYS A 5 16.648 -44.344 -3.882 1.00 0.00 C ATOM 83 CG LYS A 5 17.164 -44.527 -2.423 1.00 0.00 C ATOM 84 CD LYS A 5 16.754 -45.883 -1.809 1.00 0.00 C ATOM 85 CE LYS A 5 16.763 -45.947 -0.293 1.00 0.00 C ATOM 86 NZ LYS A 5 16.411 -47.323 0.036 1.00 0.00 N ATOM 0 H LYS A 5 18.919 -44.635 -5.085 1.00 0.00 H new ATOM 0 HA LYS A 5 16.784 -46.424 -4.357 1.00 0.00 H new ATOM 0 HB2 LYS A 5 17.048 -43.409 -4.276 1.00 0.00 H new ATOM 0 HB3 LYS A 5 15.563 -44.241 -3.855 1.00 0.00 H new ATOM 0 HG2 LYS A 5 18.251 -44.443 -2.414 1.00 0.00 H new ATOM 0 HG3 LYS A 5 16.776 -43.720 -1.801 1.00 0.00 H new ATOM 0 HD2 LYS A 5 15.752 -46.132 -2.159 1.00 0.00 H new ATOM 0 HD3 LYS A 5 17.425 -46.652 -2.191 1.00 0.00 H new ATOM 0 HE2 LYS A 5 17.743 -45.686 0.106 1.00 0.00 H new ATOM 0 HE3 LYS A 5 16.047 -45.245 0.135 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 16.053 -47.366 1.012 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 15.675 -47.659 -0.618 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 17.253 -47.927 -0.051 1.00 0.00 H new ATOM 100 N ILE A 6 16.557 -44.940 -7.255 1.00 0.00 N ATOM 101 CA ILE A 6 15.947 -45.241 -8.567 1.00 0.00 C ATOM 102 C ILE A 6 16.005 -46.757 -8.819 1.00 0.00 C ATOM 103 O ILE A 6 14.976 -47.381 -9.057 1.00 0.00 O ATOM 104 CB ILE A 6 16.630 -44.494 -9.767 1.00 0.00 C ATOM 105 CG1 ILE A 6 16.592 -42.971 -9.527 1.00 0.00 C ATOM 106 CG2 ILE A 6 15.989 -44.875 -11.156 1.00 0.00 C ATOM 107 CD1 ILE A 6 17.432 -42.155 -10.518 1.00 0.00 C ATOM 0 H ILE A 6 17.329 -44.274 -7.293 1.00 0.00 H new ATOM 0 HA ILE A 6 14.918 -44.885 -8.520 1.00 0.00 H new ATOM 0 HB ILE A 6 17.670 -44.818 -9.814 1.00 0.00 H new ATOM 0 HG12 ILE A 6 15.557 -42.632 -9.580 1.00 0.00 H new ATOM 0 HG13 ILE A 6 16.943 -42.765 -8.516 1.00 0.00 H new ATOM 0 HG21 ILE A 6 16.497 -44.331 -11.953 1.00 0.00 H new ATOM 0 HG22 ILE A 6 16.094 -45.947 -11.324 1.00 0.00 H new ATOM 0 HG23 ILE A 6 14.932 -44.610 -11.154 1.00 0.00 H new ATOM 0 HD11 ILE A 6 17.350 -41.095 -10.278 1.00 0.00 H new ATOM 0 HD12 ILE A 6 18.476 -42.462 -10.450 1.00 0.00 H new ATOM 0 HD13 ILE A 6 17.068 -42.327 -11.531 1.00 0.00 H new ATOM 119 N GLU A 7 17.210 -47.331 -8.698 1.00 0.00 N ATOM 120 CA GLU A 7 17.473 -48.763 -8.834 1.00 0.00 C ATOM 121 C GLU A 7 16.688 -49.631 -7.830 1.00 0.00 C ATOM 122 O GLU A 7 16.257 -50.702 -8.230 1.00 0.00 O ATOM 123 CB GLU A 7 18.997 -48.910 -8.669 1.00 0.00 C ATOM 124 CG GLU A 7 19.683 -50.253 -9.028 1.00 0.00 C ATOM 125 CD GLU A 7 21.201 -50.047 -9.064 1.00 0.00 C ATOM 126 OE1 GLU A 7 21.847 -50.036 -8.012 1.00 0.00 O ATOM 127 OE2 GLU A 7 21.731 -49.817 -10.149 1.00 0.00 O ATOM 0 H GLU A 7 18.052 -46.791 -8.497 1.00 0.00 H new ATOM 0 HA GLU A 7 17.131 -49.128 -9.802 1.00 0.00 H new ATOM 0 HB2 GLU A 7 19.466 -48.133 -9.273 1.00 0.00 H new ATOM 0 HB3 GLU A 7 19.234 -48.691 -7.628 1.00 0.00 H new ATOM 0 HG2 GLU A 7 19.424 -51.015 -8.293 1.00 0.00 H new ATOM 0 HG3 GLU A 7 19.329 -50.609 -9.995 1.00 0.00 H new ATOM 134 N GLU A 8 16.469 -49.246 -6.561 1.00 0.00 N ATOM 135 CA GLU A 8 15.595 -49.972 -5.623 1.00 0.00 C ATOM 136 C GLU A 8 14.094 -49.935 -5.991 1.00 0.00 C ATOM 137 O GLU A 8 13.404 -50.936 -5.762 1.00 0.00 O ATOM 138 CB GLU A 8 15.835 -49.382 -4.197 1.00 0.00 C ATOM 139 CG GLU A 8 15.299 -50.228 -2.989 1.00 0.00 C ATOM 140 CD GLU A 8 14.235 -49.520 -2.136 1.00 0.00 C ATOM 141 OE1 GLU A 8 14.503 -48.463 -1.547 1.00 0.00 O ATOM 142 OE2 GLU A 8 13.119 -50.041 -2.047 1.00 0.00 O ATOM 0 H GLU A 8 16.897 -48.415 -6.154 1.00 0.00 H new ATOM 0 HA GLU A 8 15.860 -51.028 -5.668 1.00 0.00 H new ATOM 0 HB2 GLU A 8 16.907 -49.238 -4.063 1.00 0.00 H new ATOM 0 HB3 GLU A 8 15.373 -48.396 -4.154 1.00 0.00 H new ATOM 0 HG2 GLU A 8 14.879 -51.158 -3.372 1.00 0.00 H new ATOM 0 HG3 GLU A 8 16.139 -50.497 -2.349 1.00 0.00 H new ATOM 149 N GLU A 9 13.536 -48.832 -6.517 1.00 0.00 N ATOM 150 CA GLU A 9 12.143 -48.809 -6.990 1.00 0.00 C ATOM 151 C GLU A 9 11.974 -49.277 -8.446 1.00 0.00 C ATOM 152 O GLU A 9 11.103 -50.110 -8.698 1.00 0.00 O ATOM 153 CB GLU A 9 11.515 -47.421 -6.680 1.00 0.00 C ATOM 154 CG GLU A 9 10.246 -47.510 -5.761 1.00 0.00 C ATOM 155 CD GLU A 9 10.479 -48.208 -4.418 1.00 0.00 C ATOM 156 OE1 GLU A 9 10.958 -47.599 -3.455 1.00 0.00 O ATOM 157 OE2 GLU A 9 10.166 -49.395 -4.311 1.00 0.00 O ATOM 0 H GLU A 9 14.028 -47.945 -6.625 1.00 0.00 H new ATOM 0 HA GLU A 9 11.578 -49.557 -6.435 1.00 0.00 H new ATOM 0 HB2 GLU A 9 12.262 -46.791 -6.198 1.00 0.00 H new ATOM 0 HB3 GLU A 9 11.244 -46.934 -7.617 1.00 0.00 H new ATOM 0 HG2 GLU A 9 9.879 -46.501 -5.572 1.00 0.00 H new ATOM 0 HG3 GLU A 9 9.460 -48.040 -6.299 1.00 0.00 H new ATOM 164 N ALA A 10 12.755 -48.796 -9.418 1.00 0.00 N ATOM 165 CA ALA A 10 12.827 -49.389 -10.764 1.00 0.00 C ATOM 166 C ALA A 10 13.542 -50.765 -10.861 1.00 0.00 C ATOM 167 O ALA A 10 13.739 -51.263 -11.970 1.00 0.00 O ATOM 168 CB ALA A 10 13.402 -48.316 -11.722 1.00 0.00 C ATOM 0 H ALA A 10 13.358 -47.982 -9.297 1.00 0.00 H new ATOM 0 HA ALA A 10 11.815 -49.660 -11.066 1.00 0.00 H new ATOM 0 HB1 ALA A 10 13.468 -48.726 -12.730 1.00 0.00 H new ATOM 0 HB2 ALA A 10 12.748 -47.444 -11.727 1.00 0.00 H new ATOM 0 HB3 ALA A 10 14.396 -48.022 -11.384 1.00 0.00 H new ATOM 174 N ALA A 11 13.988 -51.420 -9.774 1.00 0.00 N ATOM 175 CA ALA A 11 14.065 -52.888 -9.720 1.00 0.00 C ATOM 176 C ALA A 11 12.677 -53.551 -9.698 1.00 0.00 C ATOM 177 O ALA A 11 12.407 -54.504 -10.434 1.00 0.00 O ATOM 178 CB ALA A 11 14.852 -53.337 -8.465 1.00 0.00 C ATOM 0 H ALA A 11 14.300 -50.954 -8.922 1.00 0.00 H new ATOM 0 HA ALA A 11 14.578 -53.207 -10.627 1.00 0.00 H new ATOM 0 HB1 ALA A 11 14.902 -54.426 -8.437 1.00 0.00 H new ATOM 0 HB2 ALA A 11 15.862 -52.928 -8.503 1.00 0.00 H new ATOM 0 HB3 ALA A 11 14.347 -52.974 -7.570 1.00 0.00 H new ATOM 184 N LYS A 12 11.767 -53.000 -8.885 1.00 0.00 N ATOM 185 CA LYS A 12 10.468 -53.604 -8.609 1.00 0.00 C ATOM 186 C LYS A 12 9.453 -53.260 -9.719 1.00 0.00 C ATOM 187 O LYS A 12 8.470 -52.545 -9.524 1.00 0.00 O ATOM 188 CB LYS A 12 9.955 -53.155 -7.215 1.00 0.00 C ATOM 189 CG LYS A 12 10.924 -53.391 -6.040 1.00 0.00 C ATOM 190 CD LYS A 12 10.229 -53.056 -4.702 1.00 0.00 C ATOM 191 CE LYS A 12 11.195 -52.727 -3.562 1.00 0.00 C ATOM 192 NZ LYS A 12 11.754 -51.405 -3.828 1.00 0.00 N ATOM 0 H LYS A 12 11.918 -52.116 -8.399 1.00 0.00 H new ATOM 0 HA LYS A 12 10.583 -54.688 -8.597 1.00 0.00 H new ATOM 0 HB2 LYS A 12 9.719 -52.092 -7.260 1.00 0.00 H new ATOM 0 HB3 LYS A 12 9.023 -53.680 -7.005 1.00 0.00 H new ATOM 0 HG2 LYS A 12 11.257 -54.429 -6.036 1.00 0.00 H new ATOM 0 HG3 LYS A 12 11.813 -52.772 -6.162 1.00 0.00 H new ATOM 0 HD2 LYS A 12 9.561 -52.208 -4.854 1.00 0.00 H new ATOM 0 HD3 LYS A 12 9.608 -53.902 -4.405 1.00 0.00 H new ATOM 0 HE2 LYS A 12 10.675 -52.738 -2.604 1.00 0.00 H new ATOM 0 HE3 LYS A 12 11.987 -53.473 -3.503 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 12.058 -50.970 -2.933 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 12.572 -51.495 -4.464 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 11.031 -50.806 -4.276 1.00 0.00 H new ATOM 206 N TYR A 13 9.715 -53.795 -10.916 1.00 0.00 N ATOM 207 CA TYR A 13 8.790 -53.747 -12.055 1.00 0.00 C ATOM 208 C TYR A 13 7.455 -54.500 -11.830 1.00 0.00 C ATOM 209 O TYR A 13 6.508 -54.344 -12.601 1.00 0.00 O ATOM 210 CB TYR A 13 9.546 -54.233 -13.325 1.00 0.00 C ATOM 211 CG TYR A 13 10.208 -53.082 -14.113 1.00 0.00 C ATOM 212 CD1 TYR A 13 10.950 -52.058 -13.531 1.00 0.00 C ATOM 213 CD2 TYR A 13 10.064 -53.035 -15.493 1.00 0.00 C ATOM 214 CE1 TYR A 13 11.505 -51.051 -14.297 1.00 0.00 C ATOM 215 CE2 TYR A 13 10.617 -52.029 -16.262 1.00 0.00 C ATOM 216 CZ TYR A 13 11.336 -51.029 -15.656 1.00 0.00 C ATOM 217 OH TYR A 13 11.869 -50.007 -16.379 1.00 0.00 O ATOM 0 H TYR A 13 10.587 -54.280 -11.125 1.00 0.00 H new ATOM 0 HA TYR A 13 8.473 -52.712 -12.185 1.00 0.00 H new ATOM 0 HB2 TYR A 13 10.311 -54.952 -13.032 1.00 0.00 H new ATOM 0 HB3 TYR A 13 8.848 -54.758 -13.977 1.00 0.00 H new ATOM 0 HD1 TYR A 13 11.095 -52.051 -12.461 1.00 0.00 H new ATOM 0 HD2 TYR A 13 9.499 -53.814 -15.984 1.00 0.00 H new ATOM 0 HE1 TYR A 13 12.079 -50.272 -13.818 1.00 0.00 H new ATOM 0 HE2 TYR A 13 10.484 -52.029 -17.334 1.00 0.00 H new ATOM 0 HH TYR A 13 11.716 -49.160 -15.910 1.00 0.00 H new ATOM 227 N LYS A 14 7.382 -55.332 -10.779 1.00 0.00 N ATOM 228 CA LYS A 14 6.133 -55.824 -10.188 1.00 0.00 C ATOM 229 C LYS A 14 5.311 -54.667 -9.565 1.00 0.00 C ATOM 230 O LYS A 14 4.091 -54.607 -9.735 1.00 0.00 O ATOM 231 CB LYS A 14 6.533 -56.925 -9.155 1.00 0.00 C ATOM 232 CG LYS A 14 5.430 -57.914 -8.678 1.00 0.00 C ATOM 233 CD LYS A 14 4.550 -57.389 -7.526 1.00 0.00 C ATOM 234 CE LYS A 14 3.699 -58.483 -6.880 1.00 0.00 C ATOM 235 NZ LYS A 14 2.908 -57.872 -5.816 1.00 0.00 N ATOM 0 H LYS A 14 8.213 -55.689 -10.307 1.00 0.00 H new ATOM 0 HA LYS A 14 5.474 -56.254 -10.942 1.00 0.00 H new ATOM 0 HB2 LYS A 14 7.343 -57.512 -9.589 1.00 0.00 H new ATOM 0 HB3 LYS A 14 6.937 -56.426 -8.274 1.00 0.00 H new ATOM 0 HG2 LYS A 14 4.789 -58.158 -9.525 1.00 0.00 H new ATOM 0 HG3 LYS A 14 5.906 -58.842 -8.360 1.00 0.00 H new ATOM 0 HD2 LYS A 14 5.187 -56.936 -6.767 1.00 0.00 H new ATOM 0 HD3 LYS A 14 3.896 -56.603 -7.904 1.00 0.00 H new ATOM 0 HE2 LYS A 14 3.047 -58.946 -7.621 1.00 0.00 H new ATOM 0 HE3 LYS A 14 4.334 -59.272 -6.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 2.561 -58.612 -5.172 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 3.499 -57.201 -5.285 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 2.099 -57.367 -6.231 1.00 0.00 H new ATOM 249 N TYR A 15 5.950 -53.700 -8.882 1.00 0.00 N ATOM 250 CA TYR A 15 5.280 -52.500 -8.364 1.00 0.00 C ATOM 251 C TYR A 15 5.371 -51.343 -9.384 1.00 0.00 C ATOM 252 O TYR A 15 6.004 -50.284 -9.230 1.00 0.00 O ATOM 253 CB TYR A 15 5.796 -52.141 -6.944 1.00 0.00 C ATOM 254 CG TYR A 15 5.385 -53.244 -5.956 1.00 0.00 C ATOM 255 CD1 TYR A 15 4.051 -53.489 -5.675 1.00 0.00 C ATOM 256 CD2 TYR A 15 6.315 -54.111 -5.410 1.00 0.00 C ATOM 257 CE1 TYR A 15 3.660 -54.570 -4.914 1.00 0.00 C ATOM 258 CE2 TYR A 15 5.935 -55.196 -4.646 1.00 0.00 C ATOM 259 CZ TYR A 15 4.602 -55.434 -4.417 1.00 0.00 C ATOM 260 OH TYR A 15 4.192 -56.591 -3.828 1.00 0.00 O ATOM 0 H TYR A 15 6.948 -53.732 -8.675 1.00 0.00 H new ATOM 0 HA TYR A 15 4.217 -52.705 -8.240 1.00 0.00 H new ATOM 0 HB2 TYR A 15 6.881 -52.034 -6.956 1.00 0.00 H new ATOM 0 HB3 TYR A 15 5.385 -51.183 -6.627 1.00 0.00 H new ATOM 0 HD1 TYR A 15 3.299 -52.817 -6.061 1.00 0.00 H new ATOM 0 HD2 TYR A 15 7.366 -53.934 -5.586 1.00 0.00 H new ATOM 0 HE1 TYR A 15 2.613 -54.736 -4.709 1.00 0.00 H new ATOM 0 HE2 TYR A 15 6.683 -55.855 -4.230 1.00 0.00 H new ATOM 0 HH TYR A 15 4.974 -57.099 -3.526 1.00 0.00 H new ATOM 270 N ALA A 16 4.596 -51.659 -10.433 1.00 0.00 N ATOM 271 CA ALA A 16 4.497 -50.905 -11.677 1.00 0.00 C ATOM 272 C ALA A 16 4.119 -49.428 -11.489 1.00 0.00 C ATOM 273 O ALA A 16 4.694 -48.561 -12.142 1.00 0.00 O ATOM 274 CB ALA A 16 3.481 -51.629 -12.583 1.00 0.00 C ATOM 0 H ALA A 16 3.998 -52.485 -10.430 1.00 0.00 H new ATOM 0 HA ALA A 16 5.486 -50.875 -12.135 1.00 0.00 H new ATOM 0 HB1 ALA A 16 3.383 -51.089 -13.525 1.00 0.00 H new ATOM 0 HB2 ALA A 16 3.828 -52.643 -12.781 1.00 0.00 H new ATOM 0 HB3 ALA A 16 2.512 -51.668 -12.085 1.00 0.00 H new ATOM 280 N MET A 17 3.201 -49.156 -10.555 1.00 0.00 N ATOM 281 CA MET A 17 2.783 -47.808 -10.177 1.00 0.00 C ATOM 282 C MET A 17 3.915 -46.990 -9.516 1.00 0.00 C ATOM 283 O MET A 17 4.048 -45.798 -9.792 1.00 0.00 O ATOM 284 CB MET A 17 1.552 -47.960 -9.245 1.00 0.00 C ATOM 285 CG MET A 17 0.828 -46.634 -8.926 1.00 0.00 C ATOM 286 SD MET A 17 -0.659 -46.897 -7.924 1.00 0.00 S ATOM 287 CE MET A 17 -1.933 -46.954 -9.211 1.00 0.00 C ATOM 0 H MET A 17 2.719 -49.886 -10.031 1.00 0.00 H new ATOM 0 HA MET A 17 2.522 -47.239 -11.069 1.00 0.00 H new ATOM 0 HB2 MET A 17 0.842 -48.645 -9.709 1.00 0.00 H new ATOM 0 HB3 MET A 17 1.873 -48.419 -8.310 1.00 0.00 H new ATOM 0 HG2 MET A 17 1.509 -45.967 -8.397 1.00 0.00 H new ATOM 0 HG3 MET A 17 0.555 -46.137 -9.857 1.00 0.00 H new ATOM 0 HE1 MET A 17 -2.908 -47.111 -8.751 1.00 0.00 H new ATOM 0 HE2 MET A 17 -1.938 -46.012 -9.760 1.00 0.00 H new ATOM 0 HE3 MET A 17 -1.720 -47.773 -9.898 1.00 0.00 H new ATOM 297 N LEU A 18 4.781 -47.616 -8.705 1.00 0.00 N ATOM 298 CA LEU A 18 5.826 -46.914 -7.951 1.00 0.00 C ATOM 299 C LEU A 18 7.080 -46.643 -8.796 1.00 0.00 C ATOM 300 O LEU A 18 7.658 -45.547 -8.737 1.00 0.00 O ATOM 301 CB LEU A 18 6.158 -47.704 -6.657 1.00 0.00 C ATOM 302 CG LEU A 18 4.937 -47.970 -5.738 1.00 0.00 C ATOM 303 CD1 LEU A 18 5.370 -48.772 -4.505 1.00 0.00 C ATOM 304 CD2 LEU A 18 4.249 -46.670 -5.291 1.00 0.00 C ATOM 0 H LEU A 18 4.775 -48.625 -8.555 1.00 0.00 H new ATOM 0 HA LEU A 18 5.441 -45.933 -7.673 1.00 0.00 H new ATOM 0 HB2 LEU A 18 6.604 -48.659 -6.933 1.00 0.00 H new ATOM 0 HB3 LEU A 18 6.910 -47.153 -6.092 1.00 0.00 H new ATOM 0 HG LEU A 18 4.216 -48.543 -6.321 1.00 0.00 H new ATOM 0 HD11 LEU A 18 4.505 -48.953 -3.867 1.00 0.00 H new ATOM 0 HD12 LEU A 18 5.794 -49.725 -4.821 1.00 0.00 H new ATOM 0 HD13 LEU A 18 6.119 -48.209 -3.949 1.00 0.00 H new ATOM 0 HD21 LEU A 18 3.401 -46.909 -4.650 1.00 0.00 H new ATOM 0 HD22 LEU A 18 4.959 -46.054 -4.739 1.00 0.00 H new ATOM 0 HD23 LEU A 18 3.899 -46.124 -6.167 1.00 0.00 H new ATOM 316 N LYS A 19 7.518 -47.618 -9.605 1.00 0.00 N ATOM 317 CA LYS A 19 8.472 -47.287 -10.666 1.00 0.00 C ATOM 318 C LYS A 19 7.870 -46.355 -11.747 1.00 0.00 C ATOM 319 O LYS A 19 8.624 -45.587 -12.344 1.00 0.00 O ATOM 320 CB LYS A 19 9.093 -48.575 -11.266 1.00 0.00 C ATOM 321 CG LYS A 19 8.155 -49.493 -12.086 1.00 0.00 C ATOM 322 CD LYS A 19 8.232 -49.242 -13.609 1.00 0.00 C ATOM 323 CE LYS A 19 7.293 -50.148 -14.392 1.00 0.00 C ATOM 324 NZ LYS A 19 7.570 -49.937 -15.803 1.00 0.00 N ATOM 0 H LYS A 19 7.241 -48.598 -9.550 1.00 0.00 H new ATOM 0 HA LYS A 19 9.279 -46.713 -10.211 1.00 0.00 H new ATOM 0 HB2 LYS A 19 9.925 -48.283 -11.906 1.00 0.00 H new ATOM 0 HB3 LYS A 19 9.511 -49.162 -10.448 1.00 0.00 H new ATOM 0 HG2 LYS A 19 8.408 -50.534 -11.883 1.00 0.00 H new ATOM 0 HG3 LYS A 19 7.128 -49.344 -11.752 1.00 0.00 H new ATOM 0 HD2 LYS A 19 7.985 -48.201 -13.816 1.00 0.00 H new ATOM 0 HD3 LYS A 19 9.255 -49.401 -13.950 1.00 0.00 H new ATOM 0 HE2 LYS A 19 7.451 -51.192 -14.121 1.00 0.00 H new ATOM 0 HE3 LYS A 19 6.253 -49.913 -14.165 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 6.758 -50.257 -16.368 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 7.735 -48.925 -15.977 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 8.416 -50.478 -16.075 1.00 0.00 H new ATOM 338 N LYS A 20 6.554 -46.365 -12.046 1.00 0.00 N ATOM 339 CA LYS A 20 5.934 -45.301 -12.845 1.00 0.00 C ATOM 340 C LYS A 20 6.008 -43.940 -12.120 1.00 0.00 C ATOM 341 O LYS A 20 6.238 -42.952 -12.813 1.00 0.00 O ATOM 342 CB LYS A 20 4.458 -45.634 -13.200 1.00 0.00 C ATOM 343 CG LYS A 20 3.777 -44.667 -14.203 1.00 0.00 C ATOM 344 CD LYS A 20 4.270 -44.859 -15.651 1.00 0.00 C ATOM 345 CE LYS A 20 3.866 -43.717 -16.586 1.00 0.00 C ATOM 346 NZ LYS A 20 4.680 -42.539 -16.289 1.00 0.00 N ATOM 0 H LYS A 20 5.909 -47.096 -11.746 1.00 0.00 H new ATOM 0 HA LYS A 20 6.501 -45.233 -13.774 1.00 0.00 H new ATOM 0 HB2 LYS A 20 4.421 -46.642 -13.612 1.00 0.00 H new ATOM 0 HB3 LYS A 20 3.875 -45.644 -12.279 1.00 0.00 H new ATOM 0 HG2 LYS A 20 2.698 -44.817 -14.169 1.00 0.00 H new ATOM 0 HG3 LYS A 20 3.966 -43.639 -13.894 1.00 0.00 H new ATOM 0 HD2 LYS A 20 5.356 -44.950 -15.648 1.00 0.00 H new ATOM 0 HD3 LYS A 20 3.873 -45.796 -16.041 1.00 0.00 H new ATOM 0 HE2 LYS A 20 4.004 -44.016 -17.625 1.00 0.00 H new ATOM 0 HE3 LYS A 20 2.809 -43.484 -16.459 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 4.679 -41.900 -17.110 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 4.286 -42.044 -15.464 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 5.655 -42.834 -16.082 1.00 0.00 H new ATOM 360 N CYS A 21 5.842 -43.827 -10.784 1.00 0.00 N ATOM 361 CA CYS A 21 6.192 -42.606 -10.034 1.00 0.00 C ATOM 362 C CYS A 21 7.638 -42.123 -10.284 1.00 0.00 C ATOM 363 O CYS A 21 7.845 -40.918 -10.473 1.00 0.00 O ATOM 364 CB CYS A 21 5.978 -42.819 -8.526 1.00 0.00 C ATOM 365 SG CYS A 21 4.254 -42.969 -7.989 1.00 0.00 S ATOM 0 H CYS A 21 5.465 -44.574 -10.201 1.00 0.00 H new ATOM 0 HA CYS A 21 5.525 -41.827 -10.404 1.00 0.00 H new ATOM 0 HB2 CYS A 21 6.512 -43.720 -8.226 1.00 0.00 H new ATOM 0 HB3 CYS A 21 6.434 -41.985 -7.992 1.00 0.00 H new ATOM 370 N CYS A 22 8.625 -43.044 -10.317 1.00 0.00 N ATOM 371 CA CYS A 22 9.958 -42.751 -10.888 1.00 0.00 C ATOM 372 C CYS A 22 9.866 -42.150 -12.282 1.00 0.00 C ATOM 373 O CYS A 22 10.376 -41.059 -12.517 1.00 0.00 O ATOM 374 CB CYS A 22 10.955 -43.933 -10.777 1.00 0.00 C ATOM 375 SG CYS A 22 12.644 -43.424 -10.330 1.00 0.00 S ATOM 0 H CYS A 22 8.525 -43.993 -9.957 1.00 0.00 H new ATOM 0 HA CYS A 22 10.395 -41.976 -10.258 1.00 0.00 H new ATOM 0 HB2 CYS A 22 10.588 -44.638 -10.031 1.00 0.00 H new ATOM 0 HB3 CYS A 22 10.984 -44.463 -11.729 1.00 0.00 H new ATOM 380 N TYR A 23 9.174 -42.794 -13.199 1.00 0.00 N ATOM 381 CA TYR A 23 9.178 -42.343 -14.582 1.00 0.00 C ATOM 382 C TYR A 23 8.354 -41.051 -14.840 1.00 0.00 C ATOM 383 O TYR A 23 8.689 -40.272 -15.738 1.00 0.00 O ATOM 384 CB TYR A 23 8.908 -43.587 -15.417 1.00 0.00 C ATOM 385 CG TYR A 23 9.918 -44.740 -15.125 1.00 0.00 C ATOM 386 CD1 TYR A 23 11.099 -44.681 -14.343 1.00 0.00 C ATOM 387 CD2 TYR A 23 9.670 -45.924 -15.793 1.00 0.00 C ATOM 388 CE1 TYR A 23 11.974 -45.754 -14.330 1.00 0.00 C ATOM 389 CE2 TYR A 23 10.547 -46.989 -15.766 1.00 0.00 C ATOM 390 CZ TYR A 23 11.705 -46.897 -15.040 1.00 0.00 C ATOM 391 OH TYR A 23 12.595 -47.924 -15.024 1.00 0.00 O ATOM 0 H TYR A 23 8.607 -43.622 -13.019 1.00 0.00 H new ATOM 0 HA TYR A 23 10.140 -41.942 -14.902 1.00 0.00 H new ATOM 0 HB2 TYR A 23 7.895 -43.939 -15.221 1.00 0.00 H new ATOM 0 HB3 TYR A 23 8.956 -43.327 -16.474 1.00 0.00 H new ATOM 0 HD1 TYR A 23 11.316 -43.800 -13.758 1.00 0.00 H new ATOM 0 HD2 TYR A 23 8.755 -46.019 -16.358 1.00 0.00 H new ATOM 0 HE1 TYR A 23 12.884 -45.690 -13.751 1.00 0.00 H new ATOM 0 HE2 TYR A 23 10.321 -47.891 -16.315 1.00 0.00 H new ATOM 0 HH TYR A 23 13.454 -47.607 -14.675 1.00 0.00 H new ATOM 401 N ASP A 24 7.339 -40.789 -13.993 1.00 0.00 N ATOM 402 CA ASP A 24 6.702 -39.472 -13.819 1.00 0.00 C ATOM 403 C ASP A 24 7.698 -38.388 -13.368 1.00 0.00 C ATOM 404 O ASP A 24 7.621 -37.254 -13.841 1.00 0.00 O ATOM 405 CB ASP A 24 5.516 -39.529 -12.800 1.00 0.00 C ATOM 406 CG ASP A 24 4.389 -40.502 -13.164 1.00 0.00 C ATOM 407 OD1 ASP A 24 4.219 -40.873 -14.332 1.00 0.00 O ATOM 408 OD2 ASP A 24 3.671 -40.887 -12.248 1.00 0.00 O ATOM 0 H ASP A 24 6.930 -41.508 -13.396 1.00 0.00 H new ATOM 0 HA ASP A 24 6.319 -39.202 -14.803 1.00 0.00 H new ATOM 0 HB2 ASP A 24 5.911 -39.805 -11.822 1.00 0.00 H new ATOM 0 HB3 ASP A 24 5.094 -38.529 -12.702 1.00 0.00 H new ATOM 413 N GLY A 25 8.600 -38.720 -12.431 1.00 0.00 N ATOM 414 CA GLY A 25 9.755 -37.876 -12.102 1.00 0.00 C ATOM 415 C GLY A 25 10.802 -37.759 -13.221 1.00 0.00 C ATOM 416 O GLY A 25 11.341 -36.673 -13.420 1.00 0.00 O ATOM 0 H GLY A 25 8.548 -39.579 -11.883 1.00 0.00 H new ATOM 0 HA2 GLY A 25 9.398 -36.877 -11.850 1.00 0.00 H new ATOM 0 HA3 GLY A 25 10.238 -38.276 -11.211 1.00 0.00 H new ATOM 420 N ALA A 26 11.122 -38.846 -13.937 1.00 0.00 N ATOM 421 CA ALA A 26 12.083 -38.838 -15.047 1.00 0.00 C ATOM 422 C ALA A 26 11.675 -37.934 -16.226 1.00 0.00 C ATOM 423 O ALA A 26 12.546 -37.242 -16.759 1.00 0.00 O ATOM 424 CB ALA A 26 12.350 -40.273 -15.535 1.00 0.00 C ATOM 0 H ALA A 26 10.716 -39.765 -13.759 1.00 0.00 H new ATOM 0 HA ALA A 26 13.000 -38.406 -14.646 1.00 0.00 H new ATOM 0 HB1 ALA A 26 13.064 -40.250 -16.358 1.00 0.00 H new ATOM 0 HB2 ALA A 26 12.758 -40.866 -14.716 1.00 0.00 H new ATOM 0 HB3 ALA A 26 11.417 -40.721 -15.877 1.00 0.00 H new ATOM 430 N TYR A 27 10.410 -37.896 -16.679 1.00 0.00 N ATOM 431 CA TYR A 27 9.990 -36.836 -17.610 1.00 0.00 C ATOM 432 C TYR A 27 9.327 -35.614 -16.924 1.00 0.00 C ATOM 433 O TYR A 27 8.179 -35.246 -17.193 1.00 0.00 O ATOM 434 CB TYR A 27 9.248 -37.366 -18.876 1.00 0.00 C ATOM 435 CG TYR A 27 8.134 -38.399 -18.632 1.00 0.00 C ATOM 436 CD1 TYR A 27 7.010 -38.131 -17.865 1.00 0.00 C ATOM 437 CD2 TYR A 27 8.179 -39.624 -19.276 1.00 0.00 C ATOM 438 CE1 TYR A 27 5.975 -39.039 -17.756 1.00 0.00 C ATOM 439 CE2 TYR A 27 7.149 -40.536 -19.177 1.00 0.00 C ATOM 440 CZ TYR A 27 6.046 -40.238 -18.419 1.00 0.00 C ATOM 441 OH TYR A 27 5.028 -41.133 -18.317 1.00 0.00 O ATOM 0 H TYR A 27 9.682 -38.564 -16.426 1.00 0.00 H new ATOM 0 HA TYR A 27 10.920 -36.427 -18.006 1.00 0.00 H new ATOM 0 HB2 TYR A 27 8.815 -36.514 -19.400 1.00 0.00 H new ATOM 0 HB3 TYR A 27 9.986 -37.810 -19.544 1.00 0.00 H new ATOM 0 HD1 TYR A 27 6.942 -37.189 -17.340 1.00 0.00 H new ATOM 0 HD2 TYR A 27 9.045 -39.872 -19.872 1.00 0.00 H new ATOM 0 HE1 TYR A 27 5.112 -38.806 -17.150 1.00 0.00 H new ATOM 0 HE2 TYR A 27 7.211 -41.482 -19.695 1.00 0.00 H new ATOM 0 HH TYR A 27 5.238 -41.929 -18.849 1.00 0.00 H new ATOM 451 N ARG A 28 10.089 -34.945 -16.045 1.00 0.00 N ATOM 452 CA ARG A 28 9.615 -33.754 -15.333 1.00 0.00 C ATOM 453 C ARG A 28 10.709 -32.660 -15.322 1.00 0.00 C ATOM 454 O ARG A 28 11.684 -32.726 -14.566 1.00 0.00 O ATOM 455 CB ARG A 28 9.216 -34.174 -13.890 1.00 0.00 C ATOM 456 CG ARG A 28 8.040 -33.418 -13.215 1.00 0.00 C ATOM 457 CD ARG A 28 8.084 -31.883 -13.184 1.00 0.00 C ATOM 458 NE ARG A 28 9.339 -31.407 -12.608 1.00 0.00 N ATOM 459 CZ ARG A 28 9.682 -30.157 -12.500 1.00 0.00 C ATOM 460 NH1 ARG A 28 9.041 -29.166 -12.992 1.00 0.00 N ATOM 461 NH2 ARG A 28 10.754 -29.865 -11.885 1.00 0.00 N ATOM 0 H ARG A 28 11.045 -35.214 -15.811 1.00 0.00 H new ATOM 0 HA ARG A 28 8.746 -33.332 -15.838 1.00 0.00 H new ATOM 0 HB2 ARG A 28 8.966 -35.235 -13.907 1.00 0.00 H new ATOM 0 HB3 ARG A 28 10.094 -34.063 -13.254 1.00 0.00 H new ATOM 0 HG2 ARG A 28 7.121 -33.714 -13.720 1.00 0.00 H new ATOM 0 HG3 ARG A 28 7.966 -33.769 -12.186 1.00 0.00 H new ATOM 0 HD2 ARG A 28 7.972 -31.492 -14.195 1.00 0.00 H new ATOM 0 HD3 ARG A 28 7.245 -31.503 -12.601 1.00 0.00 H new ATOM 0 HE ARG A 28 9.996 -32.108 -12.265 1.00 0.00 H new ATOM 0 HH11 ARG A 28 8.183 -29.325 -13.521 1.00 0.00 H new ATOM 0 HH12 ARG A 28 9.387 -28.216 -12.856 1.00 0.00 H new ATOM 0 HH21 ARG A 28 11.331 -30.605 -11.485 1.00 0.00 H new ATOM 0 HH22 ARG A 28 11.038 -28.890 -11.791 1.00 0.00 H new ATOM 475 N ASN A 29 10.557 -31.645 -16.185 1.00 0.00 N ATOM 476 CA ASN A 29 11.543 -30.566 -16.326 1.00 0.00 C ATOM 477 C ASN A 29 10.949 -29.179 -16.679 1.00 0.00 C ATOM 478 O ASN A 29 11.674 -28.289 -17.142 1.00 0.00 O ATOM 479 CB ASN A 29 12.597 -31.028 -17.386 1.00 0.00 C ATOM 480 CG ASN A 29 11.968 -31.315 -18.752 1.00 0.00 C ATOM 481 OD1 ASN A 29 11.540 -32.424 -19.045 1.00 0.00 O ATOM 482 ND2 ASN A 29 11.882 -30.344 -19.640 1.00 0.00 N ATOM 0 H ASN A 29 9.750 -31.550 -16.802 1.00 0.00 H new ATOM 0 HA ASN A 29 12.002 -30.403 -15.351 1.00 0.00 H new ATOM 0 HB2 ASN A 29 13.359 -30.257 -17.496 1.00 0.00 H new ATOM 0 HB3 ASN A 29 13.101 -31.925 -17.026 1.00 0.00 H new ATOM 0 HD21 ASN A 29 11.464 -30.523 -20.553 1.00 0.00 H new ATOM 0 HD22 ASN A 29 12.233 -29.413 -19.414 1.00 0.00 H new ATOM 489 N ASP A 30 9.647 -28.947 -16.449 1.00 0.00 N ATOM 490 CA ASP A 30 8.918 -27.746 -16.889 1.00 0.00 C ATOM 491 C ASP A 30 9.197 -26.459 -16.063 1.00 0.00 C ATOM 492 O ASP A 30 8.309 -25.857 -15.450 1.00 0.00 O ATOM 493 CB ASP A 30 7.395 -28.089 -17.047 1.00 0.00 C ATOM 494 CG ASP A 30 6.695 -28.502 -15.750 1.00 0.00 C ATOM 495 OD1 ASP A 30 7.201 -29.360 -15.026 1.00 0.00 O ATOM 496 OD2 ASP A 30 5.630 -27.959 -15.462 1.00 0.00 O ATOM 0 H ASP A 30 9.057 -29.605 -15.940 1.00 0.00 H new ATOM 0 HA ASP A 30 9.314 -27.470 -17.866 1.00 0.00 H new ATOM 0 HB2 ASP A 30 6.882 -27.221 -17.460 1.00 0.00 H new ATOM 0 HB3 ASP A 30 7.291 -28.896 -17.773 1.00 0.00 H new ATOM 501 N ASP A 31 10.478 -26.059 -16.043 1.00 0.00 N ATOM 502 CA ASP A 31 11.009 -24.801 -15.484 1.00 0.00 C ATOM 503 C ASP A 31 10.893 -24.648 -13.951 1.00 0.00 C ATOM 504 O ASP A 31 11.888 -24.343 -13.292 1.00 0.00 O ATOM 505 CB ASP A 31 10.427 -23.550 -16.223 1.00 0.00 C ATOM 506 CG ASP A 31 10.618 -23.631 -17.737 1.00 0.00 C ATOM 507 OD1 ASP A 31 11.751 -23.808 -18.195 1.00 0.00 O ATOM 508 OD2 ASP A 31 9.624 -23.545 -18.449 1.00 0.00 O ATOM 0 H ASP A 31 11.217 -26.639 -16.440 1.00 0.00 H new ATOM 0 HA ASP A 31 12.081 -24.862 -15.672 1.00 0.00 H new ATOM 0 HB2 ASP A 31 9.365 -23.459 -15.997 1.00 0.00 H new ATOM 0 HB3 ASP A 31 10.911 -22.650 -15.845 1.00 0.00 H new ATOM 513 N GLU A 32 9.691 -24.800 -13.378 1.00 0.00 N ATOM 514 CA GLU A 32 9.461 -24.799 -11.928 1.00 0.00 C ATOM 515 C GLU A 32 9.954 -26.089 -11.217 1.00 0.00 C ATOM 516 O GLU A 32 10.348 -27.060 -11.878 1.00 0.00 O ATOM 517 CB GLU A 32 7.959 -24.540 -11.677 1.00 0.00 C ATOM 518 CG GLU A 32 7.480 -23.130 -12.155 1.00 0.00 C ATOM 519 CD GLU A 32 6.002 -22.855 -11.856 1.00 0.00 C ATOM 520 OE1 GLU A 32 5.146 -23.656 -12.249 1.00 0.00 O ATOM 521 OE2 GLU A 32 5.720 -21.823 -11.257 1.00 0.00 O ATOM 0 H GLU A 32 8.836 -24.929 -13.920 1.00 0.00 H new ATOM 0 HA GLU A 32 10.060 -24.002 -11.487 1.00 0.00 H new ATOM 0 HB2 GLU A 32 7.376 -25.306 -12.189 1.00 0.00 H new ATOM 0 HB3 GLU A 32 7.754 -24.643 -10.611 1.00 0.00 H new ATOM 0 HG2 GLU A 32 8.089 -22.365 -11.673 1.00 0.00 H new ATOM 0 HG3 GLU A 32 7.648 -23.042 -13.228 1.00 0.00 H new ATOM 528 N THR A 33 9.914 -26.171 -9.874 1.00 0.00 N ATOM 529 CA THR A 33 10.593 -27.257 -9.143 1.00 0.00 C ATOM 530 C THR A 33 9.696 -28.474 -8.823 1.00 0.00 C ATOM 531 O THR A 33 8.462 -28.409 -8.791 1.00 0.00 O ATOM 532 CB THR A 33 11.355 -26.737 -7.889 1.00 0.00 C ATOM 533 OG1 THR A 33 12.130 -27.801 -7.358 1.00 0.00 O ATOM 534 CG2 THR A 33 10.498 -26.267 -6.717 1.00 0.00 C ATOM 0 H THR A 33 9.423 -25.505 -9.278 1.00 0.00 H new ATOM 0 HA THR A 33 11.338 -27.639 -9.841 1.00 0.00 H new ATOM 0 HB THR A 33 11.914 -25.879 -8.261 1.00 0.00 H new ATOM 0 HG1 THR A 33 12.618 -27.488 -6.568 1.00 0.00 H new ATOM 0 HG21 THR A 33 11.144 -25.929 -5.906 1.00 0.00 H new ATOM 0 HG22 THR A 33 9.860 -25.444 -7.040 1.00 0.00 H new ATOM 0 HG23 THR A 33 9.877 -27.091 -6.367 1.00 0.00 H new ATOM 542 N CYS A 34 10.385 -29.587 -8.528 1.00 0.00 N ATOM 543 CA CYS A 34 9.810 -30.925 -8.355 1.00 0.00 C ATOM 544 C CYS A 34 8.767 -31.020 -7.230 1.00 0.00 C ATOM 545 O CYS A 34 7.725 -31.662 -7.389 1.00 0.00 O ATOM 546 CB CYS A 34 10.953 -31.932 -8.054 1.00 0.00 C ATOM 547 SG CYS A 34 12.116 -32.195 -9.417 1.00 0.00 S ATOM 0 H CYS A 34 11.397 -29.577 -8.399 1.00 0.00 H new ATOM 0 HA CYS A 34 9.292 -31.158 -9.285 1.00 0.00 H new ATOM 0 HB2 CYS A 34 11.508 -31.580 -7.185 1.00 0.00 H new ATOM 0 HB3 CYS A 34 10.511 -32.891 -7.783 1.00 0.00 H new ATOM 552 N GLU A 35 9.044 -30.327 -6.116 1.00 0.00 N ATOM 553 CA GLU A 35 8.238 -30.387 -4.896 1.00 0.00 C ATOM 554 C GLU A 35 6.817 -29.818 -5.069 1.00 0.00 C ATOM 555 O GLU A 35 5.930 -30.228 -4.331 1.00 0.00 O ATOM 556 CB GLU A 35 8.917 -29.609 -3.723 1.00 0.00 C ATOM 557 CG GLU A 35 10.462 -29.724 -3.538 1.00 0.00 C ATOM 558 CD GLU A 35 11.008 -31.149 -3.484 1.00 0.00 C ATOM 559 OE1 GLU A 35 10.735 -31.895 -2.541 1.00 0.00 O ATOM 560 OE2 GLU A 35 11.789 -31.493 -4.370 1.00 0.00 O ATOM 0 H GLU A 35 9.846 -29.702 -6.040 1.00 0.00 H new ATOM 0 HA GLU A 35 8.165 -31.450 -4.667 1.00 0.00 H new ATOM 0 HB2 GLU A 35 8.677 -28.553 -3.845 1.00 0.00 H new ATOM 0 HB3 GLU A 35 8.448 -29.937 -2.795 1.00 0.00 H new ATOM 0 HG2 GLU A 35 10.950 -29.196 -4.358 1.00 0.00 H new ATOM 0 HG3 GLU A 35 10.740 -29.211 -2.618 1.00 0.00 H new ATOM 567 N GLU A 36 6.572 -28.889 -6.007 1.00 0.00 N ATOM 568 CA GLU A 36 5.232 -28.365 -6.313 1.00 0.00 C ATOM 569 C GLU A 36 4.322 -29.462 -6.915 1.00 0.00 C ATOM 570 O GLU A 36 3.248 -29.817 -6.403 1.00 0.00 O ATOM 571 CB GLU A 36 5.391 -27.202 -7.333 1.00 0.00 C ATOM 572 CG GLU A 36 6.198 -25.963 -6.840 1.00 0.00 C ATOM 573 CD GLU A 36 6.598 -25.057 -8.011 1.00 0.00 C ATOM 574 OE1 GLU A 36 5.720 -24.483 -8.651 1.00 0.00 O ATOM 575 OE2 GLU A 36 7.793 -24.958 -8.293 1.00 0.00 O ATOM 0 H GLU A 36 7.308 -28.476 -6.581 1.00 0.00 H new ATOM 0 HA GLU A 36 4.764 -28.016 -5.392 1.00 0.00 H new ATOM 0 HB2 GLU A 36 5.876 -27.594 -8.227 1.00 0.00 H new ATOM 0 HB3 GLU A 36 4.397 -26.868 -7.630 1.00 0.00 H new ATOM 0 HG2 GLU A 36 5.599 -25.396 -6.127 1.00 0.00 H new ATOM 0 HG3 GLU A 36 7.092 -26.295 -6.312 1.00 0.00 H new ATOM 582 N ARG A 37 4.855 -30.035 -8.004 1.00 0.00 N ATOM 583 CA ARG A 37 4.222 -31.127 -8.730 1.00 0.00 C ATOM 584 C ARG A 37 4.123 -32.368 -7.832 1.00 0.00 C ATOM 585 O ARG A 37 3.049 -32.958 -7.751 1.00 0.00 O ATOM 586 CB ARG A 37 4.981 -31.438 -10.057 1.00 0.00 C ATOM 587 CG ARG A 37 4.751 -30.437 -11.228 1.00 0.00 C ATOM 588 CD ARG A 37 5.375 -29.052 -11.028 1.00 0.00 C ATOM 589 NE ARG A 37 5.200 -28.258 -12.243 1.00 0.00 N ATOM 590 CZ ARG A 37 5.033 -26.966 -12.282 1.00 0.00 C ATOM 591 NH1 ARG A 37 4.886 -26.201 -11.270 1.00 0.00 N ATOM 592 NH2 ARG A 37 5.015 -26.384 -13.411 1.00 0.00 N ATOM 0 H ARG A 37 5.747 -29.744 -8.403 1.00 0.00 H new ATOM 0 HA ARG A 37 3.212 -30.823 -9.005 1.00 0.00 H new ATOM 0 HB2 ARG A 37 6.049 -31.474 -9.841 1.00 0.00 H new ATOM 0 HB3 ARG A 37 4.690 -32.433 -10.394 1.00 0.00 H new ATOM 0 HG2 ARG A 37 5.154 -30.872 -12.142 1.00 0.00 H new ATOM 0 HG3 ARG A 37 3.678 -30.317 -11.378 1.00 0.00 H new ATOM 0 HD2 ARG A 37 4.907 -28.549 -10.182 1.00 0.00 H new ATOM 0 HD3 ARG A 37 6.435 -29.149 -10.794 1.00 0.00 H new ATOM 0 HE ARG A 37 5.209 -28.756 -13.133 1.00 0.00 H new ATOM 0 HH11 ARG A 37 4.894 -26.594 -10.329 1.00 0.00 H new ATOM 0 HH12 ARG A 37 4.761 -25.197 -11.403 1.00 0.00 H new ATOM 0 HH21 ARG A 37 5.130 -26.927 -14.267 1.00 0.00 H new ATOM 0 HH22 ARG A 37 4.885 -25.374 -13.462 1.00 0.00 H new ATOM 606 N ALA A 38 5.186 -32.773 -7.126 1.00 0.00 N ATOM 607 CA ALA A 38 5.118 -33.888 -6.185 1.00 0.00 C ATOM 608 C ALA A 38 4.553 -33.573 -4.775 1.00 0.00 C ATOM 609 O ALA A 38 4.493 -34.463 -3.927 1.00 0.00 O ATOM 610 CB ALA A 38 6.459 -34.601 -6.226 1.00 0.00 C ATOM 0 H ALA A 38 6.107 -32.339 -7.192 1.00 0.00 H new ATOM 0 HA ALA A 38 4.338 -34.575 -6.513 1.00 0.00 H new ATOM 0 HB1 ALA A 38 6.445 -35.442 -5.533 1.00 0.00 H new ATOM 0 HB2 ALA A 38 6.646 -34.966 -7.236 1.00 0.00 H new ATOM 0 HB3 ALA A 38 7.249 -33.907 -5.938 1.00 0.00 H new ATOM 616 N ALA A 39 4.154 -32.331 -4.453 1.00 0.00 N ATOM 617 CA ALA A 39 3.088 -32.078 -3.475 1.00 0.00 C ATOM 618 C ALA A 39 1.694 -32.457 -4.010 1.00 0.00 C ATOM 619 O ALA A 39 0.816 -32.811 -3.217 1.00 0.00 O ATOM 620 CB ALA A 39 3.100 -30.602 -3.029 1.00 0.00 C ATOM 0 H ALA A 39 4.556 -31.486 -4.858 1.00 0.00 H new ATOM 0 HA ALA A 39 3.291 -32.717 -2.616 1.00 0.00 H new ATOM 0 HB1 ALA A 39 2.303 -30.434 -2.305 1.00 0.00 H new ATOM 0 HB2 ALA A 39 4.061 -30.368 -2.572 1.00 0.00 H new ATOM 0 HB3 ALA A 39 2.944 -29.959 -3.895 1.00 0.00 H new ATOM 626 N ARG A 40 1.437 -32.329 -5.323 1.00 0.00 N ATOM 627 CA ARG A 40 0.261 -32.969 -5.942 1.00 0.00 C ATOM 628 C ARG A 40 0.376 -34.513 -6.049 1.00 0.00 C ATOM 629 O ARG A 40 -0.605 -35.209 -5.780 1.00 0.00 O ATOM 630 CB ARG A 40 -0.031 -32.345 -7.336 1.00 0.00 C ATOM 631 CG ARG A 40 -0.348 -30.827 -7.347 1.00 0.00 C ATOM 632 CD ARG A 40 -1.702 -30.467 -6.727 1.00 0.00 C ATOM 633 NE ARG A 40 -1.886 -29.023 -6.872 1.00 0.00 N ATOM 634 CZ ARG A 40 -2.901 -28.336 -6.430 1.00 0.00 C ATOM 635 NH1 ARG A 40 -3.888 -28.837 -5.786 1.00 0.00 N ATOM 636 NH2 ARG A 40 -2.916 -27.080 -6.647 1.00 0.00 N ATOM 0 H ARG A 40 2.018 -31.796 -5.970 1.00 0.00 H new ATOM 0 HA ARG A 40 -0.577 -32.773 -5.273 1.00 0.00 H new ATOM 0 HB2 ARG A 40 0.832 -32.521 -7.979 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -0.873 -32.875 -7.781 1.00 0.00 H new ATOM 0 HG2 ARG A 40 0.438 -30.298 -6.808 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -0.325 -30.469 -8.376 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -2.507 -31.007 -7.225 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -1.730 -30.753 -5.675 1.00 0.00 H new ATOM 0 HE ARG A 40 -1.155 -28.508 -7.363 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -3.913 -29.837 -5.589 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -4.649 -28.236 -5.470 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -2.147 -26.641 -7.154 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -3.697 -26.514 -6.314 1.00 0.00 H new ATOM 650 N ILE A 41 1.517 -35.094 -6.467 1.00 0.00 N ATOM 651 CA ILE A 41 1.768 -36.546 -6.453 1.00 0.00 C ATOM 652 C ILE A 41 2.021 -37.123 -5.038 1.00 0.00 C ATOM 653 O ILE A 41 3.116 -37.360 -4.527 1.00 0.00 O ATOM 654 CB ILE A 41 2.791 -37.042 -7.527 1.00 0.00 C ATOM 655 CG1 ILE A 41 2.394 -36.617 -8.956 1.00 0.00 C ATOM 656 CG2 ILE A 41 2.897 -38.538 -7.538 1.00 0.00 C ATOM 657 CD1 ILE A 41 3.340 -35.512 -9.351 1.00 0.00 C ATOM 0 H ILE A 41 2.304 -34.556 -6.830 1.00 0.00 H new ATOM 0 HA ILE A 41 0.820 -36.979 -6.771 1.00 0.00 H new ATOM 0 HB ILE A 41 3.740 -36.585 -7.248 1.00 0.00 H new ATOM 0 HG12 ILE A 41 2.469 -37.457 -9.646 1.00 0.00 H new ATOM 0 HG13 ILE A 41 1.360 -36.272 -8.985 1.00 0.00 H new ATOM 0 HG21 ILE A 41 3.617 -38.846 -8.296 1.00 0.00 H new ATOM 0 HG22 ILE A 41 3.229 -38.886 -6.560 1.00 0.00 H new ATOM 0 HG23 ILE A 41 1.923 -38.970 -7.766 1.00 0.00 H new ATOM 0 HD11 ILE A 41 3.102 -35.173 -10.359 1.00 0.00 H new ATOM 0 HD12 ILE A 41 3.238 -34.680 -8.654 1.00 0.00 H new ATOM 0 HD13 ILE A 41 4.364 -35.884 -9.325 1.00 0.00 H new ATOM 669 N LYS A 42 0.846 -37.349 -4.467 1.00 0.00 N ATOM 670 CA LYS A 42 0.622 -37.878 -3.116 1.00 0.00 C ATOM 671 C LYS A 42 0.263 -39.382 -3.036 1.00 0.00 C ATOM 672 O LYS A 42 -0.292 -39.820 -2.024 1.00 0.00 O ATOM 673 CB LYS A 42 -0.475 -37.034 -2.404 1.00 0.00 C ATOM 674 CG LYS A 42 0.035 -35.708 -1.811 1.00 0.00 C ATOM 675 CD LYS A 42 -1.034 -35.098 -0.878 1.00 0.00 C ATOM 676 CE LYS A 42 -0.591 -33.797 -0.203 1.00 0.00 C ATOM 677 NZ LYS A 42 -0.658 -32.708 -1.169 1.00 0.00 N ATOM 0 H LYS A 42 -0.029 -37.160 -4.956 1.00 0.00 H new ATOM 0 HA LYS A 42 1.584 -37.794 -2.611 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -1.271 -36.818 -3.117 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -0.915 -37.631 -1.605 1.00 0.00 H new ATOM 0 HG2 LYS A 42 0.958 -35.880 -1.257 1.00 0.00 H new ATOM 0 HG3 LYS A 42 0.271 -35.009 -2.613 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -1.940 -34.908 -1.453 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -1.291 -35.827 -0.109 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -1.232 -33.581 0.652 1.00 0.00 H new ATOM 0 HE3 LYS A 42 0.425 -33.899 0.178 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -0.407 -31.813 -0.702 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 0.008 -32.892 -1.946 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -1.623 -32.640 -1.550 1.00 0.00 H new ATOM 691 N ILE A 43 0.575 -40.203 -4.051 1.00 0.00 N ATOM 692 CA ILE A 43 0.139 -41.610 -4.125 1.00 0.00 C ATOM 693 C ILE A 43 0.740 -42.501 -3.009 1.00 0.00 C ATOM 694 O ILE A 43 0.046 -43.373 -2.478 1.00 0.00 O ATOM 695 CB ILE A 43 0.385 -42.163 -5.576 1.00 0.00 C ATOM 696 CG1 ILE A 43 -0.433 -41.342 -6.622 1.00 0.00 C ATOM 697 CG2 ILE A 43 0.030 -43.669 -5.708 1.00 0.00 C ATOM 698 CD1 ILE A 43 -0.007 -41.565 -8.093 1.00 0.00 C ATOM 0 H ILE A 43 1.140 -39.910 -4.848 1.00 0.00 H new ATOM 0 HA ILE A 43 -0.933 -41.645 -3.930 1.00 0.00 H new ATOM 0 HB ILE A 43 1.452 -42.055 -5.773 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -1.488 -41.598 -6.520 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -0.338 -40.282 -6.387 1.00 0.00 H new ATOM 0 HG21 ILE A 43 0.219 -43.999 -6.730 1.00 0.00 H new ATOM 0 HG22 ILE A 43 0.645 -44.249 -5.020 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -1.023 -43.817 -5.467 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -0.629 -40.955 -8.748 1.00 0.00 H new ATOM 0 HD12 ILE A 43 1.038 -41.281 -8.216 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -0.130 -42.617 -8.352 1.00 0.00 H new ATOM 710 N GLY A 44 2.002 -42.289 -2.610 1.00 0.00 N ATOM 711 CA GLY A 44 2.596 -42.997 -1.464 1.00 0.00 C ATOM 712 C GLY A 44 4.029 -42.559 -1.084 1.00 0.00 C ATOM 713 O GLY A 44 4.676 -41.915 -1.916 1.00 0.00 O ATOM 0 H GLY A 44 2.634 -41.631 -3.065 1.00 0.00 H new ATOM 0 HA2 GLY A 44 1.950 -42.857 -0.598 1.00 0.00 H new ATOM 0 HA3 GLY A 44 2.607 -44.064 -1.684 1.00 0.00 H new ATOM 717 N PRO A 45 4.579 -42.875 0.119 1.00 0.00 N ATOM 718 CA PRO A 45 5.975 -42.582 0.519 1.00 0.00 C ATOM 719 C PRO A 45 7.070 -43.086 -0.447 1.00 0.00 C ATOM 720 O PRO A 45 7.977 -42.337 -0.823 1.00 0.00 O ATOM 721 CB PRO A 45 6.103 -43.263 1.894 1.00 0.00 C ATOM 722 CG PRO A 45 4.706 -43.121 2.452 1.00 0.00 C ATOM 723 CD PRO A 45 3.835 -43.457 1.245 1.00 0.00 C ATOM 0 HA PRO A 45 6.143 -41.505 0.522 1.00 0.00 H new ATOM 0 HB2 PRO A 45 6.402 -44.308 1.805 1.00 0.00 H new ATOM 0 HB3 PRO A 45 6.845 -42.772 2.524 1.00 0.00 H new ATOM 0 HG2 PRO A 45 4.529 -43.804 3.283 1.00 0.00 H new ATOM 0 HG3 PRO A 45 4.517 -42.113 2.822 1.00 0.00 H new ATOM 0 HD2 PRO A 45 3.706 -44.533 1.129 1.00 0.00 H new ATOM 0 HD3 PRO A 45 2.838 -43.025 1.335 1.00 0.00 H new ATOM 731 N LYS A 46 6.969 -44.360 -0.853 1.00 0.00 N ATOM 732 CA LYS A 46 7.830 -44.963 -1.874 1.00 0.00 C ATOM 733 C LYS A 46 7.661 -44.349 -3.279 1.00 0.00 C ATOM 734 O LYS A 46 8.622 -44.318 -4.055 1.00 0.00 O ATOM 735 CB LYS A 46 7.617 -46.498 -1.881 1.00 0.00 C ATOM 736 CG LYS A 46 8.457 -47.181 -0.782 1.00 0.00 C ATOM 737 CD LYS A 46 8.267 -48.714 -0.727 1.00 0.00 C ATOM 738 CE LYS A 46 9.536 -49.433 -0.243 1.00 0.00 C ATOM 739 NZ LYS A 46 10.413 -49.589 -1.398 1.00 0.00 N ATOM 0 H LYS A 46 6.277 -45.007 -0.475 1.00 0.00 H new ATOM 0 HA LYS A 46 8.862 -44.739 -1.604 1.00 0.00 H new ATOM 0 HB2 LYS A 46 6.561 -46.722 -1.728 1.00 0.00 H new ATOM 0 HB3 LYS A 46 7.891 -46.902 -2.856 1.00 0.00 H new ATOM 0 HG2 LYS A 46 9.511 -46.959 -0.950 1.00 0.00 H new ATOM 0 HG3 LYS A 46 8.192 -46.755 0.185 1.00 0.00 H new ATOM 0 HD2 LYS A 46 7.438 -48.953 -0.061 1.00 0.00 H new ATOM 0 HD3 LYS A 46 7.997 -49.082 -1.717 1.00 0.00 H new ATOM 0 HE2 LYS A 46 10.030 -48.856 0.539 1.00 0.00 H new ATOM 0 HE3 LYS A 46 9.288 -50.404 0.185 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 11.358 -49.884 -1.079 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 10.022 -50.311 -2.036 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 10.486 -48.683 -1.904 1.00 0.00 H new ATOM 753 N CYS A 47 6.458 -43.833 -3.582 1.00 0.00 N ATOM 754 CA CYS A 47 6.190 -43.060 -4.793 1.00 0.00 C ATOM 755 C CYS A 47 6.946 -41.721 -4.778 1.00 0.00 C ATOM 756 O CYS A 47 7.723 -41.497 -5.707 1.00 0.00 O ATOM 757 CB CYS A 47 4.665 -42.849 -4.972 1.00 0.00 C ATOM 758 SG CYS A 47 4.175 -41.787 -6.356 1.00 0.00 S ATOM 0 H CYS A 47 5.640 -43.945 -2.983 1.00 0.00 H new ATOM 0 HA CYS A 47 6.556 -43.626 -5.649 1.00 0.00 H new ATOM 0 HB2 CYS A 47 4.195 -43.824 -5.102 1.00 0.00 H new ATOM 0 HB3 CYS A 47 4.265 -42.423 -4.052 1.00 0.00 H new ATOM 763 N VAL A 48 6.745 -40.830 -3.783 1.00 0.00 N ATOM 764 CA VAL A 48 7.582 -39.628 -3.625 1.00 0.00 C ATOM 765 C VAL A 48 9.101 -39.884 -3.586 1.00 0.00 C ATOM 766 O VAL A 48 9.837 -39.087 -4.162 1.00 0.00 O ATOM 767 CB VAL A 48 7.175 -38.659 -2.458 1.00 0.00 C ATOM 768 CG1 VAL A 48 6.632 -37.351 -3.028 1.00 0.00 C ATOM 769 CG2 VAL A 48 6.115 -39.180 -1.492 1.00 0.00 C ATOM 0 H VAL A 48 6.011 -40.923 -3.080 1.00 0.00 H new ATOM 0 HA VAL A 48 7.358 -39.112 -4.559 1.00 0.00 H new ATOM 0 HB VAL A 48 8.100 -38.540 -1.893 1.00 0.00 H new ATOM 0 HG11 VAL A 48 6.353 -36.686 -2.211 1.00 0.00 H new ATOM 0 HG12 VAL A 48 7.399 -36.874 -3.638 1.00 0.00 H new ATOM 0 HG13 VAL A 48 5.756 -37.558 -3.643 1.00 0.00 H new ATOM 0 HG21 VAL A 48 5.915 -38.427 -0.730 1.00 0.00 H new ATOM 0 HG22 VAL A 48 5.197 -39.394 -2.040 1.00 0.00 H new ATOM 0 HG23 VAL A 48 6.474 -40.092 -1.015 1.00 0.00 H new ATOM 779 N LYS A 49 9.592 -40.952 -2.933 1.00 0.00 N ATOM 780 CA LYS A 49 11.006 -41.371 -3.013 1.00 0.00 C ATOM 781 C LYS A 49 11.492 -41.637 -4.461 1.00 0.00 C ATOM 782 O LYS A 49 12.462 -41.008 -4.907 1.00 0.00 O ATOM 783 CB LYS A 49 11.195 -42.633 -2.131 1.00 0.00 C ATOM 784 CG LYS A 49 12.663 -43.131 -1.995 1.00 0.00 C ATOM 785 CD LYS A 49 12.784 -44.668 -2.117 1.00 0.00 C ATOM 786 CE LYS A 49 12.229 -45.445 -0.925 1.00 0.00 C ATOM 787 NZ LYS A 49 12.253 -46.860 -1.278 1.00 0.00 N ATOM 0 H LYS A 49 9.022 -41.550 -2.335 1.00 0.00 H new ATOM 0 HA LYS A 49 11.619 -40.547 -2.648 1.00 0.00 H new ATOM 0 HB2 LYS A 49 10.806 -42.422 -1.135 1.00 0.00 H new ATOM 0 HB3 LYS A 49 10.591 -43.440 -2.545 1.00 0.00 H new ATOM 0 HG2 LYS A 49 13.275 -42.660 -2.764 1.00 0.00 H new ATOM 0 HG3 LYS A 49 13.062 -42.814 -1.032 1.00 0.00 H new ATOM 0 HD2 LYS A 49 12.263 -44.990 -3.019 1.00 0.00 H new ATOM 0 HD3 LYS A 49 13.835 -44.928 -2.246 1.00 0.00 H new ATOM 0 HE2 LYS A 49 12.829 -45.261 -0.034 1.00 0.00 H new ATOM 0 HE3 LYS A 49 11.213 -45.123 -0.697 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 11.803 -47.414 -0.522 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 11.735 -47.005 -2.168 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 13.238 -47.172 -1.396 1.00 0.00 H new ATOM 801 N ALA A 50 10.808 -42.544 -5.190 1.00 0.00 N ATOM 802 CA ALA A 50 11.047 -42.811 -6.617 1.00 0.00 C ATOM 803 C ALA A 50 10.975 -41.510 -7.448 1.00 0.00 C ATOM 804 O ALA A 50 11.935 -41.164 -8.147 1.00 0.00 O ATOM 805 CB ALA A 50 9.973 -43.833 -7.066 1.00 0.00 C ATOM 0 H ALA A 50 10.064 -43.118 -4.794 1.00 0.00 H new ATOM 0 HA ALA A 50 12.047 -43.214 -6.775 1.00 0.00 H new ATOM 0 HB1 ALA A 50 10.109 -44.064 -8.123 1.00 0.00 H new ATOM 0 HB2 ALA A 50 10.072 -44.746 -6.479 1.00 0.00 H new ATOM 0 HB3 ALA A 50 8.981 -43.409 -6.912 1.00 0.00 H new ATOM 811 N PHE A 51 9.876 -40.753 -7.262 1.00 0.00 N ATOM 812 CA PHE A 51 9.632 -39.464 -7.913 1.00 0.00 C ATOM 813 C PHE A 51 10.778 -38.475 -7.660 1.00 0.00 C ATOM 814 O PHE A 51 11.389 -38.043 -8.633 1.00 0.00 O ATOM 815 CB PHE A 51 8.292 -38.865 -7.384 1.00 0.00 C ATOM 816 CG PHE A 51 7.667 -37.846 -8.346 1.00 0.00 C ATOM 817 CD1 PHE A 51 8.255 -36.625 -8.637 1.00 0.00 C ATOM 818 CD2 PHE A 51 6.537 -38.178 -9.064 1.00 0.00 C ATOM 819 CE1 PHE A 51 7.766 -35.798 -9.627 1.00 0.00 C ATOM 820 CE2 PHE A 51 6.037 -37.363 -10.040 1.00 0.00 C ATOM 821 CZ PHE A 51 6.657 -36.172 -10.345 1.00 0.00 C ATOM 0 H PHE A 51 9.119 -41.033 -6.639 1.00 0.00 H new ATOM 0 HA PHE A 51 9.570 -39.632 -8.988 1.00 0.00 H new ATOM 0 HB2 PHE A 51 7.583 -39.674 -7.210 1.00 0.00 H new ATOM 0 HB3 PHE A 51 8.470 -38.385 -6.422 1.00 0.00 H new ATOM 0 HD1 PHE A 51 9.121 -36.312 -8.072 1.00 0.00 H new ATOM 0 HD2 PHE A 51 6.033 -39.109 -8.849 1.00 0.00 H new ATOM 0 HE1 PHE A 51 8.255 -34.858 -9.837 1.00 0.00 H new ATOM 0 HE2 PHE A 51 5.147 -37.656 -10.577 1.00 0.00 H new ATOM 0 HZ PHE A 51 6.277 -35.542 -11.136 1.00 0.00 H new ATOM 831 N LYS A 52 11.100 -38.137 -6.400 1.00 0.00 N ATOM 832 CA LYS A 52 12.144 -37.166 -6.074 1.00 0.00 C ATOM 833 C LYS A 52 13.545 -37.576 -6.553 1.00 0.00 C ATOM 834 O LYS A 52 14.260 -36.694 -7.036 1.00 0.00 O ATOM 835 CB LYS A 52 12.150 -36.847 -4.558 1.00 0.00 C ATOM 836 CG LYS A 52 11.034 -35.848 -4.165 1.00 0.00 C ATOM 837 CD LYS A 52 10.821 -35.703 -2.636 1.00 0.00 C ATOM 838 CE LYS A 52 12.016 -35.231 -1.789 1.00 0.00 C ATOM 839 NZ LYS A 52 12.437 -33.908 -2.230 1.00 0.00 N ATOM 0 H LYS A 52 10.639 -38.534 -5.581 1.00 0.00 H new ATOM 0 HA LYS A 52 11.892 -36.262 -6.628 1.00 0.00 H new ATOM 0 HB2 LYS A 52 12.023 -37.771 -3.994 1.00 0.00 H new ATOM 0 HB3 LYS A 52 13.119 -36.434 -4.279 1.00 0.00 H new ATOM 0 HG2 LYS A 52 11.274 -34.870 -4.582 1.00 0.00 H new ATOM 0 HG3 LYS A 52 10.098 -36.168 -4.622 1.00 0.00 H new ATOM 0 HD2 LYS A 52 10.000 -35.004 -2.477 1.00 0.00 H new ATOM 0 HD3 LYS A 52 10.497 -36.669 -2.249 1.00 0.00 H new ATOM 0 HE2 LYS A 52 11.739 -35.203 -0.735 1.00 0.00 H new ATOM 0 HE3 LYS A 52 12.842 -35.936 -1.883 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 12.947 -33.431 -1.459 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 13.064 -34.000 -3.055 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 11.601 -33.347 -2.491 1.00 0.00 H new ATOM 853 N ASP A 53 13.971 -38.853 -6.480 1.00 0.00 N ATOM 854 CA ASP A 53 15.281 -39.226 -7.026 1.00 0.00 C ATOM 855 C ASP A 53 15.368 -39.142 -8.562 1.00 0.00 C ATOM 856 O ASP A 53 16.304 -38.511 -9.084 1.00 0.00 O ATOM 857 CB ASP A 53 15.764 -40.577 -6.447 1.00 0.00 C ATOM 858 CG ASP A 53 16.362 -40.364 -5.059 1.00 0.00 C ATOM 859 OD1 ASP A 53 17.348 -39.624 -4.960 1.00 0.00 O ATOM 860 OD2 ASP A 53 15.859 -40.939 -4.102 1.00 0.00 O ATOM 0 H ASP A 53 13.443 -39.618 -6.061 1.00 0.00 H new ATOM 0 HA ASP A 53 15.986 -38.466 -6.689 1.00 0.00 H new ATOM 0 HB2 ASP A 53 14.930 -41.277 -6.390 1.00 0.00 H new ATOM 0 HB3 ASP A 53 16.508 -41.021 -7.109 1.00 0.00 H new ATOM 865 N CYS A 54 14.383 -39.720 -9.269 1.00 0.00 N ATOM 866 CA CYS A 54 14.250 -39.547 -10.718 1.00 0.00 C ATOM 867 C CYS A 54 14.069 -38.070 -11.155 1.00 0.00 C ATOM 868 O CYS A 54 14.701 -37.661 -12.133 1.00 0.00 O ATOM 869 CB CYS A 54 13.086 -40.431 -11.227 1.00 0.00 C ATOM 870 SG CYS A 54 13.449 -42.153 -11.691 1.00 0.00 S ATOM 0 H CYS A 54 13.665 -40.314 -8.854 1.00 0.00 H new ATOM 0 HA CYS A 54 15.188 -39.864 -11.174 1.00 0.00 H new ATOM 0 HB2 CYS A 54 12.320 -40.450 -10.452 1.00 0.00 H new ATOM 0 HB3 CYS A 54 12.649 -39.938 -12.095 1.00 0.00 H new ATOM 875 N CYS A 55 13.260 -37.256 -10.448 1.00 0.00 N ATOM 876 CA CYS A 55 13.075 -35.823 -10.734 1.00 0.00 C ATOM 877 C CYS A 55 14.349 -34.990 -10.522 1.00 0.00 C ATOM 878 O CYS A 55 14.635 -34.113 -11.339 1.00 0.00 O ATOM 879 CB CYS A 55 11.918 -35.236 -9.886 1.00 0.00 C ATOM 880 SG CYS A 55 11.255 -33.664 -10.502 1.00 0.00 S ATOM 0 H CYS A 55 12.711 -37.581 -9.653 1.00 0.00 H new ATOM 0 HA CYS A 55 12.824 -35.760 -11.793 1.00 0.00 H new ATOM 0 HB2 CYS A 55 11.109 -35.965 -9.844 1.00 0.00 H new ATOM 0 HB3 CYS A 55 12.270 -35.092 -8.865 1.00 0.00 H new ATOM 885 N TYR A 56 15.126 -35.226 -9.453 1.00 0.00 N ATOM 886 CA TYR A 56 16.423 -34.566 -9.290 1.00 0.00 C ATOM 887 C TYR A 56 17.443 -34.966 -10.368 1.00 0.00 C ATOM 888 O TYR A 56 18.186 -34.083 -10.799 1.00 0.00 O ATOM 889 CB TYR A 56 16.965 -34.688 -7.845 1.00 0.00 C ATOM 890 CG TYR A 56 16.280 -33.633 -6.962 1.00 0.00 C ATOM 891 CD1 TYR A 56 14.994 -33.822 -6.488 1.00 0.00 C ATOM 892 CD2 TYR A 56 16.883 -32.416 -6.687 1.00 0.00 C ATOM 893 CE1 TYR A 56 14.325 -32.841 -5.792 1.00 0.00 C ATOM 894 CE2 TYR A 56 16.221 -31.428 -5.983 1.00 0.00 C ATOM 895 CZ TYR A 56 14.940 -31.642 -5.542 1.00 0.00 C ATOM 896 OH TYR A 56 14.273 -30.673 -4.868 1.00 0.00 O ATOM 0 H TYR A 56 14.878 -35.864 -8.697 1.00 0.00 H new ATOM 0 HA TYR A 56 16.251 -33.502 -9.453 1.00 0.00 H new ATOM 0 HB2 TYR A 56 16.774 -35.687 -7.454 1.00 0.00 H new ATOM 0 HB3 TYR A 56 18.045 -34.543 -7.835 1.00 0.00 H new ATOM 0 HD1 TYR A 56 14.501 -34.766 -6.669 1.00 0.00 H new ATOM 0 HD2 TYR A 56 17.891 -32.236 -7.030 1.00 0.00 H new ATOM 0 HE1 TYR A 56 13.318 -33.016 -5.444 1.00 0.00 H new ATOM 0 HE2 TYR A 56 16.712 -30.488 -5.780 1.00 0.00 H new ATOM 0 HH TYR A 56 13.319 -30.896 -4.834 1.00 0.00 H new ATOM 906 N ILE A 57 17.487 -36.223 -10.852 1.00 0.00 N ATOM 907 CA ILE A 57 18.249 -36.548 -12.077 1.00 0.00 C ATOM 908 C ILE A 57 17.745 -35.791 -13.323 1.00 0.00 C ATOM 909 O ILE A 57 18.552 -35.231 -14.069 1.00 0.00 O ATOM 910 CB ILE A 57 18.314 -38.093 -12.319 1.00 0.00 C ATOM 911 CG1 ILE A 57 18.906 -38.874 -11.117 1.00 0.00 C ATOM 912 CG2 ILE A 57 19.067 -38.512 -13.611 1.00 0.00 C ATOM 913 CD1 ILE A 57 20.202 -38.302 -10.525 1.00 0.00 C ATOM 0 H ILE A 57 17.013 -37.018 -10.423 1.00 0.00 H new ATOM 0 HA ILE A 57 19.267 -36.196 -11.907 1.00 0.00 H new ATOM 0 HB ILE A 57 17.266 -38.365 -12.443 1.00 0.00 H new ATOM 0 HG12 ILE A 57 18.155 -38.915 -10.328 1.00 0.00 H new ATOM 0 HG13 ILE A 57 19.094 -39.901 -11.431 1.00 0.00 H new ATOM 0 HG21 ILE A 57 19.063 -39.598 -13.698 1.00 0.00 H new ATOM 0 HG22 ILE A 57 18.571 -38.076 -14.479 1.00 0.00 H new ATOM 0 HG23 ILE A 57 20.096 -38.156 -13.564 1.00 0.00 H new ATOM 0 HD11 ILE A 57 20.527 -38.925 -9.692 1.00 0.00 H new ATOM 0 HD12 ILE A 57 20.977 -38.288 -11.291 1.00 0.00 H new ATOM 0 HD13 ILE A 57 20.023 -37.287 -10.171 1.00 0.00 H new ATOM 925 N ALA A 58 16.424 -35.747 -13.528 1.00 0.00 N ATOM 926 CA ALA A 58 15.785 -34.933 -14.578 1.00 0.00 C ATOM 927 C ALA A 58 16.131 -33.426 -14.492 1.00 0.00 C ATOM 928 O ALA A 58 16.445 -32.802 -15.510 1.00 0.00 O ATOM 929 CB ALA A 58 14.265 -35.136 -14.535 1.00 0.00 C ATOM 0 H ALA A 58 15.759 -36.279 -12.967 1.00 0.00 H new ATOM 0 HA ALA A 58 16.185 -35.279 -15.531 1.00 0.00 H new ATOM 0 HB1 ALA A 58 13.795 -34.533 -15.312 1.00 0.00 H new ATOM 0 HB2 ALA A 58 14.034 -36.188 -14.702 1.00 0.00 H new ATOM 0 HB3 ALA A 58 13.885 -34.831 -13.560 1.00 0.00 H new ATOM 935 N ASN A 59 16.089 -32.840 -13.285 1.00 0.00 N ATOM 936 CA ASN A 59 16.551 -31.473 -13.024 1.00 0.00 C ATOM 937 C ASN A 59 18.074 -31.299 -13.236 1.00 0.00 C ATOM 938 O ASN A 59 18.482 -30.236 -13.713 1.00 0.00 O ATOM 939 CB ASN A 59 16.126 -31.061 -11.585 1.00 0.00 C ATOM 940 CG ASN A 59 16.063 -29.543 -11.385 1.00 0.00 C ATOM 941 OD1 ASN A 59 15.047 -29.018 -10.954 1.00 0.00 O ATOM 942 ND2 ASN A 59 17.088 -28.753 -11.649 1.00 0.00 N ATOM 0 H ASN A 59 15.728 -33.310 -12.455 1.00 0.00 H new ATOM 0 HA ASN A 59 16.079 -30.812 -13.751 1.00 0.00 H new ATOM 0 HB2 ASN A 59 15.149 -31.491 -11.365 1.00 0.00 H new ATOM 0 HB3 ASN A 59 16.830 -31.486 -10.870 1.00 0.00 H new ATOM 0 HD21 ASN A 59 17.011 -27.748 -11.491 1.00 0.00 H new ATOM 0 HD22 ASN A 59 17.956 -29.148 -12.010 1.00 0.00 H new ATOM 949 N GLN A 60 18.930 -32.271 -12.873 1.00 0.00 N ATOM 950 CA GLN A 60 20.356 -32.259 -13.234 1.00 0.00 C ATOM 951 C GLN A 60 20.602 -32.358 -14.754 1.00 0.00 C ATOM 952 O GLN A 60 21.482 -31.657 -15.256 1.00 0.00 O ATOM 953 CB GLN A 60 21.128 -33.372 -12.482 1.00 0.00 C ATOM 954 CG GLN A 60 21.251 -33.089 -10.959 1.00 0.00 C ATOM 955 CD GLN A 60 21.884 -34.263 -10.212 1.00 0.00 C ATOM 956 OE1 GLN A 60 21.232 -34.969 -9.452 1.00 0.00 O ATOM 957 NE2 GLN A 60 23.166 -34.530 -10.373 1.00 0.00 N ATOM 0 H GLN A 60 18.652 -33.084 -12.323 1.00 0.00 H new ATOM 0 HA GLN A 60 20.739 -31.287 -12.922 1.00 0.00 H new ATOM 0 HB2 GLN A 60 20.621 -34.325 -12.631 1.00 0.00 H new ATOM 0 HB3 GLN A 60 22.125 -33.471 -12.911 1.00 0.00 H new ATOM 0 HG2 GLN A 60 21.852 -32.193 -10.803 1.00 0.00 H new ATOM 0 HG3 GLN A 60 20.263 -32.886 -10.546 1.00 0.00 H new ATOM 0 HE21 GLN A 60 23.731 -33.958 -11.000 1.00 0.00 H new ATOM 0 HE22 GLN A 60 23.592 -35.309 -9.871 1.00 0.00 H new ATOM 966 N VAL A 61 19.858 -33.198 -15.495 1.00 0.00 N ATOM 967 CA VAL A 61 19.874 -33.211 -16.969 1.00 0.00 C ATOM 968 C VAL A 61 19.392 -31.873 -17.576 1.00 0.00 C ATOM 969 O VAL A 61 19.977 -31.404 -18.555 1.00 0.00 O ATOM 970 CB VAL A 61 19.067 -34.440 -17.516 1.00 0.00 C ATOM 971 CG1 VAL A 61 18.924 -34.489 -19.055 1.00 0.00 C ATOM 972 CG2 VAL A 61 19.732 -35.770 -17.100 1.00 0.00 C ATOM 0 H VAL A 61 19.227 -33.889 -15.088 1.00 0.00 H new ATOM 0 HA VAL A 61 20.910 -33.323 -17.289 1.00 0.00 H new ATOM 0 HB VAL A 61 18.077 -34.313 -17.078 1.00 0.00 H new ATOM 0 HG11 VAL A 61 18.352 -35.372 -19.339 1.00 0.00 H new ATOM 0 HG12 VAL A 61 18.406 -33.594 -19.401 1.00 0.00 H new ATOM 0 HG13 VAL A 61 19.913 -34.535 -19.511 1.00 0.00 H new ATOM 0 HG21 VAL A 61 19.152 -36.605 -17.492 1.00 0.00 H new ATOM 0 HG22 VAL A 61 20.745 -35.811 -17.501 1.00 0.00 H new ATOM 0 HG23 VAL A 61 19.769 -35.834 -16.012 1.00 0.00 H new ATOM 982 N ARG A 62 18.343 -31.240 -17.020 1.00 0.00 N ATOM 983 CA ARG A 62 17.951 -29.872 -17.386 1.00 0.00 C ATOM 984 C ARG A 62 19.046 -28.819 -17.084 1.00 0.00 C ATOM 985 O ARG A 62 19.270 -27.932 -17.913 1.00 0.00 O ATOM 986 CB ARG A 62 16.603 -29.524 -16.686 1.00 0.00 C ATOM 987 CG ARG A 62 16.004 -28.130 -17.021 1.00 0.00 C ATOM 988 CD ARG A 62 15.506 -27.974 -18.468 1.00 0.00 C ATOM 989 NE ARG A 62 15.370 -26.544 -18.737 1.00 0.00 N ATOM 990 CZ ARG A 62 14.286 -25.829 -18.623 1.00 0.00 C ATOM 991 NH1 ARG A 62 13.144 -26.227 -18.213 1.00 0.00 N ATOM 992 NH2 ARG A 62 14.330 -24.593 -18.925 1.00 0.00 N ATOM 0 H ARG A 62 17.747 -31.662 -16.308 1.00 0.00 H new ATOM 0 HA ARG A 62 17.819 -29.838 -18.468 1.00 0.00 H new ATOM 0 HB2 ARG A 62 15.870 -30.286 -16.952 1.00 0.00 H new ATOM 0 HB3 ARG A 62 16.750 -29.585 -15.608 1.00 0.00 H new ATOM 0 HG2 ARG A 62 15.174 -27.934 -16.343 1.00 0.00 H new ATOM 0 HG3 ARG A 62 16.760 -27.369 -16.828 1.00 0.00 H new ATOM 0 HD2 ARG A 62 16.208 -28.430 -19.166 1.00 0.00 H new ATOM 0 HD3 ARG A 62 14.550 -28.481 -18.601 1.00 0.00 H new ATOM 0 HE ARG A 62 16.210 -26.055 -19.046 1.00 0.00 H new ATOM 0 HH11 ARG A 62 13.013 -27.199 -17.933 1.00 0.00 H new ATOM 0 HH12 ARG A 62 12.363 -25.573 -18.166 1.00 0.00 H new ATOM 0 HH21 ARG A 62 15.203 -24.178 -19.250 1.00 0.00 H new ATOM 0 HH22 ARG A 62 13.492 -24.018 -18.842 1.00 0.00 H new ATOM 1006 N ALA A 63 19.727 -28.882 -15.929 1.00 0.00 N ATOM 1007 CA ALA A 63 20.864 -28.008 -15.623 1.00 0.00 C ATOM 1008 C ALA A 63 22.132 -28.295 -16.458 1.00 0.00 C ATOM 1009 O ALA A 63 22.636 -27.381 -17.116 1.00 0.00 O ATOM 1010 CB ALA A 63 21.166 -28.092 -14.113 1.00 0.00 C ATOM 0 H ALA A 63 19.503 -29.541 -15.183 1.00 0.00 H new ATOM 0 HA ALA A 63 20.572 -26.995 -15.902 1.00 0.00 H new ATOM 0 HB1 ALA A 63 22.010 -27.445 -13.874 1.00 0.00 H new ATOM 0 HB2 ALA A 63 20.291 -27.770 -13.548 1.00 0.00 H new ATOM 0 HB3 ALA A 63 21.410 -29.121 -13.847 1.00 0.00 H new ATOM 1016 N GLU A 64 22.660 -29.531 -16.495 1.00 0.00 N ATOM 1017 CA GLU A 64 23.922 -29.836 -17.184 1.00 0.00 C ATOM 1018 C GLU A 64 23.762 -30.003 -18.716 1.00 0.00 C ATOM 1019 O GLU A 64 23.929 -31.077 -19.300 1.00 0.00 O ATOM 1020 CB GLU A 64 24.600 -31.078 -16.526 1.00 0.00 C ATOM 1021 CG GLU A 64 24.899 -30.955 -14.994 1.00 0.00 C ATOM 1022 CD GLU A 64 25.816 -29.786 -14.626 1.00 0.00 C ATOM 1023 OE1 GLU A 64 27.013 -29.865 -14.896 1.00 0.00 O ATOM 1024 OE2 GLU A 64 25.319 -28.820 -14.053 1.00 0.00 O ATOM 0 H GLU A 64 22.226 -30.340 -16.051 1.00 0.00 H new ATOM 0 HA GLU A 64 24.576 -28.973 -17.062 1.00 0.00 H new ATOM 0 HB2 GLU A 64 23.959 -31.945 -16.684 1.00 0.00 H new ATOM 0 HB3 GLU A 64 25.537 -31.275 -17.046 1.00 0.00 H new ATOM 0 HG2 GLU A 64 23.956 -30.845 -14.459 1.00 0.00 H new ATOM 0 HG3 GLU A 64 25.355 -31.883 -14.649 1.00 0.00 H new ATOM 1031 N GLN A 65 23.412 -28.896 -19.375 1.00 0.00 N ATOM 1032 CA GLN A 65 23.345 -28.820 -20.838 1.00 0.00 C ATOM 1033 C GLN A 65 24.550 -28.089 -21.471 1.00 0.00 C ATOM 1034 O GLN A 65 25.151 -28.652 -22.385 1.00 0.00 O ATOM 1035 CB GLN A 65 22.002 -28.160 -21.265 1.00 0.00 C ATOM 1036 CG GLN A 65 20.760 -29.054 -20.999 1.00 0.00 C ATOM 1037 CD GLN A 65 19.471 -28.349 -21.425 1.00 0.00 C ATOM 1038 OE1 GLN A 65 19.087 -28.355 -22.587 1.00 0.00 O ATOM 1039 NE2 GLN A 65 18.739 -27.717 -20.530 1.00 0.00 N ATOM 0 H GLN A 65 23.166 -28.023 -18.908 1.00 0.00 H new ATOM 0 HA GLN A 65 23.390 -29.841 -21.217 1.00 0.00 H new ATOM 0 HB2 GLN A 65 21.883 -27.218 -20.730 1.00 0.00 H new ATOM 0 HB3 GLN A 65 22.046 -27.920 -22.327 1.00 0.00 H new ATOM 0 HG2 GLN A 65 20.861 -29.993 -21.543 1.00 0.00 H new ATOM 0 HG3 GLN A 65 20.708 -29.304 -19.939 1.00 0.00 H new ATOM 0 HE21 GLN A 65 19.034 -27.695 -19.554 1.00 0.00 H new ATOM 0 HE22 GLN A 65 17.878 -27.250 -20.813 1.00 0.00 H new ATOM 1048 N SER A 66 24.877 -26.973 -21.059 1.00 0.00 N TER 1049 SER A 66