USER MOD reduce.3.24.130724 H: found=0, std=0, add=744, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 741 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 47 LYS NZ :NH3+ -177:sc= 0.0252 (180deg=0) USER MOD Set 1.2: A 52 SER OG : rot 180:sc= -0.274 USER MOD Set 1.3: A 56 GLN : amide:sc= 0.0171 K(o=-0.23,f=-0.84) USER MOD Set 2.1: A 49 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 51 THR OG1 : rot 180:sc= 0.00656 USER MOD Set 3.1: A 25 GLN : amide:sc= 0.949 K(o=2.1,f=-1.8) USER MOD Set 3.2: A 75 LYS NZ :NH3+ -177:sc= 1.11 (180deg=0) USER MOD Set 4.1: A 19 THR OG1 : rot 180:sc= 0 USER MOD Set 4.2: A 22 CYS SG : rot 180:sc= 0 USER MOD Set 5.1: A 18 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 5.2: A 26 SER OG : rot 180:sc= 0 USER MOD Set 6.1: A 5 GLN : amide:sc= 0.293 X(o=0.29,f=0.49) USER MOD Set 6.2: A 9 SER OG : rot -170:sc= 0 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 GLN : amide:sc= 0.176 K(o=0.18,f=-4.9!) USER MOD Single : A 8 GLN : amide:sc= 0.318 X(o=0.32,f=0) USER MOD Single : A 10 LYS NZ :NH3+ 172:sc= 0.106 (180deg=0.0387) USER MOD Single : A 16 ASN : amide:sc= 1.12 K(o=1.1,f=0) USER MOD Single : A 17 GLN : amide:sc= 0.956 K(o=0.96,f=-1.7) USER MOD Single : A 24 ASN : amide:sc= -0.0115 K(o=-0.012,f=-1) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 37 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 46 THR OG1 : rot -38:sc= 0.0589 USER MOD Single : A 53 LYS NZ :NH3+ 177:sc= 1.11 (180deg=1.1) USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 THR OG1 : rot 43:sc= 0.523 USER MOD Single : A 64 GLN : amide:sc= 0 K(o=0,f=-0.68) USER MOD Single : A 70 LYS NZ :NH3+ -167:sc= 1.2 (180deg=0.992) USER MOD Single : A 74 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 ASN : amide:sc= 1.01 K(o=1,f=0) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 GLN : amide:sc= 0.981 K(o=0.98,f=-3!) USER MOD Single : A 82 MET CE :methyl 150:sc= -0.0307 (180deg=-1.36!) USER MOD Single : A 85 GLN : amide:sc= 0 K(o=0,f=-0.58) USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 44.364 44.653 -42.184 1.00 0.00 N ATOM 2 CA GLY A 1 43.570 43.658 -41.417 1.00 0.00 C ATOM 3 C GLY A 1 42.242 44.244 -40.959 1.00 0.00 C ATOM 4 O GLY A 1 41.564 44.880 -41.767 1.00 0.00 O ATOM 0 H1 GLY A 1 45.263 44.224 -42.482 1.00 0.00 H new ATOM 0 H2 GLY A 1 43.828 44.952 -43.023 1.00 0.00 H new ATOM 0 H3 GLY A 1 44.557 45.480 -41.584 1.00 0.00 H new ATOM 0 HA2 GLY A 1 43.388 42.780 -42.036 1.00 0.00 H new ATOM 0 HA3 GLY A 1 44.141 43.324 -40.550 1.00 0.00 H new ATOM 7 N ILE A 2 41.865 44.068 -39.680 1.00 0.00 N ATOM 8 CA ILE A 2 40.574 44.530 -39.129 1.00 0.00 C ATOM 9 C ILE A 2 40.786 45.421 -37.895 1.00 0.00 C ATOM 10 O ILE A 2 40.444 46.609 -37.938 1.00 0.00 O ATOM 11 CB ILE A 2 39.649 43.313 -38.851 1.00 0.00 C ATOM 12 CG1 ILE A 2 39.233 42.645 -40.190 1.00 0.00 C ATOM 13 CG2 ILE A 2 38.396 43.720 -38.049 1.00 0.00 C ATOM 14 CD1 ILE A 2 38.444 41.333 -40.034 1.00 0.00 C ATOM 0 H ILE A 2 42.452 43.597 -38.992 1.00 0.00 H new ATOM 0 HA ILE A 2 40.070 45.155 -39.866 1.00 0.00 H new ATOM 0 HB ILE A 2 40.210 42.599 -38.248 1.00 0.00 H new ATOM 0 HG12 ILE A 2 38.629 43.351 -40.761 1.00 0.00 H new ATOM 0 HG13 ILE A 2 40.130 42.446 -40.776 1.00 0.00 H new ATOM 0 HG21 ILE A 2 37.774 42.842 -37.875 1.00 0.00 H new ATOM 0 HG22 ILE A 2 38.699 44.146 -37.092 1.00 0.00 H new ATOM 0 HG23 ILE A 2 37.828 44.460 -38.612 1.00 0.00 H new ATOM 0 HD11 ILE A 2 38.196 40.938 -41.019 1.00 0.00 H new ATOM 0 HD12 ILE A 2 39.050 40.606 -39.494 1.00 0.00 H new ATOM 0 HD13 ILE A 2 37.526 41.524 -39.478 1.00 0.00 H new ATOM 26 N ALA A 3 41.420 44.868 -36.842 1.00 0.00 N ATOM 27 CA ALA A 3 41.705 45.641 -35.623 1.00 0.00 C ATOM 28 C ALA A 3 42.734 46.757 -35.902 1.00 0.00 C ATOM 29 O ALA A 3 42.524 47.930 -35.575 1.00 0.00 O ATOM 30 CB ALA A 3 42.219 44.665 -34.554 1.00 0.00 C ATOM 0 H ALA A 3 41.740 43.900 -36.813 1.00 0.00 H new ATOM 0 HA ALA A 3 40.798 46.133 -35.271 1.00 0.00 H new ATOM 0 HB1 ALA A 3 42.439 45.212 -33.637 1.00 0.00 H new ATOM 0 HB2 ALA A 3 41.458 43.911 -34.353 1.00 0.00 H new ATOM 0 HB3 ALA A 3 43.126 44.178 -34.912 1.00 0.00 H new ATOM 36 N GLN A 4 43.818 46.382 -36.601 1.00 0.00 N ATOM 37 CA GLN A 4 44.869 47.306 -37.045 1.00 0.00 C ATOM 38 C GLN A 4 44.345 48.368 -38.022 1.00 0.00 C ATOM 39 O GLN A 4 44.809 49.509 -38.000 1.00 0.00 O ATOM 40 CB GLN A 4 46.007 46.512 -37.719 1.00 0.00 C ATOM 41 CG GLN A 4 46.717 45.475 -36.829 1.00 0.00 C ATOM 42 CD GLN A 4 47.633 46.091 -35.772 1.00 0.00 C ATOM 43 OE1 GLN A 4 47.316 47.067 -35.108 1.00 0.00 O ATOM 44 NE2 GLN A 4 48.809 45.535 -35.565 1.00 0.00 N ATOM 0 H GLN A 4 43.989 45.415 -36.876 1.00 0.00 H new ATOM 0 HA GLN A 4 45.236 47.825 -36.160 1.00 0.00 H new ATOM 0 HB2 GLN A 4 45.600 45.998 -38.590 1.00 0.00 H new ATOM 0 HB3 GLN A 4 46.751 47.219 -38.085 1.00 0.00 H new ATOM 0 HG2 GLN A 4 45.965 44.862 -36.332 1.00 0.00 H new ATOM 0 HG3 GLN A 4 47.304 44.809 -37.461 1.00 0.00 H new ATOM 0 HE21 GLN A 4 49.091 44.720 -36.110 1.00 0.00 H new ATOM 0 HE22 GLN A 4 49.438 45.920 -34.860 1.00 0.00 H new ATOM 53 N GLN A 5 43.378 48.013 -38.881 1.00 0.00 N ATOM 54 CA GLN A 5 42.804 48.932 -39.869 1.00 0.00 C ATOM 55 C GLN A 5 41.815 49.917 -39.231 1.00 0.00 C ATOM 56 O GLN A 5 41.817 51.094 -39.585 1.00 0.00 O ATOM 57 CB GLN A 5 42.160 48.125 -41.009 1.00 0.00 C ATOM 58 CG GLN A 5 41.813 48.976 -42.250 1.00 0.00 C ATOM 59 CD GLN A 5 40.346 49.406 -42.303 1.00 0.00 C ATOM 60 OE1 GLN A 5 39.483 48.711 -42.821 1.00 0.00 O ATOM 61 NE2 GLN A 5 39.998 50.577 -41.796 1.00 0.00 N ATOM 0 H GLN A 5 42.973 47.077 -38.908 1.00 0.00 H new ATOM 0 HA GLN A 5 43.607 49.541 -40.285 1.00 0.00 H new ATOM 0 HB2 GLN A 5 42.839 47.326 -41.305 1.00 0.00 H new ATOM 0 HB3 GLN A 5 41.251 47.650 -40.639 1.00 0.00 H new ATOM 0 HG2 GLN A 5 42.445 49.864 -42.260 1.00 0.00 H new ATOM 0 HG3 GLN A 5 42.049 48.407 -43.149 1.00 0.00 H new ATOM 0 HE21 GLN A 5 40.701 51.173 -41.359 1.00 0.00 H new ATOM 0 HE22 GLN A 5 39.026 50.884 -41.842 1.00 0.00 H new ATOM 70 N TRP A 6 41.011 49.465 -38.260 1.00 0.00 N ATOM 71 CA TRP A 6 40.138 50.338 -37.466 1.00 0.00 C ATOM 72 C TRP A 6 40.960 51.355 -36.660 1.00 0.00 C ATOM 73 O TRP A 6 40.682 52.556 -36.715 1.00 0.00 O ATOM 74 CB TRP A 6 39.244 49.466 -36.574 1.00 0.00 C ATOM 75 CG TRP A 6 38.014 50.110 -36.020 1.00 0.00 C ATOM 76 CD1 TRP A 6 36.848 50.275 -36.706 1.00 0.00 C ATOM 77 CD2 TRP A 6 37.729 50.533 -34.653 1.00 0.00 C ATOM 78 NE1 TRP A 6 35.881 50.766 -35.853 1.00 0.00 N ATOM 79 CE2 TRP A 6 36.358 50.927 -34.577 1.00 0.00 C ATOM 80 CE3 TRP A 6 38.469 50.559 -33.450 1.00 0.00 C ATOM 81 CZ2 TRP A 6 35.744 51.281 -33.365 1.00 0.00 C ATOM 82 CZ3 TRP A 6 37.865 50.921 -32.232 1.00 0.00 C ATOM 83 CH2 TRP A 6 36.497 51.245 -32.185 1.00 0.00 C ATOM 0 H TRP A 6 40.948 48.480 -38.002 1.00 0.00 H new ATOM 0 HA TRP A 6 39.498 50.923 -38.126 1.00 0.00 H new ATOM 0 HB2 TRP A 6 38.940 48.591 -37.149 1.00 0.00 H new ATOM 0 HB3 TRP A 6 39.845 49.106 -35.739 1.00 0.00 H new ATOM 0 HD1 TRP A 6 36.703 50.056 -37.754 1.00 0.00 H new ATOM 0 HE1 TRP A 6 34.926 50.983 -36.137 1.00 0.00 H new ATOM 0 HE3 TRP A 6 39.516 50.296 -33.466 1.00 0.00 H new ATOM 0 HZ2 TRP A 6 34.706 51.577 -33.343 1.00 0.00 H new ATOM 0 HZ3 TRP A 6 38.455 50.950 -31.328 1.00 0.00 H new ATOM 0 HH2 TRP A 6 36.027 51.466 -31.238 1.00 0.00 H new ATOM 94 N ILE A 7 42.057 50.912 -36.032 1.00 0.00 N ATOM 95 CA ILE A 7 43.082 51.793 -35.441 1.00 0.00 C ATOM 96 C ILE A 7 43.643 52.785 -36.483 1.00 0.00 C ATOM 97 O ILE A 7 43.724 53.974 -36.201 1.00 0.00 O ATOM 98 CB ILE A 7 44.175 50.944 -34.718 1.00 0.00 C ATOM 99 CG1 ILE A 7 43.900 50.839 -33.193 1.00 0.00 C ATOM 100 CG2 ILE A 7 45.615 51.482 -34.876 1.00 0.00 C ATOM 101 CD1 ILE A 7 42.604 50.097 -32.819 1.00 0.00 C ATOM 0 H ILE A 7 42.263 49.920 -35.917 1.00 0.00 H new ATOM 0 HA ILE A 7 42.621 52.417 -34.675 1.00 0.00 H new ATOM 0 HB ILE A 7 44.110 49.973 -35.209 1.00 0.00 H new ATOM 0 HG12 ILE A 7 44.741 50.332 -32.721 1.00 0.00 H new ATOM 0 HG13 ILE A 7 43.859 51.845 -32.776 1.00 0.00 H new ATOM 0 HG21 ILE A 7 46.307 50.831 -34.342 1.00 0.00 H new ATOM 0 HG22 ILE A 7 45.881 51.505 -35.933 1.00 0.00 H new ATOM 0 HG23 ILE A 7 45.674 52.490 -34.465 1.00 0.00 H new ATOM 0 HD11 ILE A 7 42.498 50.074 -31.734 1.00 0.00 H new ATOM 0 HD12 ILE A 7 41.750 50.614 -33.257 1.00 0.00 H new ATOM 0 HD13 ILE A 7 42.646 49.077 -33.201 1.00 0.00 H new ATOM 113 N GLN A 8 43.989 52.335 -37.694 1.00 0.00 N ATOM 114 CA GLN A 8 44.526 53.197 -38.771 1.00 0.00 C ATOM 115 C GLN A 8 43.484 54.095 -39.492 1.00 0.00 C ATOM 116 O GLN A 8 43.865 54.845 -40.406 1.00 0.00 O ATOM 117 CB GLN A 8 45.344 52.332 -39.749 1.00 0.00 C ATOM 118 CG GLN A 8 46.706 51.965 -39.136 1.00 0.00 C ATOM 119 CD GLN A 8 47.444 50.916 -39.957 1.00 0.00 C ATOM 120 OE1 GLN A 8 48.145 51.205 -40.918 1.00 0.00 O ATOM 121 NE2 GLN A 8 47.328 49.654 -39.586 1.00 0.00 N ATOM 0 H GLN A 8 43.906 51.355 -37.964 1.00 0.00 H new ATOM 0 HA GLN A 8 45.176 53.928 -38.291 1.00 0.00 H new ATOM 0 HB2 GLN A 8 44.791 51.424 -39.990 1.00 0.00 H new ATOM 0 HB3 GLN A 8 45.493 52.872 -40.684 1.00 0.00 H new ATOM 0 HG2 GLN A 8 47.321 52.862 -39.059 1.00 0.00 H new ATOM 0 HG3 GLN A 8 46.557 51.592 -38.123 1.00 0.00 H new ATOM 0 HE21 GLN A 8 46.745 49.409 -38.786 1.00 0.00 H new ATOM 0 HE22 GLN A 8 47.822 48.924 -40.100 1.00 0.00 H new ATOM 130 N SER A 9 42.211 54.082 -39.054 1.00 0.00 N ATOM 131 CA SER A 9 41.145 54.970 -39.581 1.00 0.00 C ATOM 132 C SER A 9 40.476 55.831 -38.501 1.00 0.00 C ATOM 133 O SER A 9 40.022 56.949 -38.797 1.00 0.00 O ATOM 134 CB SER A 9 40.061 54.158 -40.297 1.00 0.00 C ATOM 135 OG SER A 9 40.567 53.618 -41.508 1.00 0.00 O ATOM 0 H SER A 9 41.886 53.453 -38.320 1.00 0.00 H new ATOM 0 HA SER A 9 41.647 55.640 -40.279 1.00 0.00 H new ATOM 0 HB2 SER A 9 39.713 53.353 -39.650 1.00 0.00 H new ATOM 0 HB3 SER A 9 39.200 54.793 -40.506 1.00 0.00 H new ATOM 0 HG SER A 9 39.830 53.238 -42.030 1.00 0.00 H new ATOM 141 N LYS A 10 40.477 55.373 -37.239 1.00 0.00 N ATOM 142 CA LYS A 10 39.911 56.078 -36.070 1.00 0.00 C ATOM 143 C LYS A 10 40.985 56.420 -35.032 1.00 0.00 C ATOM 144 O LYS A 10 40.657 56.675 -33.885 1.00 0.00 O ATOM 145 CB LYS A 10 38.760 55.255 -35.459 1.00 0.00 C ATOM 146 CG LYS A 10 37.543 55.218 -36.392 1.00 0.00 C ATOM 147 CD LYS A 10 36.426 54.385 -35.747 1.00 0.00 C ATOM 148 CE LYS A 10 35.215 54.185 -36.674 1.00 0.00 C ATOM 149 NZ LYS A 10 35.566 53.421 -37.907 1.00 0.00 N ATOM 0 H LYS A 10 40.885 54.471 -36.992 1.00 0.00 H new ATOM 0 HA LYS A 10 39.504 57.030 -36.412 1.00 0.00 H new ATOM 0 HB2 LYS A 10 39.101 54.239 -35.263 1.00 0.00 H new ATOM 0 HB3 LYS A 10 38.472 55.685 -34.500 1.00 0.00 H new ATOM 0 HG2 LYS A 10 37.190 56.231 -36.586 1.00 0.00 H new ATOM 0 HG3 LYS A 10 37.822 54.788 -37.354 1.00 0.00 H new ATOM 0 HD2 LYS A 10 36.824 53.411 -35.463 1.00 0.00 H new ATOM 0 HD3 LYS A 10 36.098 54.875 -34.830 1.00 0.00 H new ATOM 0 HE2 LYS A 10 34.430 53.657 -36.133 1.00 0.00 H new ATOM 0 HE3 LYS A 10 34.810 55.157 -36.955 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 34.698 53.194 -38.433 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 36.193 53.996 -38.505 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 36.051 52.540 -37.643 1.00 0.00 H new ATOM 163 N ARG A 11 42.266 56.442 -35.419 1.00 0.00 N ATOM 164 CA ARG A 11 43.418 56.753 -34.547 1.00 0.00 C ATOM 165 C ARG A 11 43.174 57.995 -33.676 1.00 0.00 C ATOM 166 O ARG A 11 43.224 57.913 -32.460 1.00 0.00 O ATOM 167 CB ARG A 11 44.694 56.853 -35.416 1.00 0.00 C ATOM 168 CG ARG A 11 45.848 55.957 -34.925 1.00 0.00 C ATOM 169 CD ARG A 11 46.780 55.566 -36.086 1.00 0.00 C ATOM 170 NE ARG A 11 48.209 55.706 -35.737 1.00 0.00 N ATOM 171 CZ ARG A 11 49.092 54.754 -35.480 1.00 0.00 C ATOM 172 NH1 ARG A 11 48.770 53.489 -35.409 1.00 0.00 N ATOM 173 NH2 ARG A 11 50.344 55.066 -35.291 1.00 0.00 N ATOM 0 H ARG A 11 42.544 56.238 -36.379 1.00 0.00 H new ATOM 0 HA ARG A 11 43.557 55.942 -33.832 1.00 0.00 H new ATOM 0 HB2 ARG A 11 44.446 56.582 -36.442 1.00 0.00 H new ATOM 0 HB3 ARG A 11 45.032 57.889 -35.433 1.00 0.00 H new ATOM 0 HG2 ARG A 11 46.418 56.481 -34.158 1.00 0.00 H new ATOM 0 HG3 ARG A 11 45.442 55.058 -34.462 1.00 0.00 H new ATOM 0 HD2 ARG A 11 46.580 54.535 -36.377 1.00 0.00 H new ATOM 0 HD3 ARG A 11 46.558 56.190 -36.952 1.00 0.00 H new ATOM 0 HE ARG A 11 48.561 56.662 -35.688 1.00 0.00 H new ATOM 0 HH11 ARG A 11 47.803 53.200 -35.554 1.00 0.00 H new ATOM 0 HH12 ARG A 11 49.486 52.791 -35.208 1.00 0.00 H new ATOM 0 HH21 ARG A 11 50.640 56.041 -35.341 1.00 0.00 H new ATOM 0 HH22 ARG A 11 51.027 54.335 -35.093 1.00 0.00 H new ATOM 187 N GLU A 12 42.814 59.128 -34.300 1.00 0.00 N ATOM 188 CA GLU A 12 42.523 60.375 -33.575 1.00 0.00 C ATOM 189 C GLU A 12 41.225 60.299 -32.742 1.00 0.00 C ATOM 190 O GLU A 12 41.165 60.833 -31.636 1.00 0.00 O ATOM 191 CB GLU A 12 42.456 61.541 -34.582 1.00 0.00 C ATOM 192 CG GLU A 12 42.748 62.907 -33.947 1.00 0.00 C ATOM 193 CD GLU A 12 44.263 63.139 -33.769 1.00 0.00 C ATOM 194 OE1 GLU A 12 44.844 62.661 -32.760 1.00 0.00 O ATOM 195 OE2 GLU A 12 44.880 63.811 -34.631 1.00 0.00 O ATOM 0 H GLU A 12 42.717 59.206 -35.312 1.00 0.00 H new ATOM 0 HA GLU A 12 43.330 60.540 -32.862 1.00 0.00 H new ATOM 0 HB2 GLU A 12 43.171 61.361 -35.385 1.00 0.00 H new ATOM 0 HB3 GLU A 12 41.466 61.563 -35.037 1.00 0.00 H new ATOM 0 HG2 GLU A 12 42.330 63.696 -34.572 1.00 0.00 H new ATOM 0 HG3 GLU A 12 42.253 62.972 -32.978 1.00 0.00 H new ATOM 202 N ASP A 13 40.189 59.609 -33.246 1.00 0.00 N ATOM 203 CA ASP A 13 38.934 59.353 -32.529 1.00 0.00 C ATOM 204 C ASP A 13 39.183 58.562 -31.232 1.00 0.00 C ATOM 205 O ASP A 13 38.874 59.043 -30.145 1.00 0.00 O ATOM 206 CB ASP A 13 37.950 58.611 -33.456 1.00 0.00 C ATOM 207 CG ASP A 13 36.933 59.561 -34.106 1.00 0.00 C ATOM 208 OD1 ASP A 13 37.285 60.239 -35.102 1.00 0.00 O ATOM 209 OD2 ASP A 13 35.775 59.619 -33.630 1.00 0.00 O ATOM 0 H ASP A 13 40.203 59.206 -34.183 1.00 0.00 H new ATOM 0 HA ASP A 13 38.493 60.308 -32.242 1.00 0.00 H new ATOM 0 HB2 ASP A 13 38.509 58.092 -34.235 1.00 0.00 H new ATOM 0 HB3 ASP A 13 37.419 57.850 -32.884 1.00 0.00 H new ATOM 214 N ILE A 14 39.836 57.396 -31.335 1.00 0.00 N ATOM 215 CA ILE A 14 40.234 56.523 -30.224 1.00 0.00 C ATOM 216 C ILE A 14 41.107 57.290 -29.215 1.00 0.00 C ATOM 217 O ILE A 14 40.869 57.193 -28.015 1.00 0.00 O ATOM 218 CB ILE A 14 40.955 55.264 -30.776 1.00 0.00 C ATOM 219 CG1 ILE A 14 40.004 54.398 -31.639 1.00 0.00 C ATOM 220 CG2 ILE A 14 41.529 54.394 -29.640 1.00 0.00 C ATOM 221 CD1 ILE A 14 40.746 53.426 -32.567 1.00 0.00 C ATOM 0 H ILE A 14 40.114 57.018 -32.241 1.00 0.00 H new ATOM 0 HA ILE A 14 39.343 56.193 -29.689 1.00 0.00 H new ATOM 0 HB ILE A 14 41.774 55.626 -31.397 1.00 0.00 H new ATOM 0 HG12 ILE A 14 39.344 53.831 -30.983 1.00 0.00 H new ATOM 0 HG13 ILE A 14 39.372 55.052 -32.239 1.00 0.00 H new ATOM 0 HG21 ILE A 14 42.026 53.522 -30.065 1.00 0.00 H new ATOM 0 HG22 ILE A 14 42.248 54.976 -29.063 1.00 0.00 H new ATOM 0 HG23 ILE A 14 40.719 54.068 -28.987 1.00 0.00 H new ATOM 0 HD11 ILE A 14 40.023 52.849 -33.143 1.00 0.00 H new ATOM 0 HD12 ILE A 14 41.386 53.989 -33.247 1.00 0.00 H new ATOM 0 HD13 ILE A 14 41.357 52.749 -31.971 1.00 0.00 H new ATOM 233 N VAL A 15 42.072 58.097 -29.676 1.00 0.00 N ATOM 234 CA VAL A 15 42.928 58.935 -28.809 1.00 0.00 C ATOM 235 C VAL A 15 42.138 60.004 -28.031 1.00 0.00 C ATOM 236 O VAL A 15 42.497 60.321 -26.899 1.00 0.00 O ATOM 237 CB VAL A 15 44.064 59.568 -29.643 1.00 0.00 C ATOM 238 CG1 VAL A 15 44.881 60.627 -28.891 1.00 0.00 C ATOM 239 CG2 VAL A 15 45.073 58.500 -30.094 1.00 0.00 C ATOM 0 H VAL A 15 42.286 58.191 -30.669 1.00 0.00 H new ATOM 0 HA VAL A 15 43.362 58.281 -28.053 1.00 0.00 H new ATOM 0 HB VAL A 15 43.548 60.039 -30.480 1.00 0.00 H new ATOM 0 HG11 VAL A 15 45.657 61.021 -29.547 1.00 0.00 H new ATOM 0 HG12 VAL A 15 44.224 61.438 -28.578 1.00 0.00 H new ATOM 0 HG13 VAL A 15 45.343 60.175 -28.013 1.00 0.00 H new ATOM 0 HG21 VAL A 15 45.863 58.970 -30.679 1.00 0.00 H new ATOM 0 HG22 VAL A 15 45.508 58.018 -29.219 1.00 0.00 H new ATOM 0 HG23 VAL A 15 44.564 57.754 -30.704 1.00 0.00 H new ATOM 249 N ASN A 16 41.046 60.545 -28.597 1.00 0.00 N ATOM 250 CA ASN A 16 40.143 61.459 -27.879 1.00 0.00 C ATOM 251 C ASN A 16 39.151 60.725 -26.957 1.00 0.00 C ATOM 252 O ASN A 16 38.813 61.230 -25.882 1.00 0.00 O ATOM 253 CB ASN A 16 39.385 62.325 -28.906 1.00 0.00 C ATOM 254 CG ASN A 16 40.200 63.517 -29.363 1.00 0.00 C ATOM 255 OD1 ASN A 16 40.163 64.592 -28.778 1.00 0.00 O ATOM 256 ND2 ASN A 16 40.977 63.383 -30.420 1.00 0.00 N ATOM 0 H ASN A 16 40.766 60.362 -29.560 1.00 0.00 H new ATOM 0 HA ASN A 16 40.754 62.086 -27.230 1.00 0.00 H new ATOM 0 HB2 ASN A 16 39.122 61.714 -29.770 1.00 0.00 H new ATOM 0 HB3 ASN A 16 38.451 62.673 -28.466 1.00 0.00 H new ATOM 0 HD21 ASN A 16 41.539 64.170 -30.743 1.00 0.00 H new ATOM 0 HD22 ASN A 16 41.016 62.492 -30.915 1.00 0.00 H new ATOM 263 N GLN A 17 38.677 59.545 -27.369 1.00 0.00 N ATOM 264 CA GLN A 17 37.632 58.776 -26.685 1.00 0.00 C ATOM 265 C GLN A 17 38.166 57.903 -25.538 1.00 0.00 C ATOM 266 O GLN A 17 37.475 57.741 -24.530 1.00 0.00 O ATOM 267 CB GLN A 17 36.877 57.953 -27.748 1.00 0.00 C ATOM 268 CG GLN A 17 35.902 58.856 -28.543 1.00 0.00 C ATOM 269 CD GLN A 17 35.820 58.576 -30.050 1.00 0.00 C ATOM 270 OE1 GLN A 17 36.142 57.513 -30.558 1.00 0.00 O ATOM 271 NE2 GLN A 17 35.394 59.552 -30.828 1.00 0.00 N ATOM 0 H GLN A 17 39.020 59.085 -28.212 1.00 0.00 H new ATOM 0 HA GLN A 17 36.948 59.468 -26.194 1.00 0.00 H new ATOM 0 HB2 GLN A 17 37.589 57.488 -28.430 1.00 0.00 H new ATOM 0 HB3 GLN A 17 36.324 57.146 -27.267 1.00 0.00 H new ATOM 0 HG2 GLN A 17 34.905 58.748 -28.116 1.00 0.00 H new ATOM 0 HG3 GLN A 17 36.199 59.895 -28.400 1.00 0.00 H new ATOM 0 HE21 GLN A 17 35.121 60.446 -30.421 1.00 0.00 H new ATOM 0 HE22 GLN A 17 35.338 59.412 -31.837 1.00 0.00 H new ATOM 280 N MET A 18 39.392 57.380 -25.635 1.00 0.00 N ATOM 281 CA MET A 18 40.103 56.720 -24.531 1.00 0.00 C ATOM 282 C MET A 18 40.921 57.751 -23.730 1.00 0.00 C ATOM 283 O MET A 18 41.823 58.400 -24.264 1.00 0.00 O ATOM 284 CB MET A 18 41.052 55.626 -25.051 1.00 0.00 C ATOM 285 CG MET A 18 40.276 54.471 -25.678 1.00 0.00 C ATOM 286 SD MET A 18 41.295 53.066 -26.181 1.00 0.00 S ATOM 287 CE MET A 18 41.376 52.117 -24.639 1.00 0.00 C ATOM 0 H MET A 18 39.931 57.403 -26.501 1.00 0.00 H new ATOM 0 HA MET A 18 39.353 56.260 -23.888 1.00 0.00 H new ATOM 0 HB2 MET A 18 41.733 56.052 -25.788 1.00 0.00 H new ATOM 0 HB3 MET A 18 41.664 55.252 -24.230 1.00 0.00 H new ATOM 0 HG2 MET A 18 39.528 54.124 -24.965 1.00 0.00 H new ATOM 0 HG3 MET A 18 39.737 54.843 -26.550 1.00 0.00 H new ATOM 0 HE1 MET A 18 41.974 51.219 -24.795 1.00 0.00 H new ATOM 0 HE2 MET A 18 41.834 52.727 -23.860 1.00 0.00 H new ATOM 0 HE3 MET A 18 40.369 51.834 -24.333 1.00 0.00 H new ATOM 297 N THR A 19 40.606 57.888 -22.440 1.00 0.00 N ATOM 298 CA THR A 19 41.415 58.667 -21.485 1.00 0.00 C ATOM 299 C THR A 19 42.671 57.897 -21.049 1.00 0.00 C ATOM 300 O THR A 19 42.872 56.735 -21.422 1.00 0.00 O ATOM 301 CB THR A 19 40.577 59.026 -20.247 1.00 0.00 C ATOM 302 OG1 THR A 19 40.189 57.846 -19.573 1.00 0.00 O ATOM 303 CG2 THR A 19 39.317 59.816 -20.609 1.00 0.00 C ATOM 0 H THR A 19 39.779 57.462 -22.021 1.00 0.00 H new ATOM 0 HA THR A 19 41.732 59.579 -21.991 1.00 0.00 H new ATOM 0 HB THR A 19 41.202 59.650 -19.608 1.00 0.00 H new ATOM 0 HG1 THR A 19 39.657 58.080 -18.784 1.00 0.00 H new ATOM 0 HG21 THR A 19 38.759 60.046 -19.702 1.00 0.00 H new ATOM 0 HG22 THR A 19 39.600 60.744 -21.106 1.00 0.00 H new ATOM 0 HG23 THR A 19 38.694 59.221 -21.277 1.00 0.00 H new ATOM 311 N GLU A 20 43.511 58.520 -20.211 1.00 0.00 N ATOM 312 CA GLU A 20 44.628 57.831 -19.541 1.00 0.00 C ATOM 313 C GLU A 20 44.152 56.585 -18.783 1.00 0.00 C ATOM 314 O GLU A 20 44.788 55.544 -18.889 1.00 0.00 O ATOM 315 CB GLU A 20 45.358 58.803 -18.598 1.00 0.00 C ATOM 316 CG GLU A 20 46.800 58.400 -18.266 1.00 0.00 C ATOM 317 CD GLU A 20 46.958 57.248 -17.231 1.00 0.00 C ATOM 318 OE1 GLU A 20 46.243 57.248 -16.212 1.00 0.00 O ATOM 319 OE2 GLU A 20 47.823 56.377 -17.472 1.00 0.00 O ATOM 0 H GLU A 20 43.438 59.510 -19.978 1.00 0.00 H new ATOM 0 HA GLU A 20 45.326 57.494 -20.307 1.00 0.00 H new ATOM 0 HB2 GLU A 20 45.366 59.794 -19.052 1.00 0.00 H new ATOM 0 HB3 GLU A 20 44.793 58.883 -17.669 1.00 0.00 H new ATOM 0 HG2 GLU A 20 47.297 58.104 -19.190 1.00 0.00 H new ATOM 0 HG3 GLU A 20 47.325 59.277 -17.888 1.00 0.00 H new ATOM 326 N ALA A 21 42.997 56.648 -18.107 1.00 0.00 N ATOM 327 CA ALA A 21 42.423 55.516 -17.380 1.00 0.00 C ATOM 328 C ALA A 21 42.026 54.352 -18.308 1.00 0.00 C ATOM 329 O ALA A 21 42.296 53.193 -17.992 1.00 0.00 O ATOM 330 CB ALA A 21 41.217 56.011 -16.569 1.00 0.00 C ATOM 0 H ALA A 21 42.432 57.496 -18.051 1.00 0.00 H new ATOM 0 HA ALA A 21 43.185 55.117 -16.711 1.00 0.00 H new ATOM 0 HB1 ALA A 21 40.779 55.176 -16.022 1.00 0.00 H new ATOM 0 HB2 ALA A 21 41.542 56.776 -15.864 1.00 0.00 H new ATOM 0 HB3 ALA A 21 40.472 56.432 -17.244 1.00 0.00 H new ATOM 336 N CYS A 22 41.446 54.642 -19.480 1.00 0.00 N ATOM 337 CA CYS A 22 41.119 53.623 -20.482 1.00 0.00 C ATOM 338 C CYS A 22 42.383 52.935 -21.032 1.00 0.00 C ATOM 339 O CYS A 22 42.413 51.713 -21.184 1.00 0.00 O ATOM 340 CB CYS A 22 40.312 54.257 -21.625 1.00 0.00 C ATOM 341 SG CYS A 22 38.715 54.875 -21.007 1.00 0.00 S ATOM 0 H CYS A 22 41.191 55.589 -19.759 1.00 0.00 H new ATOM 0 HA CYS A 22 40.517 52.855 -19.997 1.00 0.00 H new ATOM 0 HB2 CYS A 22 40.879 55.075 -22.069 1.00 0.00 H new ATOM 0 HB3 CYS A 22 40.145 53.522 -22.412 1.00 0.00 H new ATOM 0 HG CYS A 22 38.048 55.409 -21.987 1.00 0.00 H new ATOM 347 N LEU A 23 43.446 53.704 -21.316 1.00 0.00 N ATOM 348 CA LEU A 23 44.723 53.141 -21.775 1.00 0.00 C ATOM 349 C LEU A 23 45.446 52.360 -20.667 1.00 0.00 C ATOM 350 O LEU A 23 45.998 51.291 -20.919 1.00 0.00 O ATOM 351 CB LEU A 23 45.622 54.270 -22.304 1.00 0.00 C ATOM 352 CG LEU A 23 46.741 53.711 -23.200 1.00 0.00 C ATOM 353 CD1 LEU A 23 46.191 53.340 -24.580 1.00 0.00 C ATOM 354 CD2 LEU A 23 47.860 54.736 -23.334 1.00 0.00 C ATOM 0 H LEU A 23 43.445 54.721 -21.235 1.00 0.00 H new ATOM 0 HA LEU A 23 44.507 52.434 -22.575 1.00 0.00 H new ATOM 0 HB2 LEU A 23 45.022 54.983 -22.869 1.00 0.00 H new ATOM 0 HB3 LEU A 23 46.059 54.814 -21.467 1.00 0.00 H new ATOM 0 HG LEU A 23 47.141 52.809 -22.738 1.00 0.00 H new ATOM 0 HD11 LEU A 23 46.997 52.947 -25.199 1.00 0.00 H new ATOM 0 HD12 LEU A 23 45.415 52.583 -24.471 1.00 0.00 H new ATOM 0 HD13 LEU A 23 45.769 54.226 -25.054 1.00 0.00 H new ATOM 0 HD21 LEU A 23 48.648 54.333 -23.970 1.00 0.00 H new ATOM 0 HD22 LEU A 23 47.466 55.649 -23.780 1.00 0.00 H new ATOM 0 HD23 LEU A 23 48.268 54.960 -22.348 1.00 0.00 H new ATOM 366 N ASN A 24 45.421 52.873 -19.434 1.00 0.00 N ATOM 367 CA ASN A 24 45.946 52.215 -18.240 1.00 0.00 C ATOM 368 C ASN A 24 45.257 50.859 -18.020 1.00 0.00 C ATOM 369 O ASN A 24 45.940 49.868 -17.788 1.00 0.00 O ATOM 370 CB ASN A 24 45.788 53.182 -17.052 1.00 0.00 C ATOM 371 CG ASN A 24 46.497 52.741 -15.785 1.00 0.00 C ATOM 372 OD1 ASN A 24 46.294 51.660 -15.255 1.00 0.00 O ATOM 373 ND2 ASN A 24 47.340 53.590 -15.234 1.00 0.00 N ATOM 0 H ASN A 24 45.020 53.790 -19.235 1.00 0.00 H new ATOM 0 HA ASN A 24 47.006 51.987 -18.353 1.00 0.00 H new ATOM 0 HB2 ASN A 24 46.167 54.161 -17.344 1.00 0.00 H new ATOM 0 HB3 ASN A 24 44.726 53.303 -16.836 1.00 0.00 H new ATOM 0 HD21 ASN A 24 47.820 53.343 -14.368 1.00 0.00 H new ATOM 0 HD22 ASN A 24 47.513 54.494 -15.673 1.00 0.00 H new ATOM 380 N GLN A 25 43.928 50.779 -18.199 1.00 0.00 N ATOM 381 CA GLN A 25 43.204 49.506 -18.210 1.00 0.00 C ATOM 382 C GLN A 25 43.718 48.528 -19.286 1.00 0.00 C ATOM 383 O GLN A 25 43.941 47.363 -18.963 1.00 0.00 O ATOM 384 CB GLN A 25 41.694 49.723 -18.385 1.00 0.00 C ATOM 385 CG GLN A 25 40.964 50.073 -17.074 1.00 0.00 C ATOM 386 CD GLN A 25 39.726 49.200 -16.853 1.00 0.00 C ATOM 387 OE1 GLN A 25 39.757 47.978 -16.945 1.00 0.00 O ATOM 388 NE2 GLN A 25 38.570 49.778 -16.576 1.00 0.00 N ATOM 0 H GLN A 25 43.331 51.594 -18.339 1.00 0.00 H new ATOM 0 HA GLN A 25 43.392 49.051 -17.238 1.00 0.00 H new ATOM 0 HB2 GLN A 25 41.532 50.524 -19.106 1.00 0.00 H new ATOM 0 HB3 GLN A 25 41.252 48.820 -18.807 1.00 0.00 H new ATOM 0 HG2 GLN A 25 41.648 49.950 -16.235 1.00 0.00 H new ATOM 0 HG3 GLN A 25 40.669 51.122 -17.093 1.00 0.00 H new ATOM 0 HE21 GLN A 25 38.514 50.793 -16.493 1.00 0.00 H new ATOM 0 HE22 GLN A 25 37.734 49.209 -16.445 1.00 0.00 H new ATOM 397 N SER A 26 43.943 48.972 -20.535 1.00 0.00 N ATOM 398 CA SER A 26 44.537 48.115 -21.581 1.00 0.00 C ATOM 399 C SER A 26 45.937 47.624 -21.180 1.00 0.00 C ATOM 400 O SER A 26 46.189 46.419 -21.161 1.00 0.00 O ATOM 401 CB SER A 26 44.614 48.839 -22.929 1.00 0.00 C ATOM 402 OG SER A 26 43.315 49.104 -23.414 1.00 0.00 O ATOM 0 H SER A 26 43.723 49.918 -20.846 1.00 0.00 H new ATOM 0 HA SER A 26 43.879 47.252 -21.686 1.00 0.00 H new ATOM 0 HB2 SER A 26 45.166 49.772 -22.818 1.00 0.00 H new ATOM 0 HB3 SER A 26 45.161 48.228 -23.647 1.00 0.00 H new ATOM 0 HG SER A 26 43.376 49.568 -24.275 1.00 0.00 H new ATOM 408 N LEU A 27 46.840 48.543 -20.806 1.00 0.00 N ATOM 409 CA LEU A 27 48.218 48.238 -20.396 1.00 0.00 C ATOM 410 C LEU A 27 48.266 47.281 -19.190 1.00 0.00 C ATOM 411 O LEU A 27 48.987 46.289 -19.219 1.00 0.00 O ATOM 412 CB LEU A 27 48.941 49.561 -20.074 1.00 0.00 C ATOM 413 CG LEU A 27 49.296 50.410 -21.306 1.00 0.00 C ATOM 414 CD1 LEU A 27 49.595 51.850 -20.885 1.00 0.00 C ATOM 415 CD2 LEU A 27 50.535 49.858 -22.021 1.00 0.00 C ATOM 0 H LEU A 27 46.627 49.540 -20.780 1.00 0.00 H new ATOM 0 HA LEU A 27 48.721 47.727 -21.216 1.00 0.00 H new ATOM 0 HB2 LEU A 27 48.311 50.153 -19.410 1.00 0.00 H new ATOM 0 HB3 LEU A 27 49.857 49.336 -19.527 1.00 0.00 H new ATOM 0 HG LEU A 27 48.441 50.378 -21.981 1.00 0.00 H new ATOM 0 HD11 LEU A 27 49.845 52.442 -21.765 1.00 0.00 H new ATOM 0 HD12 LEU A 27 48.718 52.276 -20.398 1.00 0.00 H new ATOM 0 HD13 LEU A 27 50.435 51.859 -20.191 1.00 0.00 H new ATOM 0 HD21 LEU A 27 50.762 50.479 -22.888 1.00 0.00 H new ATOM 0 HD22 LEU A 27 51.384 49.866 -21.337 1.00 0.00 H new ATOM 0 HD23 LEU A 27 50.342 48.836 -22.347 1.00 0.00 H new ATOM 427 N ASP A 28 47.492 47.551 -18.134 1.00 0.00 N ATOM 428 CA ASP A 28 47.455 46.741 -16.911 1.00 0.00 C ATOM 429 C ASP A 28 46.799 45.365 -17.132 1.00 0.00 C ATOM 430 O ASP A 28 47.299 44.365 -16.617 1.00 0.00 O ATOM 431 CB ASP A 28 46.726 47.519 -15.811 1.00 0.00 C ATOM 432 CG ASP A 28 46.769 46.773 -14.468 1.00 0.00 C ATOM 433 OD1 ASP A 28 47.841 46.735 -13.831 1.00 0.00 O ATOM 434 OD2 ASP A 28 45.709 46.258 -14.031 1.00 0.00 O ATOM 0 H ASP A 28 46.862 48.353 -18.104 1.00 0.00 H new ATOM 0 HA ASP A 28 48.483 46.546 -16.607 1.00 0.00 H new ATOM 0 HB2 ASP A 28 47.182 48.502 -15.697 1.00 0.00 H new ATOM 0 HB3 ASP A 28 45.689 47.681 -16.105 1.00 0.00 H new ATOM 439 N ALA A 29 45.736 45.275 -17.947 1.00 0.00 N ATOM 440 CA ALA A 29 45.151 43.991 -18.335 1.00 0.00 C ATOM 441 C ALA A 29 46.159 43.131 -19.119 1.00 0.00 C ATOM 442 O ALA A 29 46.327 41.948 -18.813 1.00 0.00 O ATOM 443 CB ALA A 29 43.872 44.235 -19.145 1.00 0.00 C ATOM 0 H ALA A 29 45.265 46.085 -18.350 1.00 0.00 H new ATOM 0 HA ALA A 29 44.894 43.434 -17.434 1.00 0.00 H new ATOM 0 HB1 ALA A 29 43.436 43.279 -19.434 1.00 0.00 H new ATOM 0 HB2 ALA A 29 43.157 44.791 -18.538 1.00 0.00 H new ATOM 0 HB3 ALA A 29 44.112 44.809 -20.040 1.00 0.00 H new ATOM 449 N LEU A 30 46.876 43.733 -20.080 1.00 0.00 N ATOM 450 CA LEU A 30 47.943 43.074 -20.840 1.00 0.00 C ATOM 451 C LEU A 30 49.137 42.666 -19.962 1.00 0.00 C ATOM 452 O LEU A 30 49.722 41.610 -20.198 1.00 0.00 O ATOM 453 CB LEU A 30 48.389 43.977 -21.997 1.00 0.00 C ATOM 454 CG LEU A 30 47.310 44.157 -23.082 1.00 0.00 C ATOM 455 CD1 LEU A 30 47.733 45.285 -24.011 1.00 0.00 C ATOM 456 CD2 LEU A 30 47.116 42.898 -23.931 1.00 0.00 C ATOM 0 H LEU A 30 46.727 44.704 -20.353 1.00 0.00 H new ATOM 0 HA LEU A 30 47.535 42.147 -21.242 1.00 0.00 H new ATOM 0 HB2 LEU A 30 48.662 44.955 -21.601 1.00 0.00 H new ATOM 0 HB3 LEU A 30 49.285 43.556 -22.452 1.00 0.00 H new ATOM 0 HG LEU A 30 46.371 44.375 -22.574 1.00 0.00 H new ATOM 0 HD11 LEU A 30 46.977 45.422 -24.784 1.00 0.00 H new ATOM 0 HD12 LEU A 30 47.839 46.207 -23.439 1.00 0.00 H new ATOM 0 HD13 LEU A 30 48.686 45.035 -24.476 1.00 0.00 H new ATOM 0 HD21 LEU A 30 46.345 43.079 -24.680 1.00 0.00 H new ATOM 0 HD22 LEU A 30 48.053 42.647 -24.428 1.00 0.00 H new ATOM 0 HD23 LEU A 30 46.812 42.070 -23.290 1.00 0.00 H new ATOM 468 N LEU A 31 49.469 43.451 -18.930 1.00 0.00 N ATOM 469 CA LEU A 31 50.476 43.087 -17.926 1.00 0.00 C ATOM 470 C LEU A 31 50.023 41.845 -17.130 1.00 0.00 C ATOM 471 O LEU A 31 50.804 40.911 -16.929 1.00 0.00 O ATOM 472 CB LEU A 31 50.718 44.299 -17.001 1.00 0.00 C ATOM 473 CG LEU A 31 52.012 44.190 -16.167 1.00 0.00 C ATOM 474 CD1 LEU A 31 53.212 44.767 -16.925 1.00 0.00 C ATOM 475 CD2 LEU A 31 51.868 44.962 -14.852 1.00 0.00 C ATOM 0 H LEU A 31 49.043 44.363 -18.767 1.00 0.00 H new ATOM 0 HA LEU A 31 51.414 42.827 -18.417 1.00 0.00 H new ATOM 0 HB2 LEU A 31 50.761 45.205 -17.606 1.00 0.00 H new ATOM 0 HB3 LEU A 31 49.869 44.406 -16.326 1.00 0.00 H new ATOM 0 HG LEU A 31 52.178 43.131 -15.970 1.00 0.00 H new ATOM 0 HD11 LEU A 31 54.108 44.676 -16.311 1.00 0.00 H new ATOM 0 HD12 LEU A 31 53.352 44.218 -17.856 1.00 0.00 H new ATOM 0 HD13 LEU A 31 53.030 45.818 -17.148 1.00 0.00 H new ATOM 0 HD21 LEU A 31 52.789 44.875 -14.276 1.00 0.00 H new ATOM 0 HD22 LEU A 31 51.672 46.013 -15.066 1.00 0.00 H new ATOM 0 HD23 LEU A 31 51.040 44.549 -14.276 1.00 0.00 H new ATOM 487 N SER A 32 48.739 41.801 -16.747 1.00 0.00 N ATOM 488 CA SER A 32 48.096 40.676 -16.042 1.00 0.00 C ATOM 489 C SER A 32 48.083 39.352 -16.828 1.00 0.00 C ATOM 490 O SER A 32 48.039 38.276 -16.220 1.00 0.00 O ATOM 491 CB SER A 32 46.657 41.051 -15.652 1.00 0.00 C ATOM 492 OG SER A 32 46.446 40.817 -14.266 1.00 0.00 O ATOM 0 H SER A 32 48.095 42.572 -16.924 1.00 0.00 H new ATOM 0 HA SER A 32 48.708 40.499 -15.158 1.00 0.00 H new ATOM 0 HB2 SER A 32 46.472 42.100 -15.883 1.00 0.00 H new ATOM 0 HB3 SER A 32 45.949 40.465 -16.239 1.00 0.00 H new ATOM 0 HG SER A 32 45.527 41.061 -14.029 1.00 0.00 H new ATOM 498 N ARG A 33 48.182 39.412 -18.169 1.00 0.00 N ATOM 499 CA ARG A 33 48.287 38.242 -19.076 1.00 0.00 C ATOM 500 C ARG A 33 49.670 38.104 -19.750 1.00 0.00 C ATOM 501 O ARG A 33 49.815 37.338 -20.701 1.00 0.00 O ATOM 502 CB ARG A 33 47.111 38.218 -20.083 1.00 0.00 C ATOM 503 CG ARG A 33 47.146 39.385 -21.083 1.00 0.00 C ATOM 504 CD ARG A 33 46.278 39.162 -22.330 1.00 0.00 C ATOM 505 NE ARG A 33 44.864 39.540 -22.114 1.00 0.00 N ATOM 506 CZ ARG A 33 43.819 38.736 -21.999 1.00 0.00 C ATOM 507 NH1 ARG A 33 43.935 37.438 -21.937 1.00 0.00 N ATOM 508 NH2 ARG A 33 42.615 39.236 -21.953 1.00 0.00 N ATOM 0 H ARG A 33 48.192 40.300 -18.671 1.00 0.00 H new ATOM 0 HA ARG A 33 48.202 37.350 -18.455 1.00 0.00 H new ATOM 0 HB2 ARG A 33 47.131 37.277 -20.632 1.00 0.00 H new ATOM 0 HB3 ARG A 33 46.170 38.247 -19.534 1.00 0.00 H new ATOM 0 HG2 ARG A 33 46.814 40.293 -20.579 1.00 0.00 H new ATOM 0 HG3 ARG A 33 48.177 39.552 -21.395 1.00 0.00 H new ATOM 0 HD2 ARG A 33 46.683 39.743 -23.159 1.00 0.00 H new ATOM 0 HD3 ARG A 33 46.329 38.113 -22.621 1.00 0.00 H new ATOM 0 HE ARG A 33 44.672 40.539 -22.046 1.00 0.00 H new ATOM 0 HH11 ARG A 33 44.858 37.006 -21.977 1.00 0.00 H new ATOM 0 HH12 ARG A 33 43.103 36.855 -21.848 1.00 0.00 H new ATOM 0 HH21 ARG A 33 42.480 40.246 -22.006 1.00 0.00 H new ATOM 0 HH22 ARG A 33 41.809 38.617 -21.864 1.00 0.00 H new ATOM 522 N ASP A 34 50.677 38.838 -19.262 1.00 0.00 N ATOM 523 CA ASP A 34 52.074 38.826 -19.732 1.00 0.00 C ATOM 524 C ASP A 34 52.248 39.071 -21.256 1.00 0.00 C ATOM 525 O ASP A 34 53.090 38.458 -21.917 1.00 0.00 O ATOM 526 CB ASP A 34 52.772 37.559 -19.202 1.00 0.00 C ATOM 527 CG ASP A 34 54.305 37.596 -19.347 1.00 0.00 C ATOM 528 OD1 ASP A 34 54.927 38.636 -19.026 1.00 0.00 O ATOM 529 OD2 ASP A 34 54.902 36.557 -19.720 1.00 0.00 O ATOM 0 H ASP A 34 50.536 39.490 -18.490 1.00 0.00 H new ATOM 0 HA ASP A 34 52.580 39.695 -19.311 1.00 0.00 H new ATOM 0 HB2 ASP A 34 52.518 37.426 -18.150 1.00 0.00 H new ATOM 0 HB3 ASP A 34 52.385 36.691 -19.735 1.00 0.00 H new ATOM 534 N LEU A 35 51.438 39.980 -21.821 1.00 0.00 N ATOM 535 CA LEU A 35 51.425 40.360 -23.252 1.00 0.00 C ATOM 536 C LEU A 35 52.038 41.765 -23.487 1.00 0.00 C ATOM 537 O LEU A 35 52.378 42.118 -24.617 1.00 0.00 O ATOM 538 CB LEU A 35 49.973 40.188 -23.764 1.00 0.00 C ATOM 539 CG LEU A 35 49.767 39.800 -25.249 1.00 0.00 C ATOM 540 CD1 LEU A 35 48.320 39.344 -25.450 1.00 0.00 C ATOM 541 CD2 LEU A 35 50.006 40.920 -26.266 1.00 0.00 C ATOM 0 H LEU A 35 50.745 40.494 -21.276 1.00 0.00 H new ATOM 0 HA LEU A 35 52.071 39.708 -23.839 1.00 0.00 H new ATOM 0 HB2 LEU A 35 49.490 39.428 -23.150 1.00 0.00 H new ATOM 0 HB3 LEU A 35 49.443 41.124 -23.587 1.00 0.00 H new ATOM 0 HG LEU A 35 50.511 39.025 -25.434 1.00 0.00 H new ATOM 0 HD11 LEU A 35 48.167 39.069 -26.494 1.00 0.00 H new ATOM 0 HD12 LEU A 35 48.119 38.482 -24.814 1.00 0.00 H new ATOM 0 HD13 LEU A 35 47.643 40.156 -25.186 1.00 0.00 H new ATOM 0 HD21 LEU A 35 49.834 40.540 -27.273 1.00 0.00 H new ATOM 0 HD22 LEU A 35 49.321 41.744 -26.067 1.00 0.00 H new ATOM 0 HD23 LEU A 35 51.033 41.274 -26.182 1.00 0.00 H new ATOM 553 N ILE A 36 52.286 42.536 -22.418 1.00 0.00 N ATOM 554 CA ILE A 36 53.101 43.765 -22.435 1.00 0.00 C ATOM 555 C ILE A 36 54.214 43.623 -21.379 1.00 0.00 C ATOM 556 O ILE A 36 53.959 43.248 -20.229 1.00 0.00 O ATOM 557 CB ILE A 36 52.193 45.018 -22.271 1.00 0.00 C ATOM 558 CG1 ILE A 36 52.708 46.297 -22.968 1.00 0.00 C ATOM 559 CG2 ILE A 36 51.804 45.323 -20.818 1.00 0.00 C ATOM 560 CD1 ILE A 36 53.950 46.970 -22.390 1.00 0.00 C ATOM 0 H ILE A 36 51.917 42.318 -21.492 1.00 0.00 H new ATOM 0 HA ILE A 36 53.596 43.909 -23.395 1.00 0.00 H new ATOM 0 HB ILE A 36 51.290 44.717 -22.802 1.00 0.00 H new ATOM 0 HG12 ILE A 36 52.914 46.051 -24.010 1.00 0.00 H new ATOM 0 HG13 ILE A 36 51.899 47.028 -22.967 1.00 0.00 H new ATOM 0 HG21 ILE A 36 51.171 46.210 -20.789 1.00 0.00 H new ATOM 0 HG22 ILE A 36 51.260 44.476 -20.402 1.00 0.00 H new ATOM 0 HG23 ILE A 36 52.704 45.500 -20.230 1.00 0.00 H new ATOM 0 HD11 ILE A 36 54.193 47.853 -22.981 1.00 0.00 H new ATOM 0 HD12 ILE A 36 53.757 47.265 -21.359 1.00 0.00 H new ATOM 0 HD13 ILE A 36 54.788 46.273 -22.418 1.00 0.00 H new ATOM 572 N MET A 37 55.470 43.857 -21.771 1.00 0.00 N ATOM 573 CA MET A 37 56.627 43.831 -20.863 1.00 0.00 C ATOM 574 C MET A 37 56.685 45.117 -20.012 1.00 0.00 C ATOM 575 O MET A 37 56.403 46.205 -20.500 1.00 0.00 O ATOM 576 CB MET A 37 57.932 43.712 -21.674 1.00 0.00 C ATOM 577 CG MET A 37 58.131 42.299 -22.244 1.00 0.00 C ATOM 578 SD MET A 37 59.672 42.136 -23.197 1.00 0.00 S ATOM 579 CE MET A 37 59.625 40.356 -23.532 1.00 0.00 C ATOM 0 H MET A 37 55.717 44.072 -22.737 1.00 0.00 H new ATOM 0 HA MET A 37 56.518 42.970 -20.204 1.00 0.00 H new ATOM 0 HB2 MET A 37 57.918 44.433 -22.491 1.00 0.00 H new ATOM 0 HB3 MET A 37 58.779 43.968 -21.037 1.00 0.00 H new ATOM 0 HG2 MET A 37 58.137 41.579 -21.425 1.00 0.00 H new ATOM 0 HG3 MET A 37 57.285 42.047 -22.883 1.00 0.00 H new ATOM 0 HE1 MET A 37 60.502 40.072 -24.113 1.00 0.00 H new ATOM 0 HE2 MET A 37 59.621 39.808 -22.590 1.00 0.00 H new ATOM 0 HE3 MET A 37 58.723 40.115 -24.095 1.00 0.00 H new ATOM 589 N LYS A 38 57.172 44.998 -18.763 1.00 0.00 N ATOM 590 CA LYS A 38 57.371 46.165 -17.871 1.00 0.00 C ATOM 591 C LYS A 38 58.307 47.225 -18.465 1.00 0.00 C ATOM 592 O LYS A 38 58.100 48.420 -18.242 1.00 0.00 O ATOM 593 CB LYS A 38 57.804 45.667 -16.476 1.00 0.00 C ATOM 594 CG LYS A 38 57.858 46.785 -15.413 1.00 0.00 C ATOM 595 CD LYS A 38 59.248 47.417 -15.227 1.00 0.00 C ATOM 596 CE LYS A 38 60.210 46.469 -14.495 1.00 0.00 C ATOM 597 NZ LYS A 38 61.576 47.056 -14.401 1.00 0.00 N ATOM 0 H LYS A 38 57.436 44.106 -18.344 1.00 0.00 H new ATOM 0 HA LYS A 38 56.422 46.690 -17.764 1.00 0.00 H new ATOM 0 HB2 LYS A 38 57.111 44.894 -16.144 1.00 0.00 H new ATOM 0 HB3 LYS A 38 58.787 45.202 -16.554 1.00 0.00 H new ATOM 0 HG2 LYS A 38 57.151 47.567 -15.689 1.00 0.00 H new ATOM 0 HG3 LYS A 38 57.526 46.378 -14.458 1.00 0.00 H new ATOM 0 HD2 LYS A 38 59.663 47.676 -16.201 1.00 0.00 H new ATOM 0 HD3 LYS A 38 59.153 48.345 -14.664 1.00 0.00 H new ATOM 0 HE2 LYS A 38 59.830 46.263 -13.494 1.00 0.00 H new ATOM 0 HE3 LYS A 38 60.256 45.516 -15.021 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 62.205 46.394 -13.902 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 61.946 47.230 -15.357 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 61.533 47.954 -13.878 1.00 0.00 H new ATOM 611 N GLU A 39 59.301 46.822 -19.271 1.00 0.00 N ATOM 612 CA GLU A 39 60.160 47.741 -20.031 1.00 0.00 C ATOM 613 C GLU A 39 59.348 48.704 -20.913 1.00 0.00 C ATOM 614 O GLU A 39 59.491 49.925 -20.808 1.00 0.00 O ATOM 615 CB GLU A 39 61.167 46.956 -20.907 1.00 0.00 C ATOM 616 CG GLU A 39 62.595 47.017 -20.354 1.00 0.00 C ATOM 617 CD GLU A 39 63.608 46.499 -21.401 1.00 0.00 C ATOM 618 OE1 GLU A 39 63.796 45.259 -21.513 1.00 0.00 O ATOM 619 OE2 GLU A 39 64.234 47.326 -22.106 1.00 0.00 O ATOM 0 H GLU A 39 59.533 45.839 -19.414 1.00 0.00 H new ATOM 0 HA GLU A 39 60.704 48.337 -19.298 1.00 0.00 H new ATOM 0 HB2 GLU A 39 60.851 45.915 -20.975 1.00 0.00 H new ATOM 0 HB3 GLU A 39 61.155 47.359 -21.920 1.00 0.00 H new ATOM 0 HG2 GLU A 39 62.841 48.043 -20.079 1.00 0.00 H new ATOM 0 HG3 GLU A 39 62.665 46.418 -19.446 1.00 0.00 H new ATOM 626 N ASP A 40 58.457 48.175 -21.763 1.00 0.00 N ATOM 627 CA ASP A 40 57.590 48.989 -22.608 1.00 0.00 C ATOM 628 C ASP A 40 56.469 49.688 -21.805 1.00 0.00 C ATOM 629 O ASP A 40 56.108 50.800 -22.136 1.00 0.00 O ATOM 630 CB ASP A 40 57.020 48.164 -23.769 1.00 0.00 C ATOM 631 CG ASP A 40 58.024 48.093 -24.939 1.00 0.00 C ATOM 632 OD1 ASP A 40 58.228 49.123 -25.619 1.00 0.00 O ATOM 633 OD2 ASP A 40 58.590 46.999 -25.186 1.00 0.00 O ATOM 0 H ASP A 40 58.322 47.171 -21.880 1.00 0.00 H new ATOM 0 HA ASP A 40 58.209 49.782 -23.029 1.00 0.00 H new ATOM 0 HB2 ASP A 40 56.786 47.157 -23.424 1.00 0.00 H new ATOM 0 HB3 ASP A 40 56.086 48.609 -24.112 1.00 0.00 H new ATOM 638 N TYR A 41 55.981 49.077 -20.719 1.00 0.00 N ATOM 639 CA TYR A 41 55.006 49.712 -19.810 1.00 0.00 C ATOM 640 C TYR A 41 55.529 51.051 -19.259 1.00 0.00 C ATOM 641 O TYR A 41 54.840 52.064 -19.312 1.00 0.00 O ATOM 642 CB TYR A 41 54.664 48.730 -18.678 1.00 0.00 C ATOM 643 CG TYR A 41 53.481 49.117 -17.808 1.00 0.00 C ATOM 644 CD1 TYR A 41 53.654 50.029 -16.749 1.00 0.00 C ATOM 645 CD2 TYR A 41 52.226 48.512 -18.014 1.00 0.00 C ATOM 646 CE1 TYR A 41 52.570 50.351 -15.908 1.00 0.00 C ATOM 647 CE2 TYR A 41 51.144 48.818 -17.163 1.00 0.00 C ATOM 648 CZ TYR A 41 51.310 49.750 -16.113 1.00 0.00 C ATOM 649 OH TYR A 41 50.274 50.060 -15.293 1.00 0.00 O ATOM 0 H TYR A 41 56.247 48.132 -20.442 1.00 0.00 H new ATOM 0 HA TYR A 41 54.099 49.944 -20.368 1.00 0.00 H new ATOM 0 HB2 TYR A 41 54.465 47.753 -19.117 1.00 0.00 H new ATOM 0 HB3 TYR A 41 55.541 48.620 -18.040 1.00 0.00 H new ATOM 0 HD1 TYR A 41 54.620 50.483 -16.581 1.00 0.00 H new ATOM 0 HD2 TYR A 41 52.092 47.812 -18.826 1.00 0.00 H new ATOM 0 HE1 TYR A 41 52.704 51.060 -15.104 1.00 0.00 H new ATOM 0 HE2 TYR A 41 50.187 48.340 -17.314 1.00 0.00 H new ATOM 0 HH TYR A 41 49.477 49.561 -15.570 1.00 0.00 H new ATOM 659 N GLU A 42 56.787 51.084 -18.782 1.00 0.00 N ATOM 660 CA GLU A 42 57.406 52.318 -18.274 1.00 0.00 C ATOM 661 C GLU A 42 57.863 53.275 -19.386 1.00 0.00 C ATOM 662 O GLU A 42 57.751 54.496 -19.222 1.00 0.00 O ATOM 663 CB GLU A 42 58.560 51.991 -17.310 1.00 0.00 C ATOM 664 CG GLU A 42 58.050 51.301 -16.035 1.00 0.00 C ATOM 665 CD GLU A 42 59.114 51.298 -14.918 1.00 0.00 C ATOM 666 OE1 GLU A 42 60.252 50.810 -15.143 1.00 0.00 O ATOM 667 OE2 GLU A 42 58.813 51.765 -13.792 1.00 0.00 O ATOM 0 H GLU A 42 57.395 50.266 -18.739 1.00 0.00 H new ATOM 0 HA GLU A 42 56.629 52.850 -17.725 1.00 0.00 H new ATOM 0 HB2 GLU A 42 59.282 51.346 -17.810 1.00 0.00 H new ATOM 0 HB3 GLU A 42 59.084 52.909 -17.044 1.00 0.00 H new ATOM 0 HG2 GLU A 42 57.153 51.809 -15.681 1.00 0.00 H new ATOM 0 HG3 GLU A 42 57.764 50.275 -16.267 1.00 0.00 H new ATOM 674 N LEU A 43 58.301 52.775 -20.556 1.00 0.00 N ATOM 675 CA LEU A 43 58.575 53.610 -21.734 1.00 0.00 C ATOM 676 C LEU A 43 57.303 54.238 -22.353 1.00 0.00 C ATOM 677 O LEU A 43 57.378 55.287 -22.985 1.00 0.00 O ATOM 678 CB LEU A 43 59.355 52.803 -22.790 1.00 0.00 C ATOM 679 CG LEU A 43 60.827 52.530 -22.419 1.00 0.00 C ATOM 680 CD1 LEU A 43 61.431 51.527 -23.404 1.00 0.00 C ATOM 681 CD2 LEU A 43 61.680 53.803 -22.466 1.00 0.00 C ATOM 0 H LEU A 43 58.474 51.781 -20.709 1.00 0.00 H new ATOM 0 HA LEU A 43 59.186 54.444 -21.389 1.00 0.00 H new ATOM 0 HB2 LEU A 43 58.850 51.850 -22.949 1.00 0.00 H new ATOM 0 HB3 LEU A 43 59.325 53.341 -23.737 1.00 0.00 H new ATOM 0 HG LEU A 43 60.831 52.139 -21.402 1.00 0.00 H new ATOM 0 HD11 LEU A 43 62.471 51.337 -23.138 1.00 0.00 H new ATOM 0 HD12 LEU A 43 60.870 50.594 -23.363 1.00 0.00 H new ATOM 0 HD13 LEU A 43 61.383 51.935 -24.414 1.00 0.00 H new ATOM 0 HD21 LEU A 43 62.709 53.562 -22.198 1.00 0.00 H new ATOM 0 HD22 LEU A 43 61.656 54.220 -23.473 1.00 0.00 H new ATOM 0 HD23 LEU A 43 61.283 54.533 -21.761 1.00 0.00 H new ATOM 693 N VAL A 44 56.124 53.635 -22.134 1.00 0.00 N ATOM 694 CA VAL A 44 54.814 54.256 -22.397 1.00 0.00 C ATOM 695 C VAL A 44 54.428 55.231 -21.263 1.00 0.00 C ATOM 696 O VAL A 44 53.810 56.253 -21.538 1.00 0.00 O ATOM 697 CB VAL A 44 53.736 53.173 -22.641 1.00 0.00 C ATOM 698 CG1 VAL A 44 52.319 53.745 -22.738 1.00 0.00 C ATOM 699 CG2 VAL A 44 53.988 52.434 -23.965 1.00 0.00 C ATOM 0 H VAL A 44 56.052 52.687 -21.763 1.00 0.00 H new ATOM 0 HA VAL A 44 54.883 54.848 -23.309 1.00 0.00 H new ATOM 0 HB VAL A 44 53.809 52.508 -21.780 1.00 0.00 H new ATOM 0 HG11 VAL A 44 51.610 52.935 -22.909 1.00 0.00 H new ATOM 0 HG12 VAL A 44 52.068 54.256 -21.808 1.00 0.00 H new ATOM 0 HG13 VAL A 44 52.268 54.453 -23.566 1.00 0.00 H new ATOM 0 HG21 VAL A 44 53.216 51.678 -24.112 1.00 0.00 H new ATOM 0 HG22 VAL A 44 53.961 53.146 -24.790 1.00 0.00 H new ATOM 0 HG23 VAL A 44 54.966 51.953 -23.933 1.00 0.00 H new ATOM 709 N SER A 45 54.818 54.972 -20.009 1.00 0.00 N ATOM 710 CA SER A 45 54.502 55.860 -18.869 1.00 0.00 C ATOM 711 C SER A 45 55.311 57.175 -18.843 1.00 0.00 C ATOM 712 O SER A 45 54.777 58.221 -18.453 1.00 0.00 O ATOM 713 CB SER A 45 54.686 55.092 -17.556 1.00 0.00 C ATOM 714 OG SER A 45 54.043 55.779 -16.496 1.00 0.00 O ATOM 0 H SER A 45 55.359 54.147 -19.750 1.00 0.00 H new ATOM 0 HA SER A 45 53.462 56.163 -18.994 1.00 0.00 H new ATOM 0 HB2 SER A 45 54.273 54.088 -17.652 1.00 0.00 H new ATOM 0 HB3 SER A 45 55.748 54.981 -17.336 1.00 0.00 H new ATOM 0 HG SER A 45 54.165 55.280 -15.661 1.00 0.00 H new ATOM 720 N THR A 46 56.582 57.153 -19.274 1.00 0.00 N ATOM 721 CA THR A 46 57.503 58.321 -19.258 1.00 0.00 C ATOM 722 C THR A 46 57.135 59.465 -20.233 1.00 0.00 C ATOM 723 O THR A 46 57.730 60.552 -20.199 1.00 0.00 O ATOM 724 CB THR A 46 58.950 57.828 -19.466 1.00 0.00 C ATOM 725 OG1 THR A 46 59.888 58.793 -19.034 1.00 0.00 O ATOM 726 CG2 THR A 46 59.271 57.461 -20.917 1.00 0.00 C ATOM 0 H THR A 46 57.015 56.311 -19.652 1.00 0.00 H new ATOM 0 HA THR A 46 57.401 58.784 -18.276 1.00 0.00 H new ATOM 0 HB THR A 46 59.027 56.923 -18.864 1.00 0.00 H new ATOM 0 HG1 THR A 46 59.561 59.690 -19.257 1.00 0.00 H new ATOM 0 HG21 THR A 46 60.305 57.123 -20.987 1.00 0.00 H new ATOM 0 HG22 THR A 46 58.606 56.663 -21.246 1.00 0.00 H new ATOM 0 HG23 THR A 46 59.131 58.335 -21.553 1.00 0.00 H new ATOM 734 N LYS A 47 56.146 59.233 -21.117 1.00 0.00 N ATOM 735 CA LYS A 47 55.642 60.172 -22.140 1.00 0.00 C ATOM 736 C LYS A 47 55.129 61.516 -21.554 1.00 0.00 C ATOM 737 O LYS A 47 54.690 61.556 -20.396 1.00 0.00 O ATOM 738 CB LYS A 47 54.507 59.459 -22.907 1.00 0.00 C ATOM 739 CG LYS A 47 54.986 58.247 -23.739 1.00 0.00 C ATOM 740 CD LYS A 47 55.830 58.622 -24.974 1.00 0.00 C ATOM 741 CE LYS A 47 54.966 59.337 -26.026 1.00 0.00 C ATOM 742 NZ LYS A 47 55.772 59.735 -27.219 1.00 0.00 N ATOM 0 H LYS A 47 55.651 58.341 -21.139 1.00 0.00 H new ATOM 0 HA LYS A 47 56.471 60.438 -22.796 1.00 0.00 H new ATOM 0 HB2 LYS A 47 53.753 59.124 -22.194 1.00 0.00 H new ATOM 0 HB3 LYS A 47 54.023 60.175 -23.570 1.00 0.00 H new ATOM 0 HG2 LYS A 47 55.573 57.590 -23.098 1.00 0.00 H new ATOM 0 HG3 LYS A 47 54.116 57.679 -24.067 1.00 0.00 H new ATOM 0 HD2 LYS A 47 56.655 59.268 -24.674 1.00 0.00 H new ATOM 0 HD3 LYS A 47 56.269 57.723 -25.407 1.00 0.00 H new ATOM 0 HE2 LYS A 47 54.153 58.681 -26.337 1.00 0.00 H new ATOM 0 HE3 LYS A 47 54.509 60.222 -25.583 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 55.170 60.259 -27.886 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 56.563 60.340 -26.918 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 56.145 58.884 -27.685 1.00 0.00 H new ATOM 756 N PRO A 48 55.116 62.608 -22.349 1.00 0.00 N ATOM 757 CA PRO A 48 54.754 63.951 -21.866 1.00 0.00 C ATOM 758 C PRO A 48 53.249 64.131 -21.573 1.00 0.00 C ATOM 759 O PRO A 48 52.893 64.886 -20.665 1.00 0.00 O ATOM 760 CB PRO A 48 55.222 64.920 -22.963 1.00 0.00 C ATOM 761 CG PRO A 48 55.177 64.077 -24.236 1.00 0.00 C ATOM 762 CD PRO A 48 55.577 62.687 -23.736 1.00 0.00 C ATOM 0 HA PRO A 48 55.233 64.137 -20.905 1.00 0.00 H new ATOM 0 HB2 PRO A 48 54.568 65.789 -23.035 1.00 0.00 H new ATOM 0 HB3 PRO A 48 56.227 65.293 -22.765 1.00 0.00 H new ATOM 0 HG2 PRO A 48 54.184 64.075 -24.685 1.00 0.00 H new ATOM 0 HG3 PRO A 48 55.868 64.449 -24.992 1.00 0.00 H new ATOM 0 HD2 PRO A 48 55.119 61.907 -24.344 1.00 0.00 H new ATOM 0 HD3 PRO A 48 56.656 62.546 -23.797 1.00 0.00 H new ATOM 770 N THR A 49 52.373 63.440 -22.317 1.00 0.00 N ATOM 771 CA THR A 49 50.901 63.539 -22.199 1.00 0.00 C ATOM 772 C THR A 49 50.224 62.202 -22.504 1.00 0.00 C ATOM 773 O THR A 49 50.715 61.405 -23.309 1.00 0.00 O ATOM 774 CB THR A 49 50.309 64.586 -23.166 1.00 0.00 C ATOM 775 OG1 THR A 49 50.747 64.347 -24.487 1.00 0.00 O ATOM 776 CG2 THR A 49 50.668 66.023 -22.798 1.00 0.00 C ATOM 0 H THR A 49 52.670 62.780 -23.036 1.00 0.00 H new ATOM 0 HA THR A 49 50.709 63.838 -21.168 1.00 0.00 H new ATOM 0 HB THR A 49 49.227 64.477 -23.087 1.00 0.00 H new ATOM 0 HG1 THR A 49 50.361 65.019 -25.086 1.00 0.00 H new ATOM 0 HG21 THR A 49 50.219 66.706 -23.519 1.00 0.00 H new ATOM 0 HG22 THR A 49 50.290 66.248 -21.801 1.00 0.00 H new ATOM 0 HG23 THR A 49 51.751 66.142 -22.811 1.00 0.00 H new ATOM 784 N ARG A 50 49.051 61.965 -21.900 1.00 0.00 N ATOM 785 CA ARG A 50 48.228 60.758 -22.115 1.00 0.00 C ATOM 786 C ARG A 50 47.798 60.538 -23.572 1.00 0.00 C ATOM 787 O ARG A 50 47.821 59.408 -24.044 1.00 0.00 O ATOM 788 CB ARG A 50 47.046 60.759 -21.134 1.00 0.00 C ATOM 789 CG ARG A 50 46.042 61.912 -21.342 1.00 0.00 C ATOM 790 CD ARG A 50 45.494 62.493 -20.024 1.00 0.00 C ATOM 791 NE ARG A 50 45.740 63.948 -19.935 1.00 0.00 N ATOM 792 CZ ARG A 50 46.842 64.557 -19.527 1.00 0.00 C ATOM 793 NH1 ARG A 50 47.863 63.908 -19.039 1.00 0.00 N ATOM 794 NH2 ARG A 50 46.944 65.851 -19.618 1.00 0.00 N ATOM 0 H ARG A 50 48.636 62.617 -21.235 1.00 0.00 H new ATOM 0 HA ARG A 50 48.858 59.894 -21.904 1.00 0.00 H new ATOM 0 HB2 ARG A 50 46.515 59.811 -21.224 1.00 0.00 H new ATOM 0 HB3 ARG A 50 47.435 60.812 -20.117 1.00 0.00 H new ATOM 0 HG2 ARG A 50 46.527 62.708 -21.907 1.00 0.00 H new ATOM 0 HG3 ARG A 50 45.209 61.553 -21.946 1.00 0.00 H new ATOM 0 HD2 ARG A 50 44.424 62.298 -19.955 1.00 0.00 H new ATOM 0 HD3 ARG A 50 45.964 61.990 -19.179 1.00 0.00 H new ATOM 0 HE ARG A 50 44.971 64.553 -20.221 1.00 0.00 H new ATOM 0 HH11 ARG A 50 47.831 62.892 -18.960 1.00 0.00 H new ATOM 0 HH12 ARG A 50 48.693 64.417 -18.736 1.00 0.00 H new ATOM 0 HH21 ARG A 50 46.174 66.397 -20.004 1.00 0.00 H new ATOM 0 HH22 ARG A 50 47.794 66.319 -19.303 1.00 0.00 H new ATOM 808 N THR A 51 47.524 61.607 -24.314 1.00 0.00 N ATOM 809 CA THR A 51 47.254 61.573 -25.766 1.00 0.00 C ATOM 810 C THR A 51 48.465 61.136 -26.603 1.00 0.00 C ATOM 811 O THR A 51 48.295 60.702 -27.746 1.00 0.00 O ATOM 812 CB THR A 51 46.768 62.947 -26.250 1.00 0.00 C ATOM 813 OG1 THR A 51 47.654 63.950 -25.795 1.00 0.00 O ATOM 814 CG2 THR A 51 45.373 63.275 -25.716 1.00 0.00 C ATOM 0 H THR A 51 47.480 62.548 -23.922 1.00 0.00 H new ATOM 0 HA THR A 51 46.477 60.822 -25.911 1.00 0.00 H new ATOM 0 HB THR A 51 46.734 62.915 -27.339 1.00 0.00 H new ATOM 0 HG1 THR A 51 47.344 64.826 -26.106 1.00 0.00 H new ATOM 0 HG21 THR A 51 45.065 64.255 -26.081 1.00 0.00 H new ATOM 0 HG22 THR A 51 44.665 62.521 -26.060 1.00 0.00 H new ATOM 0 HG23 THR A 51 45.393 63.283 -24.626 1.00 0.00 H new ATOM 822 N SER A 52 49.679 61.213 -26.043 1.00 0.00 N ATOM 823 CA SER A 52 50.919 60.670 -26.620 1.00 0.00 C ATOM 824 C SER A 52 51.237 59.258 -26.091 1.00 0.00 C ATOM 825 O SER A 52 51.798 58.443 -26.830 1.00 0.00 O ATOM 826 CB SER A 52 52.067 61.646 -26.327 1.00 0.00 C ATOM 827 OG SER A 52 53.158 61.425 -27.201 1.00 0.00 O ATOM 0 H SER A 52 49.832 61.671 -25.144 1.00 0.00 H new ATOM 0 HA SER A 52 50.789 60.567 -27.697 1.00 0.00 H new ATOM 0 HB2 SER A 52 51.713 62.671 -26.434 1.00 0.00 H new ATOM 0 HB3 SER A 52 52.395 61.528 -25.294 1.00 0.00 H new ATOM 0 HG SER A 52 53.876 62.060 -26.995 1.00 0.00 H new ATOM 833 N LYS A 53 50.807 58.900 -24.864 1.00 0.00 N ATOM 834 CA LYS A 53 50.842 57.510 -24.350 1.00 0.00 C ATOM 835 C LYS A 53 50.099 56.541 -25.272 1.00 0.00 C ATOM 836 O LYS A 53 50.633 55.478 -25.587 1.00 0.00 O ATOM 837 CB LYS A 53 50.266 57.381 -22.923 1.00 0.00 C ATOM 838 CG LYS A 53 51.041 58.166 -21.856 1.00 0.00 C ATOM 839 CD LYS A 53 50.535 57.922 -20.421 1.00 0.00 C ATOM 840 CE LYS A 53 50.814 56.486 -19.936 1.00 0.00 C ATOM 841 NZ LYS A 53 49.579 55.765 -19.516 1.00 0.00 N ATOM 0 H LYS A 53 50.423 59.569 -24.196 1.00 0.00 H new ATOM 0 HA LYS A 53 51.899 57.245 -24.320 1.00 0.00 H new ATOM 0 HB2 LYS A 53 49.231 57.723 -22.929 1.00 0.00 H new ATOM 0 HB3 LYS A 53 50.252 56.328 -22.643 1.00 0.00 H new ATOM 0 HG2 LYS A 53 52.095 57.895 -21.912 1.00 0.00 H new ATOM 0 HG3 LYS A 53 50.974 59.231 -22.080 1.00 0.00 H new ATOM 0 HD2 LYS A 53 51.013 58.630 -19.745 1.00 0.00 H new ATOM 0 HD3 LYS A 53 49.463 58.115 -20.379 1.00 0.00 H new ATOM 0 HE2 LYS A 53 51.301 55.927 -20.735 1.00 0.00 H new ATOM 0 HE3 LYS A 53 51.511 56.520 -19.099 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 49.821 54.790 -19.248 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 49.153 56.252 -18.702 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 48.901 55.750 -20.304 1.00 0.00 H new ATOM 855 N VAL A 54 48.903 56.919 -25.744 1.00 0.00 N ATOM 856 CA VAL A 54 48.118 56.089 -26.683 1.00 0.00 C ATOM 857 C VAL A 54 48.926 55.813 -27.956 1.00 0.00 C ATOM 858 O VAL A 54 49.061 54.662 -28.354 1.00 0.00 O ATOM 859 CB VAL A 54 46.753 56.711 -27.051 1.00 0.00 C ATOM 860 CG1 VAL A 54 45.911 55.725 -27.879 1.00 0.00 C ATOM 861 CG2 VAL A 54 45.899 57.122 -25.846 1.00 0.00 C ATOM 0 H VAL A 54 48.452 57.798 -25.492 1.00 0.00 H new ATOM 0 HA VAL A 54 47.910 55.153 -26.165 1.00 0.00 H new ATOM 0 HB VAL A 54 47.008 57.609 -27.614 1.00 0.00 H new ATOM 0 HG11 VAL A 54 44.954 56.183 -28.127 1.00 0.00 H new ATOM 0 HG12 VAL A 54 46.442 55.474 -28.797 1.00 0.00 H new ATOM 0 HG13 VAL A 54 45.739 54.818 -27.300 1.00 0.00 H new ATOM 0 HG21 VAL A 54 44.959 57.549 -26.195 1.00 0.00 H new ATOM 0 HG22 VAL A 54 45.693 56.246 -25.230 1.00 0.00 H new ATOM 0 HG23 VAL A 54 46.437 57.863 -25.255 1.00 0.00 H new ATOM 871 N ARG A 55 49.536 56.847 -28.557 1.00 0.00 N ATOM 872 CA ARG A 55 50.410 56.714 -29.740 1.00 0.00 C ATOM 873 C ARG A 55 51.622 55.806 -29.499 1.00 0.00 C ATOM 874 O ARG A 55 51.909 54.956 -30.342 1.00 0.00 O ATOM 875 CB ARG A 55 50.843 58.112 -30.221 1.00 0.00 C ATOM 876 CG ARG A 55 49.893 58.625 -31.316 1.00 0.00 C ATOM 877 CD ARG A 55 50.101 60.119 -31.594 1.00 0.00 C ATOM 878 NE ARG A 55 49.431 60.950 -30.572 1.00 0.00 N ATOM 879 CZ ARG A 55 49.323 62.266 -30.580 1.00 0.00 C ATOM 880 NH1 ARG A 55 49.927 63.019 -31.461 1.00 0.00 N ATOM 881 NH2 ARG A 55 48.584 62.839 -29.675 1.00 0.00 N ATOM 0 H ARG A 55 49.437 57.810 -28.234 1.00 0.00 H new ATOM 0 HA ARG A 55 49.830 56.224 -30.522 1.00 0.00 H new ATOM 0 HB2 ARG A 55 50.847 58.807 -29.381 1.00 0.00 H new ATOM 0 HB3 ARG A 55 51.862 58.071 -30.606 1.00 0.00 H new ATOM 0 HG2 ARG A 55 50.055 58.058 -32.233 1.00 0.00 H new ATOM 0 HG3 ARG A 55 48.861 58.452 -31.012 1.00 0.00 H new ATOM 0 HD2 ARG A 55 51.167 60.344 -31.608 1.00 0.00 H new ATOM 0 HD3 ARG A 55 49.710 60.366 -32.581 1.00 0.00 H new ATOM 0 HE ARG A 55 49.011 60.459 -29.783 1.00 0.00 H new ATOM 0 HH11 ARG A 55 50.511 62.593 -32.181 1.00 0.00 H new ATOM 0 HH12 ARG A 55 49.815 64.032 -31.429 1.00 0.00 H new ATOM 0 HH21 ARG A 55 48.102 62.273 -28.977 1.00 0.00 H new ATOM 0 HH22 ARG A 55 48.487 63.854 -29.664 1.00 0.00 H new ATOM 895 N GLN A 56 52.289 55.928 -28.349 1.00 0.00 N ATOM 896 CA GLN A 56 53.408 55.051 -27.978 1.00 0.00 C ATOM 897 C GLN A 56 52.973 53.574 -27.901 1.00 0.00 C ATOM 898 O GLN A 56 53.645 52.697 -28.448 1.00 0.00 O ATOM 899 CB GLN A 56 54.008 55.524 -26.643 1.00 0.00 C ATOM 900 CG GLN A 56 55.408 54.940 -26.367 1.00 0.00 C ATOM 901 CD GLN A 56 56.518 55.519 -27.239 1.00 0.00 C ATOM 902 OE1 GLN A 56 56.411 56.591 -27.837 1.00 0.00 O ATOM 903 NE2 GLN A 56 57.658 54.851 -27.326 1.00 0.00 N ATOM 0 H GLN A 56 52.071 56.636 -27.648 1.00 0.00 H new ATOM 0 HA GLN A 56 54.171 55.114 -28.754 1.00 0.00 H new ATOM 0 HB2 GLN A 56 54.069 56.612 -26.645 1.00 0.00 H new ATOM 0 HB3 GLN A 56 53.337 55.243 -25.831 1.00 0.00 H new ATOM 0 HG2 GLN A 56 55.659 55.111 -25.320 1.00 0.00 H new ATOM 0 HG3 GLN A 56 55.373 53.861 -26.514 1.00 0.00 H new ATOM 0 HE21 GLN A 56 57.767 53.962 -26.838 1.00 0.00 H new ATOM 0 HE22 GLN A 56 58.428 55.226 -27.881 1.00 0.00 H new ATOM 912 N LEU A 57 51.818 53.298 -27.286 1.00 0.00 N ATOM 913 CA LEU A 57 51.196 51.972 -27.269 1.00 0.00 C ATOM 914 C LEU A 57 50.793 51.492 -28.678 1.00 0.00 C ATOM 915 O LEU A 57 51.037 50.333 -29.014 1.00 0.00 O ATOM 916 CB LEU A 57 50.038 51.997 -26.248 1.00 0.00 C ATOM 917 CG LEU A 57 48.996 50.861 -26.381 1.00 0.00 C ATOM 918 CD1 LEU A 57 48.418 50.512 -25.006 1.00 0.00 C ATOM 919 CD2 LEU A 57 47.846 51.237 -27.331 1.00 0.00 C ATOM 0 H LEU A 57 51.282 54.002 -26.778 1.00 0.00 H new ATOM 0 HA LEU A 57 51.917 51.222 -26.944 1.00 0.00 H new ATOM 0 HB2 LEU A 57 50.463 51.959 -25.245 1.00 0.00 H new ATOM 0 HB3 LEU A 57 49.520 52.952 -26.339 1.00 0.00 H new ATOM 0 HG LEU A 57 49.514 49.999 -26.801 1.00 0.00 H new ATOM 0 HD11 LEU A 57 47.686 49.711 -25.112 1.00 0.00 H new ATOM 0 HD12 LEU A 57 49.221 50.184 -24.346 1.00 0.00 H new ATOM 0 HD13 LEU A 57 47.935 51.392 -24.580 1.00 0.00 H new ATOM 0 HD21 LEU A 57 47.140 50.409 -27.393 1.00 0.00 H new ATOM 0 HD22 LEU A 57 47.335 52.122 -26.952 1.00 0.00 H new ATOM 0 HD23 LEU A 57 48.247 51.446 -28.323 1.00 0.00 H new ATOM 931 N LEU A 58 50.215 52.357 -29.522 1.00 0.00 N ATOM 932 CA LEU A 58 49.828 52.009 -30.894 1.00 0.00 C ATOM 933 C LEU A 58 51.031 51.632 -31.782 1.00 0.00 C ATOM 934 O LEU A 58 50.920 50.718 -32.602 1.00 0.00 O ATOM 935 CB LEU A 58 48.996 53.137 -31.531 1.00 0.00 C ATOM 936 CG LEU A 58 47.556 53.274 -30.994 1.00 0.00 C ATOM 937 CD1 LEU A 58 46.863 54.419 -31.733 1.00 0.00 C ATOM 938 CD2 LEU A 58 46.721 52.008 -31.198 1.00 0.00 C ATOM 0 H LEU A 58 50.002 53.322 -29.270 1.00 0.00 H new ATOM 0 HA LEU A 58 49.208 51.115 -30.827 1.00 0.00 H new ATOM 0 HB2 LEU A 58 49.516 54.082 -31.376 1.00 0.00 H new ATOM 0 HB3 LEU A 58 48.951 52.970 -32.607 1.00 0.00 H new ATOM 0 HG LEU A 58 47.629 53.460 -29.922 1.00 0.00 H new ATOM 0 HD11 LEU A 58 45.843 54.527 -31.363 1.00 0.00 H new ATOM 0 HD12 LEU A 58 47.411 55.346 -31.563 1.00 0.00 H new ATOM 0 HD13 LEU A 58 46.840 54.202 -32.801 1.00 0.00 H new ATOM 0 HD21 LEU A 58 45.718 52.165 -30.800 1.00 0.00 H new ATOM 0 HD22 LEU A 58 46.658 51.781 -32.262 1.00 0.00 H new ATOM 0 HD23 LEU A 58 47.191 51.174 -30.677 1.00 0.00 H new ATOM 950 N ASP A 59 52.186 52.280 -31.597 1.00 0.00 N ATOM 951 CA ASP A 59 53.431 51.907 -32.284 1.00 0.00 C ATOM 952 C ASP A 59 53.919 50.495 -31.895 1.00 0.00 C ATOM 953 O ASP A 59 54.387 49.749 -32.758 1.00 0.00 O ATOM 954 CB ASP A 59 54.527 52.951 -32.017 1.00 0.00 C ATOM 955 CG ASP A 59 54.280 54.308 -32.707 1.00 0.00 C ATOM 956 OD1 ASP A 59 53.644 54.353 -33.791 1.00 0.00 O ATOM 957 OD2 ASP A 59 54.790 55.335 -32.195 1.00 0.00 O ATOM 0 H ASP A 59 52.286 53.077 -30.968 1.00 0.00 H new ATOM 0 HA ASP A 59 53.213 51.885 -33.352 1.00 0.00 H new ATOM 0 HB2 ASP A 59 54.608 53.111 -30.942 1.00 0.00 H new ATOM 0 HB3 ASP A 59 55.484 52.553 -32.353 1.00 0.00 H new ATOM 962 N THR A 60 53.760 50.084 -30.629 1.00 0.00 N ATOM 963 CA THR A 60 53.995 48.691 -30.193 1.00 0.00 C ATOM 964 C THR A 60 52.937 47.735 -30.753 1.00 0.00 C ATOM 965 O THR A 60 53.277 46.656 -31.239 1.00 0.00 O ATOM 966 CB THR A 60 54.037 48.602 -28.655 1.00 0.00 C ATOM 967 OG1 THR A 60 55.062 49.445 -28.168 1.00 0.00 O ATOM 968 CG2 THR A 60 54.343 47.191 -28.144 1.00 0.00 C ATOM 0 H THR A 60 53.465 50.704 -29.875 1.00 0.00 H new ATOM 0 HA THR A 60 54.963 48.385 -30.590 1.00 0.00 H new ATOM 0 HB THR A 60 53.048 48.896 -28.303 1.00 0.00 H new ATOM 0 HG1 THR A 60 55.091 49.393 -27.190 1.00 0.00 H new ATOM 0 HG21 THR A 60 54.359 47.194 -27.054 1.00 0.00 H new ATOM 0 HG22 THR A 60 53.574 46.503 -28.494 1.00 0.00 H new ATOM 0 HG23 THR A 60 55.315 46.871 -28.520 1.00 0.00 H new ATOM 976 N THR A 61 51.663 48.137 -30.758 1.00 0.00 N ATOM 977 CA THR A 61 50.540 47.370 -31.322 1.00 0.00 C ATOM 978 C THR A 61 50.747 46.988 -32.798 1.00 0.00 C ATOM 979 O THR A 61 50.381 45.883 -33.207 1.00 0.00 O ATOM 980 CB THR A 61 49.220 48.134 -31.088 1.00 0.00 C ATOM 981 OG1 THR A 61 48.494 47.490 -30.077 1.00 0.00 O ATOM 982 CG2 THR A 61 48.258 48.258 -32.267 1.00 0.00 C ATOM 0 H THR A 61 51.372 49.030 -30.359 1.00 0.00 H new ATOM 0 HA THR A 61 50.488 46.417 -30.795 1.00 0.00 H new ATOM 0 HB THR A 61 49.558 49.143 -30.854 1.00 0.00 H new ATOM 0 HG1 THR A 61 49.101 47.233 -29.352 1.00 0.00 H new ATOM 0 HG21 THR A 61 47.375 48.818 -31.959 1.00 0.00 H new ATOM 0 HG22 THR A 61 48.752 48.781 -33.086 1.00 0.00 H new ATOM 0 HG23 THR A 61 47.960 47.264 -32.599 1.00 0.00 H new ATOM 990 N ASP A 62 51.400 47.842 -33.601 1.00 0.00 N ATOM 991 CA ASP A 62 51.753 47.539 -35.000 1.00 0.00 C ATOM 992 C ASP A 62 52.671 46.301 -35.139 1.00 0.00 C ATOM 993 O ASP A 62 52.544 45.541 -36.103 1.00 0.00 O ATOM 994 CB ASP A 62 52.400 48.774 -35.635 1.00 0.00 C ATOM 995 CG ASP A 62 52.612 48.587 -37.149 1.00 0.00 C ATOM 996 OD1 ASP A 62 51.615 48.586 -37.898 1.00 0.00 O ATOM 997 OD2 ASP A 62 53.787 48.463 -37.578 1.00 0.00 O ATOM 0 H ASP A 62 51.701 48.768 -33.298 1.00 0.00 H new ATOM 0 HA ASP A 62 50.833 47.288 -35.527 1.00 0.00 H new ATOM 0 HB2 ASP A 62 51.770 49.646 -35.460 1.00 0.00 H new ATOM 0 HB3 ASP A 62 53.358 48.971 -35.154 1.00 0.00 H new ATOM 1002 N ILE A 63 53.550 46.057 -34.157 1.00 0.00 N ATOM 1003 CA ILE A 63 54.433 44.877 -34.084 1.00 0.00 C ATOM 1004 C ILE A 63 53.636 43.629 -33.661 1.00 0.00 C ATOM 1005 O ILE A 63 53.850 42.534 -34.185 1.00 0.00 O ATOM 1006 CB ILE A 63 55.592 45.129 -33.078 1.00 0.00 C ATOM 1007 CG1 ILE A 63 56.315 46.475 -33.334 1.00 0.00 C ATOM 1008 CG2 ILE A 63 56.602 43.963 -33.123 1.00 0.00 C ATOM 1009 CD1 ILE A 63 57.359 46.844 -32.270 1.00 0.00 C ATOM 0 H ILE A 63 53.672 46.691 -33.368 1.00 0.00 H new ATOM 0 HA ILE A 63 54.854 44.705 -35.075 1.00 0.00 H new ATOM 0 HB ILE A 63 55.148 45.187 -32.084 1.00 0.00 H new ATOM 0 HG12 ILE A 63 56.805 46.432 -34.307 1.00 0.00 H new ATOM 0 HG13 ILE A 63 55.571 47.270 -33.387 1.00 0.00 H new ATOM 0 HG21 ILE A 63 57.408 44.152 -32.414 1.00 0.00 H new ATOM 0 HG22 ILE A 63 56.097 43.034 -32.859 1.00 0.00 H new ATOM 0 HG23 ILE A 63 57.015 43.878 -34.128 1.00 0.00 H new ATOM 0 HD11 ILE A 63 57.817 47.799 -32.526 1.00 0.00 H new ATOM 0 HD12 ILE A 63 56.874 46.923 -31.297 1.00 0.00 H new ATOM 0 HD13 ILE A 63 58.128 46.072 -32.231 1.00 0.00 H new ATOM 1021 N GLN A 64 52.712 43.803 -32.709 1.00 0.00 N ATOM 1022 CA GLN A 64 51.968 42.720 -32.045 1.00 0.00 C ATOM 1023 C GLN A 64 50.921 42.029 -32.941 1.00 0.00 C ATOM 1024 O GLN A 64 50.632 40.840 -32.732 1.00 0.00 O ATOM 1025 CB GLN A 64 51.261 43.308 -30.817 1.00 0.00 C ATOM 1026 CG GLN A 64 52.249 43.766 -29.730 1.00 0.00 C ATOM 1027 CD GLN A 64 52.846 42.622 -28.905 1.00 0.00 C ATOM 1028 OE1 GLN A 64 52.441 41.465 -28.960 1.00 0.00 O ATOM 1029 NE2 GLN A 64 53.852 42.907 -28.098 1.00 0.00 N ATOM 0 H GLN A 64 52.452 44.728 -32.367 1.00 0.00 H new ATOM 0 HA GLN A 64 52.695 41.952 -31.780 1.00 0.00 H new ATOM 0 HB2 GLN A 64 50.648 44.155 -31.126 1.00 0.00 H new ATOM 0 HB3 GLN A 64 50.586 42.561 -30.398 1.00 0.00 H new ATOM 0 HG2 GLN A 64 53.060 44.321 -30.202 1.00 0.00 H new ATOM 0 HG3 GLN A 64 51.739 44.456 -29.058 1.00 0.00 H new ATOM 0 HE21 GLN A 64 54.203 43.863 -28.038 1.00 0.00 H new ATOM 0 HE22 GLN A 64 54.278 42.171 -27.535 1.00 0.00 H new ATOM 1038 N GLY A 65 50.362 42.755 -33.919 1.00 0.00 N ATOM 1039 CA GLY A 65 49.303 42.215 -34.784 1.00 0.00 C ATOM 1040 C GLY A 65 47.924 42.173 -34.086 1.00 0.00 C ATOM 1041 O GLY A 65 47.642 42.920 -33.132 1.00 0.00 O ATOM 0 H GLY A 65 50.625 43.717 -34.131 1.00 0.00 H new ATOM 0 HA2 GLY A 65 49.231 42.824 -35.685 1.00 0.00 H new ATOM 0 HA3 GLY A 65 49.576 41.208 -35.100 1.00 0.00 H new ATOM 1045 N GLU A 66 47.067 41.299 -34.630 1.00 0.00 N ATOM 1046 CA GLU A 66 45.629 41.195 -34.311 1.00 0.00 C ATOM 1047 C GLU A 66 45.346 40.532 -32.938 1.00 0.00 C ATOM 1048 O GLU A 66 44.561 39.599 -32.831 1.00 0.00 O ATOM 1049 CB GLU A 66 44.927 40.506 -35.501 1.00 0.00 C ATOM 1050 CG GLU A 66 43.461 40.926 -35.701 1.00 0.00 C ATOM 1051 CD GLU A 66 43.199 41.444 -37.134 1.00 0.00 C ATOM 1052 OE1 GLU A 66 43.093 40.596 -38.064 1.00 0.00 O ATOM 1053 OE2 GLU A 66 43.105 42.683 -37.317 1.00 0.00 O ATOM 0 H GLU A 66 47.362 40.619 -35.330 1.00 0.00 H new ATOM 0 HA GLU A 66 45.211 42.194 -34.185 1.00 0.00 H new ATOM 0 HB2 GLU A 66 45.483 40.726 -36.412 1.00 0.00 H new ATOM 0 HB3 GLU A 66 44.967 39.426 -35.356 1.00 0.00 H new ATOM 0 HG2 GLU A 66 42.809 40.076 -35.497 1.00 0.00 H new ATOM 0 HG3 GLU A 66 43.205 41.704 -34.982 1.00 0.00 H new ATOM 1060 N GLU A 67 45.998 40.993 -31.858 1.00 0.00 N ATOM 1061 CA GLU A 67 45.763 40.567 -30.462 1.00 0.00 C ATOM 1062 C GLU A 67 45.756 41.768 -29.496 1.00 0.00 C ATOM 1063 O GLU A 67 44.743 42.076 -28.866 1.00 0.00 O ATOM 1064 CB GLU A 67 46.846 39.566 -29.998 1.00 0.00 C ATOM 1065 CG GLU A 67 46.776 38.175 -30.647 1.00 0.00 C ATOM 1066 CD GLU A 67 45.465 37.407 -30.355 1.00 0.00 C ATOM 1067 OE1 GLU A 67 44.807 37.659 -29.318 1.00 0.00 O ATOM 1068 OE2 GLU A 67 45.100 36.515 -31.162 1.00 0.00 O ATOM 0 H GLU A 67 46.731 41.699 -31.932 1.00 0.00 H new ATOM 0 HA GLU A 67 44.785 40.087 -30.442 1.00 0.00 H new ATOM 0 HB2 GLU A 67 47.826 39.996 -30.204 1.00 0.00 H new ATOM 0 HB3 GLU A 67 46.770 39.449 -28.917 1.00 0.00 H new ATOM 0 HG2 GLU A 67 46.889 38.283 -31.726 1.00 0.00 H new ATOM 0 HG3 GLU A 67 47.619 37.580 -30.297 1.00 0.00 H new ATOM 1075 N PHE A 68 46.880 42.507 -29.456 1.00 0.00 N ATOM 1076 CA PHE A 68 47.034 43.717 -28.638 1.00 0.00 C ATOM 1077 C PHE A 68 46.044 44.810 -29.105 1.00 0.00 C ATOM 1078 O PHE A 68 45.325 45.381 -28.293 1.00 0.00 O ATOM 1079 CB PHE A 68 48.502 44.156 -28.738 1.00 0.00 C ATOM 1080 CG PHE A 68 49.071 44.990 -27.608 1.00 0.00 C ATOM 1081 CD1 PHE A 68 48.531 46.246 -27.277 1.00 0.00 C ATOM 1082 CD2 PHE A 68 50.230 44.547 -26.940 1.00 0.00 C ATOM 1083 CE1 PHE A 68 49.173 47.065 -26.338 1.00 0.00 C ATOM 1084 CE2 PHE A 68 50.887 45.372 -26.022 1.00 0.00 C ATOM 1085 CZ PHE A 68 50.369 46.647 -25.725 1.00 0.00 C ATOM 0 H PHE A 68 47.713 42.276 -29.997 1.00 0.00 H new ATOM 0 HA PHE A 68 46.795 43.526 -27.592 1.00 0.00 H new ATOM 0 HB2 PHE A 68 49.114 43.259 -28.832 1.00 0.00 H new ATOM 0 HB3 PHE A 68 48.620 44.721 -29.663 1.00 0.00 H new ATOM 0 HD1 PHE A 68 47.619 46.580 -27.748 1.00 0.00 H new ATOM 0 HD2 PHE A 68 50.616 43.558 -27.140 1.00 0.00 H new ATOM 0 HE1 PHE A 68 48.747 48.024 -26.083 1.00 0.00 H new ATOM 0 HE2 PHE A 68 51.792 45.031 -25.541 1.00 0.00 H new ATOM 0 HZ PHE A 68 50.884 47.298 -25.034 1.00 0.00 H new ATOM 1095 N ALA A 69 45.920 44.991 -30.426 1.00 0.00 N ATOM 1096 CA ALA A 69 44.896 45.851 -31.038 1.00 0.00 C ATOM 1097 C ALA A 69 43.466 45.429 -30.658 1.00 0.00 C ATOM 1098 O ALA A 69 42.630 46.279 -30.349 1.00 0.00 O ATOM 1099 CB ALA A 69 45.084 45.832 -32.560 1.00 0.00 C ATOM 0 H ALA A 69 46.532 44.541 -31.107 1.00 0.00 H new ATOM 0 HA ALA A 69 45.024 46.864 -30.655 1.00 0.00 H new ATOM 0 HB1 ALA A 69 44.331 46.466 -33.028 1.00 0.00 H new ATOM 0 HB2 ALA A 69 46.078 46.205 -32.809 1.00 0.00 H new ATOM 0 HB3 ALA A 69 44.978 44.811 -32.927 1.00 0.00 H new ATOM 1105 N LYS A 70 43.172 44.114 -30.633 1.00 0.00 N ATOM 1106 CA LYS A 70 41.840 43.610 -30.257 1.00 0.00 C ATOM 1107 C LYS A 70 41.493 43.911 -28.798 1.00 0.00 C ATOM 1108 O LYS A 70 40.341 44.252 -28.532 1.00 0.00 O ATOM 1109 CB LYS A 70 41.674 42.108 -30.567 1.00 0.00 C ATOM 1110 CG LYS A 70 41.840 41.823 -32.070 1.00 0.00 C ATOM 1111 CD LYS A 70 41.215 40.493 -32.529 1.00 0.00 C ATOM 1112 CE LYS A 70 41.652 39.275 -31.704 1.00 0.00 C ATOM 1113 NZ LYS A 70 42.218 38.197 -32.560 1.00 0.00 N ATOM 0 H LYS A 70 43.842 43.382 -30.870 1.00 0.00 H new ATOM 0 HA LYS A 70 41.128 44.153 -30.879 1.00 0.00 H new ATOM 0 HB2 LYS A 70 42.410 41.535 -30.003 1.00 0.00 H new ATOM 0 HB3 LYS A 70 40.690 41.774 -30.238 1.00 0.00 H new ATOM 0 HG2 LYS A 70 41.389 42.638 -32.636 1.00 0.00 H new ATOM 0 HG3 LYS A 70 42.903 41.816 -32.313 1.00 0.00 H new ATOM 0 HD2 LYS A 70 40.129 40.579 -32.482 1.00 0.00 H new ATOM 0 HD3 LYS A 70 41.476 40.323 -33.573 1.00 0.00 H new ATOM 0 HE2 LYS A 70 42.396 39.583 -30.969 1.00 0.00 H new ATOM 0 HE3 LYS A 70 40.798 38.887 -31.150 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 42.296 37.320 -32.007 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 41.593 38.038 -33.376 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 43.161 38.479 -32.896 1.00 0.00 H new ATOM 1127 N VAL A 71 42.459 43.864 -27.861 1.00 0.00 N ATOM 1128 CA VAL A 71 42.169 44.240 -26.466 1.00 0.00 C ATOM 1129 C VAL A 71 41.780 45.715 -26.323 1.00 0.00 C ATOM 1130 O VAL A 71 40.905 46.005 -25.518 1.00 0.00 O ATOM 1131 CB VAL A 71 43.276 43.839 -25.464 1.00 0.00 C ATOM 1132 CG1 VAL A 71 44.134 45.002 -24.946 1.00 0.00 C ATOM 1133 CG2 VAL A 71 42.632 43.179 -24.236 1.00 0.00 C ATOM 0 H VAL A 71 43.422 43.577 -28.038 1.00 0.00 H new ATOM 0 HA VAL A 71 41.296 43.646 -26.194 1.00 0.00 H new ATOM 0 HB VAL A 71 43.933 43.170 -26.021 1.00 0.00 H new ATOM 0 HG11 VAL A 71 44.881 44.621 -24.250 1.00 0.00 H new ATOM 0 HG12 VAL A 71 44.633 45.488 -25.785 1.00 0.00 H new ATOM 0 HG13 VAL A 71 43.497 45.724 -24.435 1.00 0.00 H new ATOM 0 HG21 VAL A 71 43.409 42.894 -23.526 1.00 0.00 H new ATOM 0 HG22 VAL A 71 41.948 43.882 -23.762 1.00 0.00 H new ATOM 0 HG23 VAL A 71 42.082 42.291 -24.547 1.00 0.00 H new ATOM 1143 N ILE A 72 42.374 46.632 -27.102 1.00 0.00 N ATOM 1144 CA ILE A 72 41.995 48.060 -27.094 1.00 0.00 C ATOM 1145 C ILE A 72 40.491 48.194 -27.384 1.00 0.00 C ATOM 1146 O ILE A 72 39.757 48.864 -26.660 1.00 0.00 O ATOM 1147 CB ILE A 72 42.834 48.870 -28.118 1.00 0.00 C ATOM 1148 CG1 ILE A 72 44.349 48.775 -27.819 1.00 0.00 C ATOM 1149 CG2 ILE A 72 42.421 50.353 -28.151 1.00 0.00 C ATOM 1150 CD1 ILE A 72 45.234 49.376 -28.921 1.00 0.00 C ATOM 0 H ILE A 72 43.127 46.410 -27.753 1.00 0.00 H new ATOM 0 HA ILE A 72 42.204 48.473 -26.107 1.00 0.00 H new ATOM 0 HB ILE A 72 42.634 48.425 -29.093 1.00 0.00 H new ATOM 0 HG12 ILE A 72 44.558 49.286 -26.879 1.00 0.00 H new ATOM 0 HG13 ILE A 72 44.618 47.728 -27.680 1.00 0.00 H new ATOM 0 HG21 ILE A 72 43.032 50.885 -28.880 1.00 0.00 H new ATOM 0 HG22 ILE A 72 41.371 50.432 -28.431 1.00 0.00 H new ATOM 0 HG23 ILE A 72 42.567 50.794 -27.165 1.00 0.00 H new ATOM 0 HD11 ILE A 72 46.283 49.273 -28.642 1.00 0.00 H new ATOM 0 HD12 ILE A 72 45.055 48.850 -29.859 1.00 0.00 H new ATOM 0 HD13 ILE A 72 44.993 50.432 -29.045 1.00 0.00 H new ATOM 1162 N VAL A 73 40.023 47.495 -28.421 1.00 0.00 N ATOM 1163 CA VAL A 73 38.629 47.554 -28.881 1.00 0.00 C ATOM 1164 C VAL A 73 37.669 46.756 -27.983 1.00 0.00 C ATOM 1165 O VAL A 73 36.567 47.227 -27.699 1.00 0.00 O ATOM 1166 CB VAL A 73 38.537 47.105 -30.349 1.00 0.00 C ATOM 1167 CG1 VAL A 73 37.142 47.402 -30.893 1.00 0.00 C ATOM 1168 CG2 VAL A 73 39.544 47.840 -31.248 1.00 0.00 C ATOM 0 H VAL A 73 40.606 46.865 -28.972 1.00 0.00 H new ATOM 0 HA VAL A 73 38.306 48.593 -28.811 1.00 0.00 H new ATOM 0 HB VAL A 73 38.757 46.038 -30.364 1.00 0.00 H new ATOM 0 HG11 VAL A 73 37.081 47.082 -31.933 1.00 0.00 H new ATOM 0 HG12 VAL A 73 36.400 46.863 -30.304 1.00 0.00 H new ATOM 0 HG13 VAL A 73 36.947 48.473 -30.831 1.00 0.00 H new ATOM 0 HG21 VAL A 73 39.440 47.488 -32.274 1.00 0.00 H new ATOM 0 HG22 VAL A 73 39.350 48.912 -31.210 1.00 0.00 H new ATOM 0 HG23 VAL A 73 40.557 47.642 -30.898 1.00 0.00 H new ATOM 1178 N GLN A 74 38.077 45.590 -27.462 1.00 0.00 N ATOM 1179 CA GLN A 74 37.302 44.861 -26.446 1.00 0.00 C ATOM 1180 C GLN A 74 37.163 45.666 -25.148 1.00 0.00 C ATOM 1181 O GLN A 74 36.058 45.779 -24.622 1.00 0.00 O ATOM 1182 CB GLN A 74 37.927 43.483 -26.152 1.00 0.00 C ATOM 1183 CG GLN A 74 37.294 42.342 -26.972 1.00 0.00 C ATOM 1184 CD GLN A 74 36.671 41.268 -26.081 1.00 0.00 C ATOM 1185 OE1 GLN A 74 37.229 40.208 -25.845 1.00 0.00 O ATOM 1186 NE2 GLN A 74 35.489 41.503 -25.538 1.00 0.00 N ATOM 0 H GLN A 74 38.946 45.128 -27.730 1.00 0.00 H new ATOM 0 HA GLN A 74 36.304 44.711 -26.857 1.00 0.00 H new ATOM 0 HB2 GLN A 74 38.996 43.524 -26.363 1.00 0.00 H new ATOM 0 HB3 GLN A 74 37.820 43.262 -25.090 1.00 0.00 H new ATOM 0 HG2 GLN A 74 36.530 42.752 -27.632 1.00 0.00 H new ATOM 0 HG3 GLN A 74 38.055 41.888 -27.608 1.00 0.00 H new ATOM 0 HE21 GLN A 74 35.008 42.383 -25.724 1.00 0.00 H new ATOM 0 HE22 GLN A 74 35.058 40.804 -24.933 1.00 0.00 H new ATOM 1195 N LYS A 75 38.250 46.281 -24.657 1.00 0.00 N ATOM 1196 CA LYS A 75 38.232 47.147 -23.469 1.00 0.00 C ATOM 1197 C LYS A 75 37.321 48.360 -23.664 1.00 0.00 C ATOM 1198 O LYS A 75 36.630 48.750 -22.725 1.00 0.00 O ATOM 1199 CB LYS A 75 39.674 47.551 -23.098 1.00 0.00 C ATOM 1200 CG LYS A 75 39.800 48.387 -21.811 1.00 0.00 C ATOM 1201 CD LYS A 75 39.202 47.735 -20.551 1.00 0.00 C ATOM 1202 CE LYS A 75 39.940 46.445 -20.163 1.00 0.00 C ATOM 1203 NZ LYS A 75 39.442 45.901 -18.872 1.00 0.00 N ATOM 0 H LYS A 75 39.175 46.190 -25.078 1.00 0.00 H new ATOM 0 HA LYS A 75 37.810 46.587 -22.634 1.00 0.00 H new ATOM 0 HB2 LYS A 75 40.272 46.647 -22.987 1.00 0.00 H new ATOM 0 HB3 LYS A 75 40.102 48.117 -23.925 1.00 0.00 H new ATOM 0 HG2 LYS A 75 40.855 48.591 -21.630 1.00 0.00 H new ATOM 0 HG3 LYS A 75 39.312 49.348 -21.971 1.00 0.00 H new ATOM 0 HD2 LYS A 75 39.247 48.441 -19.722 1.00 0.00 H new ATOM 0 HD3 LYS A 75 38.149 47.512 -20.724 1.00 0.00 H new ATOM 0 HE2 LYS A 75 39.810 45.700 -20.948 1.00 0.00 H new ATOM 0 HE3 LYS A 75 41.009 46.645 -20.087 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 39.995 45.059 -18.614 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 39.542 46.622 -18.130 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 38.440 45.641 -18.969 1.00 0.00 H new ATOM 1217 N LEU A 76 37.256 48.920 -24.872 1.00 0.00 N ATOM 1218 CA LEU A 76 36.284 49.956 -25.236 1.00 0.00 C ATOM 1219 C LEU A 76 34.827 49.458 -25.185 1.00 0.00 C ATOM 1220 O LEU A 76 33.985 50.120 -24.573 1.00 0.00 O ATOM 1221 CB LEU A 76 36.640 50.502 -26.628 1.00 0.00 C ATOM 1222 CG LEU A 76 37.737 51.577 -26.583 1.00 0.00 C ATOM 1223 CD1 LEU A 76 38.195 51.884 -28.005 1.00 0.00 C ATOM 1224 CD2 LEU A 76 37.197 52.844 -25.903 1.00 0.00 C ATOM 0 H LEU A 76 37.883 48.666 -25.635 1.00 0.00 H new ATOM 0 HA LEU A 76 36.345 50.755 -24.497 1.00 0.00 H new ATOM 0 HB2 LEU A 76 36.970 49.679 -27.263 1.00 0.00 H new ATOM 0 HB3 LEU A 76 35.745 50.921 -27.089 1.00 0.00 H new ATOM 0 HG LEU A 76 38.588 51.214 -26.006 1.00 0.00 H new ATOM 0 HD11 LEU A 76 38.974 52.646 -27.980 1.00 0.00 H new ATOM 0 HD12 LEU A 76 38.589 50.977 -28.464 1.00 0.00 H new ATOM 0 HD13 LEU A 76 37.350 52.248 -28.589 1.00 0.00 H new ATOM 0 HD21 LEU A 76 37.979 53.603 -25.874 1.00 0.00 H new ATOM 0 HD22 LEU A 76 36.344 53.223 -26.466 1.00 0.00 H new ATOM 0 HD23 LEU A 76 36.884 52.606 -24.886 1.00 0.00 H new ATOM 1236 N LYS A 77 34.535 48.282 -25.756 1.00 0.00 N ATOM 1237 CA LYS A 77 33.211 47.640 -25.659 1.00 0.00 C ATOM 1238 C LYS A 77 32.800 47.331 -24.207 1.00 0.00 C ATOM 1239 O LYS A 77 31.655 47.588 -23.832 1.00 0.00 O ATOM 1240 CB LYS A 77 33.147 46.398 -26.580 1.00 0.00 C ATOM 1241 CG LYS A 77 32.205 46.671 -27.768 1.00 0.00 C ATOM 1242 CD LYS A 77 32.141 45.548 -28.819 1.00 0.00 C ATOM 1243 CE LYS A 77 33.393 45.512 -29.713 1.00 0.00 C ATOM 1244 NZ LYS A 77 33.186 44.605 -30.882 1.00 0.00 N ATOM 0 H LYS A 77 35.210 47.745 -26.300 1.00 0.00 H new ATOM 0 HA LYS A 77 32.469 48.355 -26.014 1.00 0.00 H new ATOM 0 HB2 LYS A 77 34.145 46.154 -26.945 1.00 0.00 H new ATOM 0 HB3 LYS A 77 32.794 45.535 -26.016 1.00 0.00 H new ATOM 0 HG2 LYS A 77 31.200 46.845 -27.383 1.00 0.00 H new ATOM 0 HG3 LYS A 77 32.522 47.591 -28.260 1.00 0.00 H new ATOM 0 HD2 LYS A 77 32.029 44.588 -28.315 1.00 0.00 H new ATOM 0 HD3 LYS A 77 31.257 45.686 -29.441 1.00 0.00 H new ATOM 0 HE2 LYS A 77 33.623 46.518 -30.064 1.00 0.00 H new ATOM 0 HE3 LYS A 77 34.251 45.173 -29.132 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 34.043 44.596 -31.471 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 32.989 43.642 -30.543 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 32.381 44.945 -31.447 1.00 0.00 H new ATOM 1258 N ASP A 78 33.731 46.853 -23.375 1.00 0.00 N ATOM 1259 CA ASP A 78 33.518 46.637 -21.931 1.00 0.00 C ATOM 1260 C ASP A 78 33.369 47.941 -21.120 1.00 0.00 C ATOM 1261 O ASP A 78 32.638 47.962 -20.125 1.00 0.00 O ATOM 1262 CB ASP A 78 34.660 45.782 -21.355 1.00 0.00 C ATOM 1263 CG ASP A 78 34.386 44.274 -21.512 1.00 0.00 C ATOM 1264 OD1 ASP A 78 33.444 43.765 -20.853 1.00 0.00 O ATOM 1265 OD2 ASP A 78 35.126 43.586 -22.256 1.00 0.00 O ATOM 0 H ASP A 78 34.669 46.600 -23.685 1.00 0.00 H new ATOM 0 HA ASP A 78 32.567 46.112 -21.836 1.00 0.00 H new ATOM 0 HB2 ASP A 78 35.593 46.036 -21.859 1.00 0.00 H new ATOM 0 HB3 ASP A 78 34.793 46.019 -20.299 1.00 0.00 H new ATOM 1270 N ASN A 79 34.005 49.045 -21.542 1.00 0.00 N ATOM 1271 CA ASN A 79 33.833 50.374 -20.931 1.00 0.00 C ATOM 1272 C ASN A 79 32.423 50.975 -21.123 1.00 0.00 C ATOM 1273 O ASN A 79 32.079 51.927 -20.416 1.00 0.00 O ATOM 1274 CB ASN A 79 34.915 51.346 -21.457 1.00 0.00 C ATOM 1275 CG ASN A 79 36.086 51.466 -20.503 1.00 0.00 C ATOM 1276 OD1 ASN A 79 36.102 52.281 -19.592 1.00 0.00 O ATOM 1277 ND2 ASN A 79 37.110 50.658 -20.677 1.00 0.00 N ATOM 0 H ASN A 79 34.659 49.041 -22.324 1.00 0.00 H new ATOM 0 HA ASN A 79 33.951 50.233 -19.857 1.00 0.00 H new ATOM 0 HB2 ASN A 79 35.272 51.000 -22.427 1.00 0.00 H new ATOM 0 HB3 ASN A 79 34.473 52.330 -21.613 1.00 0.00 H new ATOM 0 HD21 ASN A 79 37.915 50.713 -20.052 1.00 0.00 H new ATOM 0 HD22 ASN A 79 37.099 49.977 -21.436 1.00 0.00 H new ATOM 1284 N LYS A 80 31.619 50.441 -22.070 1.00 0.00 N ATOM 1285 CA LYS A 80 30.249 50.919 -22.393 1.00 0.00 C ATOM 1286 C LYS A 80 30.138 52.434 -22.692 1.00 0.00 C ATOM 1287 O LYS A 80 29.064 53.034 -22.540 1.00 0.00 O ATOM 1288 CB LYS A 80 29.281 50.424 -21.288 1.00 0.00 C ATOM 1289 CG LYS A 80 28.836 48.963 -21.495 1.00 0.00 C ATOM 1290 CD LYS A 80 27.393 48.846 -22.019 1.00 0.00 C ATOM 1291 CE LYS A 80 27.176 49.566 -23.358 1.00 0.00 C ATOM 1292 NZ LYS A 80 25.744 49.526 -23.765 1.00 0.00 N ATOM 0 H LYS A 80 31.907 49.649 -22.645 1.00 0.00 H new ATOM 0 HA LYS A 80 29.957 50.482 -23.348 1.00 0.00 H new ATOM 0 HB2 LYS A 80 29.767 50.517 -20.317 1.00 0.00 H new ATOM 0 HB3 LYS A 80 28.401 51.067 -21.267 1.00 0.00 H new ATOM 0 HG2 LYS A 80 29.513 48.478 -22.198 1.00 0.00 H new ATOM 0 HG3 LYS A 80 28.919 48.426 -20.550 1.00 0.00 H new ATOM 0 HD2 LYS A 80 27.140 47.792 -22.135 1.00 0.00 H new ATOM 0 HD3 LYS A 80 26.709 49.258 -21.277 1.00 0.00 H new ATOM 0 HE2 LYS A 80 27.504 50.602 -23.274 1.00 0.00 H new ATOM 0 HE3 LYS A 80 27.789 49.099 -24.129 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 25.627 50.020 -24.673 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 25.440 48.537 -23.867 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 25.164 49.993 -23.039 1.00 0.00 H new ATOM 1306 N GLN A 81 31.252 53.040 -23.140 1.00 0.00 N ATOM 1307 CA GLN A 81 31.324 54.489 -23.407 1.00 0.00 C ATOM 1308 C GLN A 81 30.595 54.955 -24.689 1.00 0.00 C ATOM 1309 O GLN A 81 30.279 56.140 -24.827 1.00 0.00 O ATOM 1310 CB GLN A 81 32.796 54.925 -23.429 1.00 0.00 C ATOM 1311 CG GLN A 81 33.659 54.264 -24.526 1.00 0.00 C ATOM 1312 CD GLN A 81 34.639 55.281 -25.088 1.00 0.00 C ATOM 1313 OE1 GLN A 81 34.387 55.897 -26.120 1.00 0.00 O ATOM 1314 NE2 GLN A 81 35.733 55.535 -24.396 1.00 0.00 N ATOM 0 H GLN A 81 32.123 52.543 -23.326 1.00 0.00 H new ATOM 0 HA GLN A 81 30.786 54.976 -22.594 1.00 0.00 H new ATOM 0 HB2 GLN A 81 32.837 56.006 -23.559 1.00 0.00 H new ATOM 0 HB3 GLN A 81 33.239 54.704 -22.458 1.00 0.00 H new ATOM 0 HG2 GLN A 81 34.200 53.413 -24.113 1.00 0.00 H new ATOM 0 HG3 GLN A 81 33.021 53.880 -25.322 1.00 0.00 H new ATOM 0 HE21 GLN A 81 35.928 55.014 -23.541 1.00 0.00 H new ATOM 0 HE22 GLN A 81 36.384 56.252 -24.716 1.00 0.00 H new ATOM 1323 N MET A 82 30.317 54.024 -25.619 1.00 0.00 N ATOM 1324 CA MET A 82 29.551 54.224 -26.872 1.00 0.00 C ATOM 1325 C MET A 82 30.088 55.296 -27.855 1.00 0.00 C ATOM 1326 O MET A 82 29.422 55.612 -28.845 1.00 0.00 O ATOM 1327 CB MET A 82 28.053 54.435 -26.549 1.00 0.00 C ATOM 1328 CG MET A 82 27.400 53.330 -25.695 1.00 0.00 C ATOM 1329 SD MET A 82 26.825 51.824 -26.552 1.00 0.00 S ATOM 1330 CE MET A 82 28.361 50.894 -26.821 1.00 0.00 C ATOM 0 H MET A 82 30.635 53.060 -25.516 1.00 0.00 H new ATOM 0 HA MET A 82 29.691 53.300 -27.432 1.00 0.00 H new ATOM 0 HB2 MET A 82 27.941 55.387 -26.029 1.00 0.00 H new ATOM 0 HB3 MET A 82 27.504 54.518 -27.487 1.00 0.00 H new ATOM 0 HG2 MET A 82 28.117 53.028 -24.931 1.00 0.00 H new ATOM 0 HG3 MET A 82 26.547 53.767 -25.176 1.00 0.00 H new ATOM 0 HE1 MET A 82 28.144 49.826 -26.820 1.00 0.00 H new ATOM 0 HE2 MET A 82 28.794 51.176 -27.781 1.00 0.00 H new ATOM 0 HE3 MET A 82 29.068 51.121 -26.024 1.00 0.00 H new ATOM 1340 N GLY A 83 31.301 55.826 -27.643 1.00 0.00 N ATOM 1341 CA GLY A 83 31.907 56.859 -28.500 1.00 0.00 C ATOM 1342 C GLY A 83 32.307 56.395 -29.913 1.00 0.00 C ATOM 1343 O GLY A 83 32.594 57.230 -30.770 1.00 0.00 O ATOM 0 H GLY A 83 31.897 55.547 -26.863 1.00 0.00 H new ATOM 0 HA2 GLY A 83 31.205 57.687 -28.593 1.00 0.00 H new ATOM 0 HA3 GLY A 83 32.794 57.248 -27.999 1.00 0.00 H new ATOM 1347 N LEU A 84 32.318 55.076 -30.161 1.00 0.00 N ATOM 1348 CA LEU A 84 32.848 54.437 -31.378 1.00 0.00 C ATOM 1349 C LEU A 84 31.878 53.373 -31.950 1.00 0.00 C ATOM 1350 O LEU A 84 32.304 52.355 -32.492 1.00 0.00 O ATOM 1351 CB LEU A 84 34.292 53.902 -31.169 1.00 0.00 C ATOM 1352 CG LEU A 84 35.108 54.424 -29.966 1.00 0.00 C ATOM 1353 CD1 LEU A 84 34.812 53.588 -28.720 1.00 0.00 C ATOM 1354 CD2 LEU A 84 36.612 54.357 -30.234 1.00 0.00 C ATOM 0 H LEU A 84 31.944 54.399 -29.495 1.00 0.00 H new ATOM 0 HA LEU A 84 32.921 55.210 -32.143 1.00 0.00 H new ATOM 0 HB2 LEU A 84 34.234 52.817 -31.083 1.00 0.00 H new ATOM 0 HB3 LEU A 84 34.860 54.120 -32.074 1.00 0.00 H new ATOM 0 HG LEU A 84 34.815 55.462 -29.810 1.00 0.00 H new ATOM 0 HD11 LEU A 84 35.394 53.968 -27.880 1.00 0.00 H new ATOM 0 HD12 LEU A 84 33.750 53.651 -28.483 1.00 0.00 H new ATOM 0 HD13 LEU A 84 35.081 52.548 -28.907 1.00 0.00 H new ATOM 0 HD21 LEU A 84 37.153 54.732 -29.366 1.00 0.00 H new ATOM 0 HD22 LEU A 84 36.902 53.324 -30.424 1.00 0.00 H new ATOM 0 HD23 LEU A 84 36.854 54.967 -31.104 1.00 0.00 H new ATOM 1366 N GLN A 85 30.565 53.633 -31.824 1.00 0.00 N ATOM 1367 CA GLN A 85 29.431 52.817 -32.314 1.00 0.00 C ATOM 1368 C GLN A 85 29.682 51.924 -33.557 1.00 0.00 C ATOM 1369 O GLN A 85 29.341 50.733 -33.482 1.00 0.00 O ATOM 1370 CB GLN A 85 28.216 53.743 -32.539 1.00 0.00 C ATOM 1371 CG GLN A 85 27.294 53.839 -31.310 1.00 0.00 C ATOM 1372 CD GLN A 85 26.448 52.581 -31.078 1.00 0.00 C ATOM 1373 OE1 GLN A 85 26.117 51.823 -31.983 1.00 0.00 O ATOM 1374 NE2 GLN A 85 26.054 52.309 -29.848 1.00 0.00 N ATOM 0 H GLN A 85 30.242 54.474 -31.346 1.00 0.00 H new ATOM 0 HA GLN A 85 29.251 52.083 -31.528 1.00 0.00 H new ATOM 0 HB2 GLN A 85 28.570 54.741 -32.799 1.00 0.00 H new ATOM 0 HB3 GLN A 85 27.641 53.377 -33.390 1.00 0.00 H new ATOM 0 HG2 GLN A 85 27.901 54.027 -30.424 1.00 0.00 H new ATOM 0 HG3 GLN A 85 26.631 54.696 -31.430 1.00 0.00 H new ATOM 0 HE21 GLN A 85 26.318 52.926 -29.080 1.00 0.00 H new ATOM 0 HE22 GLN A 85 25.486 51.482 -29.666 1.00 0.00 H new ATOM 1383 N PRO A 86 30.282 52.404 -34.667 1.00 0.00 N ATOM 1384 CA PRO A 86 30.726 51.562 -35.793 1.00 0.00 C ATOM 1385 C PRO A 86 31.965 50.691 -35.452 1.00 0.00 C ATOM 1386 O PRO A 86 33.033 50.829 -36.058 1.00 0.00 O ATOM 1387 CB PRO A 86 30.935 52.538 -36.964 1.00 0.00 C ATOM 1388 CG PRO A 86 31.333 53.839 -36.268 1.00 0.00 C ATOM 1389 CD PRO A 86 30.479 53.817 -35.004 1.00 0.00 C ATOM 0 HA PRO A 86 29.984 50.807 -36.054 1.00 0.00 H new ATOM 0 HB2 PRO A 86 31.713 52.191 -37.644 1.00 0.00 H new ATOM 0 HB3 PRO A 86 30.027 52.659 -37.554 1.00 0.00 H new ATOM 0 HG2 PRO A 86 32.398 53.865 -36.037 1.00 0.00 H new ATOM 0 HG3 PRO A 86 31.119 54.711 -36.886 1.00 0.00 H new ATOM 0 HD2 PRO A 86 30.975 54.346 -34.190 1.00 0.00 H new ATOM 0 HD3 PRO A 86 29.523 54.314 -35.171 1.00 0.00 H new ATOM 1397 N TYR A 87 31.832 49.807 -34.456 1.00 0.00 N ATOM 1398 CA TYR A 87 32.852 48.849 -34.010 1.00 0.00 C ATOM 1399 C TYR A 87 33.231 47.792 -35.086 1.00 0.00 C ATOM 1400 O TYR A 87 32.398 47.455 -35.942 1.00 0.00 O ATOM 1401 CB TYR A 87 32.353 48.132 -32.745 1.00 0.00 C ATOM 1402 CG TYR A 87 32.492 48.925 -31.458 1.00 0.00 C ATOM 1403 CD1 TYR A 87 33.761 49.065 -30.862 1.00 0.00 C ATOM 1404 CD2 TYR A 87 31.358 49.468 -30.824 1.00 0.00 C ATOM 1405 CE1 TYR A 87 33.898 49.730 -29.629 1.00 0.00 C ATOM 1406 CE2 TYR A 87 31.492 50.141 -29.593 1.00 0.00 C ATOM 1407 CZ TYR A 87 32.762 50.271 -28.990 1.00 0.00 C ATOM 1408 OH TYR A 87 32.895 50.882 -27.783 1.00 0.00 O ATOM 0 H TYR A 87 30.971 49.736 -33.914 1.00 0.00 H new ATOM 0 HA TYR A 87 33.756 49.424 -33.809 1.00 0.00 H new ATOM 0 HB2 TYR A 87 31.303 47.874 -32.883 1.00 0.00 H new ATOM 0 HB3 TYR A 87 32.900 47.195 -32.637 1.00 0.00 H new ATOM 0 HD1 TYR A 87 34.633 48.660 -31.354 1.00 0.00 H new ATOM 0 HD2 TYR A 87 30.385 49.369 -31.281 1.00 0.00 H new ATOM 0 HE1 TYR A 87 34.872 49.826 -29.172 1.00 0.00 H new ATOM 0 HE2 TYR A 87 30.621 50.558 -29.110 1.00 0.00 H new ATOM 0 HH TYR A 87 32.019 51.201 -27.479 1.00 0.00 H new ATOM 1418 N PRO A 88 34.454 47.231 -35.033 1.00 0.00 N ATOM 1419 CA PRO A 88 34.939 46.189 -35.943 1.00 0.00 C ATOM 1420 C PRO A 88 34.708 44.758 -35.387 1.00 0.00 C ATOM 1421 O PRO A 88 34.516 44.535 -34.177 1.00 0.00 O ATOM 1422 CB PRO A 88 36.442 46.493 -36.052 1.00 0.00 C ATOM 1423 CG PRO A 88 36.803 46.923 -34.625 1.00 0.00 C ATOM 1424 CD PRO A 88 35.519 47.571 -34.094 1.00 0.00 C ATOM 0 HA PRO A 88 34.415 46.203 -36.899 1.00 0.00 H new ATOM 0 HB2 PRO A 88 37.010 45.618 -36.367 1.00 0.00 H new ATOM 0 HB3 PRO A 88 36.644 47.282 -36.776 1.00 0.00 H new ATOM 0 HG2 PRO A 88 37.101 46.070 -34.015 1.00 0.00 H new ATOM 0 HG3 PRO A 88 37.636 47.626 -34.619 1.00 0.00 H new ATOM 0 HD2 PRO A 88 35.285 47.203 -33.095 1.00 0.00 H new ATOM 0 HD3 PRO A 88 35.635 48.652 -34.017 1.00 0.00 H new ATOM 1432 N GLU A 89 34.795 43.779 -36.311 1.00 0.00 N ATOM 1433 CA GLU A 89 34.559 42.334 -36.083 1.00 0.00 C ATOM 1434 C GLU A 89 35.713 41.592 -35.340 1.00 0.00 C ATOM 1435 O GLU A 89 36.173 40.513 -35.737 1.00 0.00 O ATOM 1436 CB GLU A 89 34.224 41.667 -37.437 1.00 0.00 C ATOM 1437 CG GLU A 89 32.907 42.173 -38.059 1.00 0.00 C ATOM 1438 CD GLU A 89 33.083 43.303 -39.106 1.00 0.00 C ATOM 1439 OE1 GLU A 89 33.950 44.204 -38.939 1.00 0.00 O ATOM 1440 OE2 GLU A 89 32.320 43.301 -40.108 1.00 0.00 O ATOM 0 H GLU A 89 35.042 43.980 -37.280 1.00 0.00 H new ATOM 0 HA GLU A 89 33.715 42.250 -35.398 1.00 0.00 H new ATOM 0 HB2 GLU A 89 35.041 41.849 -38.135 1.00 0.00 H new ATOM 0 HB3 GLU A 89 34.160 40.588 -37.296 1.00 0.00 H new ATOM 0 HG2 GLU A 89 32.397 41.333 -38.531 1.00 0.00 H new ATOM 0 HG3 GLU A 89 32.257 42.532 -37.261 1.00 0.00 H new ATOM 1447 N ILE A 90 36.194 42.184 -34.232 1.00 0.00 N ATOM 1448 CA ILE A 90 37.304 41.678 -33.380 1.00 0.00 C ATOM 1449 C ILE A 90 36.926 40.541 -32.390 1.00 0.00 C ATOM 1450 O ILE A 90 37.659 40.283 -31.431 1.00 0.00 O ATOM 1451 CB ILE A 90 37.979 42.861 -32.646 1.00 0.00 C ATOM 1452 CG1 ILE A 90 37.001 43.687 -31.775 1.00 0.00 C ATOM 1453 CG2 ILE A 90 38.695 43.735 -33.685 1.00 0.00 C ATOM 1454 CD1 ILE A 90 37.260 43.509 -30.277 1.00 0.00 C ATOM 0 H ILE A 90 35.810 43.063 -33.885 1.00 0.00 H new ATOM 0 HA ILE A 90 38.007 41.204 -34.065 1.00 0.00 H new ATOM 0 HB ILE A 90 38.702 42.455 -31.939 1.00 0.00 H new ATOM 0 HG12 ILE A 90 37.091 44.742 -32.034 1.00 0.00 H new ATOM 0 HG13 ILE A 90 35.977 43.390 -32.002 1.00 0.00 H new ATOM 0 HG21 ILE A 90 39.177 44.575 -33.184 1.00 0.00 H new ATOM 0 HG22 ILE A 90 39.448 43.141 -34.203 1.00 0.00 H new ATOM 0 HG23 ILE A 90 37.969 44.111 -34.406 1.00 0.00 H new ATOM 0 HD11 ILE A 90 36.548 44.109 -29.711 1.00 0.00 H new ATOM 0 HD12 ILE A 90 37.143 42.459 -30.010 1.00 0.00 H new ATOM 0 HD13 ILE A 90 38.274 43.832 -30.042 1.00 0.00 H new