USER MOD reduce.3.24.130724 H: found=0, std=0, add=744, rem=0, adj=17 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 22 CYS SG : rot -148:sc= 0.432 USER MOD Set 1.2: A 81 GLN : amide:sc= -0.835 K(o=-0.4,f=-2.2) USER MOD Set 2.1: A 47 LYS NZ :NH3+ 175:sc= 0.881 (180deg=0) USER MOD Set 2.2: A 56 GLN : amide:sc= 0.77 K(o=1.7,f=-2.6) USER MOD Set 3.1: A 49 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 51 THR OG1 : rot 180:sc= 0.00101 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 GLN : amide:sc= 0.84 K(o=0.84,f=-3!) USER MOD Single : A 5 GLN : amide:sc= 0.292 X(o=0.29,f=0) USER MOD Single : A 8 GLN : amide:sc= 0.99 K(o=0.99,f=-0.39) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 10 LYS NZ :NH3+ 147:sc= 1.31 (180deg=1.16) USER MOD Single : A 16 ASN : amide:sc= 1.13 K(o=1.1,f=0) USER MOD Single : A 17 GLN : amide:sc= -0.148 X(o=-0.15,f=-0.52) USER MOD Single : A 18 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 ASN : amide:sc= -0.0263 K(o=-0.026,f=-0.94) USER MOD Single : A 25 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 SER OG : rot 180:sc= 0 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 -21:sc= 0.189 USER MOD Single : A 46 THR OG1 : rot 180:sc= -0.0185 USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ -159:sc= 1.13 (180deg=0.599) USER MOD Single : A 60 THR OG1 : rot -169:sc= 1.03 USER MOD Single : A 61 THR OG1 : rot 130:sc= 0 USER MOD Single : A 64 GLN : amide:sc= -0.0635 X(o=-0.063,f=-0.063) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 ASN : amide:sc=-0.00786 K(o=-0.0079,f=-2.5!) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 85 GLN : amide:sc= 0.334 K(o=0.33,f=-0.52) USER MOD Single : A 87 TYR OH : rot 126:sc= 0.0615 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 44.555 44.281 -42.123 1.00 0.00 N ATOM 2 CA GLY A 1 43.734 43.253 -41.439 1.00 0.00 C ATOM 3 C GLY A 1 42.455 43.854 -40.877 1.00 0.00 C ATOM 4 O GLY A 1 41.751 44.550 -41.604 1.00 0.00 O ATOM 0 H1 GLY A 1 45.421 43.842 -42.496 1.00 0.00 H new ATOM 0 H2 GLY A 1 44.011 44.695 -42.907 1.00 0.00 H new ATOM 0 H3 GLY A 1 44.810 45.028 -41.446 1.00 0.00 H new ATOM 0 HA2 GLY A 1 43.487 42.456 -42.140 1.00 0.00 H new ATOM 0 HA3 GLY A 1 44.311 42.801 -40.633 1.00 0.00 H new ATOM 7 N ILE A 2 42.152 43.618 -39.591 1.00 0.00 N ATOM 8 CA ILE A 2 40.900 44.067 -38.943 1.00 0.00 C ATOM 9 C ILE A 2 41.213 45.047 -37.802 1.00 0.00 C ATOM 10 O ILE A 2 41.060 46.255 -37.991 1.00 0.00 O ATOM 11 CB ILE A 2 40.047 42.844 -38.511 1.00 0.00 C ATOM 12 CG1 ILE A 2 39.623 42.008 -39.742 1.00 0.00 C ATOM 13 CG2 ILE A 2 38.802 43.291 -37.729 1.00 0.00 C ATOM 14 CD1 ILE A 2 38.975 40.658 -39.398 1.00 0.00 C ATOM 0 H ILE A 2 42.771 43.106 -38.963 1.00 0.00 H new ATOM 0 HA ILE A 2 40.289 44.621 -39.655 1.00 0.00 H new ATOM 0 HB ILE A 2 40.663 42.224 -37.860 1.00 0.00 H new ATOM 0 HG12 ILE A 2 38.923 42.592 -40.339 1.00 0.00 H new ATOM 0 HG13 ILE A 2 40.500 41.829 -40.364 1.00 0.00 H new ATOM 0 HG21 ILE A 2 38.221 42.416 -37.438 1.00 0.00 H new ATOM 0 HG22 ILE A 2 39.109 43.836 -36.836 1.00 0.00 H new ATOM 0 HG23 ILE A 2 38.191 43.939 -38.357 1.00 0.00 H new ATOM 0 HD11 ILE A 2 38.709 40.137 -40.318 1.00 0.00 H new ATOM 0 HD12 ILE A 2 39.679 40.051 -38.828 1.00 0.00 H new ATOM 0 HD13 ILE A 2 38.077 40.826 -38.803 1.00 0.00 H new ATOM 26 N ALA A 3 41.741 44.581 -36.662 1.00 0.00 N ATOM 27 CA ALA A 3 42.140 45.467 -35.556 1.00 0.00 C ATOM 28 C ALA A 3 43.256 46.438 -35.989 1.00 0.00 C ATOM 29 O ALA A 3 43.199 47.638 -35.722 1.00 0.00 O ATOM 30 CB ALA A 3 42.590 44.610 -34.365 1.00 0.00 C ATOM 0 H ALA A 3 41.903 43.591 -36.480 1.00 0.00 H new ATOM 0 HA ALA A 3 41.284 46.075 -35.262 1.00 0.00 H new ATOM 0 HB1 ALA A 3 42.887 45.259 -33.541 1.00 0.00 H new ATOM 0 HB2 ALA A 3 41.767 43.971 -34.045 1.00 0.00 H new ATOM 0 HB3 ALA A 3 43.436 43.990 -34.662 1.00 0.00 H new ATOM 36 N GLN A 4 44.230 45.911 -36.742 1.00 0.00 N ATOM 37 CA GLN A 4 45.337 46.654 -37.357 1.00 0.00 C ATOM 38 C GLN A 4 44.866 47.733 -38.352 1.00 0.00 C ATOM 39 O GLN A 4 45.558 48.728 -38.542 1.00 0.00 O ATOM 40 CB GLN A 4 46.255 45.659 -38.094 1.00 0.00 C ATOM 41 CG GLN A 4 46.956 44.636 -37.182 1.00 0.00 C ATOM 42 CD GLN A 4 48.106 45.247 -36.385 1.00 0.00 C ATOM 43 OE1 GLN A 4 49.133 45.630 -36.925 1.00 0.00 O ATOM 44 NE2 GLN A 4 47.994 45.331 -35.077 1.00 0.00 N ATOM 0 H GLN A 4 44.270 44.913 -36.948 1.00 0.00 H new ATOM 0 HA GLN A 4 45.865 47.168 -36.554 1.00 0.00 H new ATOM 0 HB2 GLN A 4 45.664 45.120 -38.835 1.00 0.00 H new ATOM 0 HB3 GLN A 4 47.014 46.220 -38.639 1.00 0.00 H new ATOM 0 HG2 GLN A 4 46.227 44.211 -36.492 1.00 0.00 H new ATOM 0 HG3 GLN A 4 47.336 43.815 -37.789 1.00 0.00 H new ATOM 0 HE21 GLN A 4 47.141 45.014 -34.617 1.00 0.00 H new ATOM 0 HE22 GLN A 4 48.760 45.713 -34.523 1.00 0.00 H new ATOM 53 N GLN A 5 43.700 47.560 -38.987 1.00 0.00 N ATOM 54 CA GLN A 5 43.152 48.530 -39.947 1.00 0.00 C ATOM 55 C GLN A 5 42.291 49.587 -39.249 1.00 0.00 C ATOM 56 O GLN A 5 42.393 50.771 -39.576 1.00 0.00 O ATOM 57 CB GLN A 5 42.377 47.773 -41.040 1.00 0.00 C ATOM 58 CG GLN A 5 42.001 48.634 -42.261 1.00 0.00 C ATOM 59 CD GLN A 5 40.586 49.212 -42.202 1.00 0.00 C ATOM 60 OE1 GLN A 5 39.627 48.634 -42.695 1.00 0.00 O ATOM 61 NE2 GLN A 5 40.392 50.373 -41.613 1.00 0.00 N ATOM 0 H GLN A 5 43.107 46.741 -38.850 1.00 0.00 H new ATOM 0 HA GLN A 5 43.971 49.075 -40.417 1.00 0.00 H new ATOM 0 HB2 GLN A 5 42.978 46.928 -41.377 1.00 0.00 H new ATOM 0 HB3 GLN A 5 41.466 47.362 -40.605 1.00 0.00 H new ATOM 0 HG2 GLN A 5 42.714 49.454 -42.348 1.00 0.00 H new ATOM 0 HG3 GLN A 5 42.098 48.030 -43.163 1.00 0.00 H new ATOM 0 HE21 GLN A 5 41.178 50.871 -41.196 1.00 0.00 H new ATOM 0 HE22 GLN A 5 39.455 50.775 -41.574 1.00 0.00 H new ATOM 70 N TRP A 6 41.484 49.199 -38.257 1.00 0.00 N ATOM 71 CA TRP A 6 40.695 50.139 -37.450 1.00 0.00 C ATOM 72 C TRP A 6 41.608 51.101 -36.677 1.00 0.00 C ATOM 73 O TRP A 6 41.428 52.318 -36.743 1.00 0.00 O ATOM 74 CB TRP A 6 39.771 49.344 -36.520 1.00 0.00 C ATOM 75 CG TRP A 6 38.529 50.050 -36.065 1.00 0.00 C ATOM 76 CD1 TRP A 6 37.418 50.229 -36.816 1.00 0.00 C ATOM 77 CD2 TRP A 6 38.193 50.560 -34.735 1.00 0.00 C ATOM 78 NE1 TRP A 6 36.417 50.791 -36.047 1.00 0.00 N ATOM 79 CE2 TRP A 6 36.832 50.991 -34.750 1.00 0.00 C ATOM 80 CE3 TRP A 6 38.877 50.642 -33.506 1.00 0.00 C ATOM 81 CZ2 TRP A 6 36.168 51.418 -33.591 1.00 0.00 C ATOM 82 CZ3 TRP A 6 38.227 51.095 -32.340 1.00 0.00 C ATOM 83 CH2 TRP A 6 36.872 51.459 -32.377 1.00 0.00 C ATOM 0 H TRP A 6 41.358 48.223 -37.989 1.00 0.00 H new ATOM 0 HA TRP A 6 40.079 50.758 -38.102 1.00 0.00 H new ATOM 0 HB2 TRP A 6 39.477 48.427 -37.030 1.00 0.00 H new ATOM 0 HB3 TRP A 6 40.341 49.050 -35.639 1.00 0.00 H new ATOM 0 HD1 TRP A 6 37.327 49.971 -37.861 1.00 0.00 H new ATOM 0 HE1 TRP A 6 35.488 51.028 -36.396 1.00 0.00 H new ATOM 0 HE3 TRP A 6 39.916 50.353 -33.456 1.00 0.00 H new ATOM 0 HZ2 TRP A 6 35.129 51.711 -33.632 1.00 0.00 H new ATOM 0 HZ3 TRP A 6 38.775 51.162 -31.412 1.00 0.00 H new ATOM 0 HH2 TRP A 6 36.371 51.770 -31.472 1.00 0.00 H new ATOM 94 N ILE A 7 42.683 50.579 -36.071 1.00 0.00 N ATOM 95 CA ILE A 7 43.735 51.374 -35.417 1.00 0.00 C ATOM 96 C ILE A 7 44.614 52.184 -36.400 1.00 0.00 C ATOM 97 O ILE A 7 45.465 52.951 -35.966 1.00 0.00 O ATOM 98 CB ILE A 7 44.566 50.473 -34.464 1.00 0.00 C ATOM 99 CG1 ILE A 7 44.873 51.211 -33.141 1.00 0.00 C ATOM 100 CG2 ILE A 7 45.845 49.917 -35.109 1.00 0.00 C ATOM 101 CD1 ILE A 7 43.818 50.900 -32.075 1.00 0.00 C ATOM 0 H ILE A 7 42.850 49.574 -36.020 1.00 0.00 H new ATOM 0 HA ILE A 7 43.237 52.139 -34.821 1.00 0.00 H new ATOM 0 HB ILE A 7 43.947 49.604 -34.242 1.00 0.00 H new ATOM 0 HG12 ILE A 7 45.858 50.917 -32.778 1.00 0.00 H new ATOM 0 HG13 ILE A 7 44.907 52.286 -33.320 1.00 0.00 H new ATOM 0 HG21 ILE A 7 46.376 49.297 -34.387 1.00 0.00 H new ATOM 0 HG22 ILE A 7 45.582 49.316 -35.980 1.00 0.00 H new ATOM 0 HG23 ILE A 7 46.485 50.743 -35.418 1.00 0.00 H new ATOM 0 HD11 ILE A 7 44.061 51.433 -31.156 1.00 0.00 H new ATOM 0 HD12 ILE A 7 42.837 51.217 -32.430 1.00 0.00 H new ATOM 0 HD13 ILE A 7 43.804 49.828 -31.879 1.00 0.00 H new ATOM 113 N GLN A 8 44.399 52.068 -37.716 1.00 0.00 N ATOM 114 CA GLN A 8 45.043 52.890 -38.757 1.00 0.00 C ATOM 115 C GLN A 8 44.062 53.857 -39.452 1.00 0.00 C ATOM 116 O GLN A 8 44.498 54.698 -40.238 1.00 0.00 O ATOM 117 CB GLN A 8 45.750 51.981 -39.779 1.00 0.00 C ATOM 118 CG GLN A 8 47.077 51.405 -39.253 1.00 0.00 C ATOM 119 CD GLN A 8 47.709 50.403 -40.228 1.00 0.00 C ATOM 120 OE1 GLN A 8 47.371 50.317 -41.404 1.00 0.00 O ATOM 121 NE2 GLN A 8 48.670 49.609 -39.806 1.00 0.00 N ATOM 0 H GLN A 8 43.753 51.379 -38.101 1.00 0.00 H new ATOM 0 HA GLN A 8 45.784 53.519 -38.264 1.00 0.00 H new ATOM 0 HB2 GLN A 8 45.085 51.160 -40.048 1.00 0.00 H new ATOM 0 HB3 GLN A 8 45.942 52.548 -40.690 1.00 0.00 H new ATOM 0 HG2 GLN A 8 47.777 52.221 -39.071 1.00 0.00 H new ATOM 0 HG3 GLN A 8 46.902 50.915 -38.295 1.00 0.00 H new ATOM 0 HE21 GLN A 8 48.978 49.652 -38.834 1.00 0.00 H new ATOM 0 HE22 GLN A 8 49.107 48.950 -40.451 1.00 0.00 H new ATOM 130 N SER A 9 42.765 53.814 -39.112 1.00 0.00 N ATOM 131 CA SER A 9 41.704 54.675 -39.674 1.00 0.00 C ATOM 132 C SER A 9 41.026 55.557 -38.611 1.00 0.00 C ATOM 133 O SER A 9 40.606 56.679 -38.902 1.00 0.00 O ATOM 134 CB SER A 9 40.675 53.785 -40.381 1.00 0.00 C ATOM 135 OG SER A 9 39.701 54.563 -41.058 1.00 0.00 O ATOM 0 H SER A 9 42.410 53.159 -38.416 1.00 0.00 H new ATOM 0 HA SER A 9 42.163 55.362 -40.385 1.00 0.00 H new ATOM 0 HB2 SER A 9 41.182 53.133 -41.093 1.00 0.00 H new ATOM 0 HB3 SER A 9 40.186 53.140 -39.651 1.00 0.00 H new ATOM 0 HG SER A 9 39.059 53.970 -41.501 1.00 0.00 H new ATOM 141 N LYS A 10 41.017 55.106 -37.348 1.00 0.00 N ATOM 142 CA LYS A 10 40.430 55.794 -36.183 1.00 0.00 C ATOM 143 C LYS A 10 41.446 56.085 -35.070 1.00 0.00 C ATOM 144 O LYS A 10 41.050 56.392 -33.950 1.00 0.00 O ATOM 145 CB LYS A 10 39.203 54.991 -35.696 1.00 0.00 C ATOM 146 CG LYS A 10 37.993 55.263 -36.600 1.00 0.00 C ATOM 147 CD LYS A 10 36.708 54.634 -36.041 1.00 0.00 C ATOM 148 CE LYS A 10 35.468 55.108 -36.812 1.00 0.00 C ATOM 149 NZ LYS A 10 35.035 56.468 -36.400 1.00 0.00 N ATOM 0 H LYS A 10 41.437 54.211 -37.097 1.00 0.00 H new ATOM 0 HA LYS A 10 40.099 56.785 -36.494 1.00 0.00 H new ATOM 0 HB2 LYS A 10 39.434 53.926 -35.697 1.00 0.00 H new ATOM 0 HB3 LYS A 10 38.966 55.265 -34.668 1.00 0.00 H new ATOM 0 HG2 LYS A 10 37.854 56.339 -36.707 1.00 0.00 H new ATOM 0 HG3 LYS A 10 38.188 54.866 -37.596 1.00 0.00 H new ATOM 0 HD2 LYS A 10 36.779 53.548 -36.097 1.00 0.00 H new ATOM 0 HD3 LYS A 10 36.604 54.893 -34.987 1.00 0.00 H new ATOM 0 HE2 LYS A 10 35.684 55.106 -37.880 1.00 0.00 H new ATOM 0 HE3 LYS A 10 34.651 54.404 -36.651 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 34.629 56.966 -37.218 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 34.318 56.392 -35.650 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 35.854 57.000 -36.043 1.00 0.00 H new ATOM 163 N ARG A 11 42.753 56.062 -35.371 1.00 0.00 N ATOM 164 CA ARG A 11 43.848 56.359 -34.416 1.00 0.00 C ATOM 165 C ARG A 11 43.692 57.653 -33.606 1.00 0.00 C ATOM 166 O ARG A 11 44.163 57.717 -32.476 1.00 0.00 O ATOM 167 CB ARG A 11 45.236 56.291 -35.088 1.00 0.00 C ATOM 168 CG ARG A 11 45.544 57.261 -36.245 1.00 0.00 C ATOM 169 CD ARG A 11 44.940 56.871 -37.609 1.00 0.00 C ATOM 170 NE ARG A 11 43.911 57.833 -38.056 1.00 0.00 N ATOM 171 CZ ARG A 11 43.588 58.137 -39.305 1.00 0.00 C ATOM 172 NH1 ARG A 11 44.007 57.457 -40.332 1.00 0.00 N ATOM 173 NH2 ARG A 11 42.822 59.159 -39.552 1.00 0.00 N ATOM 0 H ARG A 11 43.093 55.832 -36.305 1.00 0.00 H new ATOM 0 HA ARG A 11 43.769 55.559 -33.680 1.00 0.00 H new ATOM 0 HB2 ARG A 11 45.987 56.450 -34.314 1.00 0.00 H new ATOM 0 HB3 ARG A 11 45.374 55.276 -35.461 1.00 0.00 H new ATOM 0 HG2 ARG A 11 45.179 58.252 -35.974 1.00 0.00 H new ATOM 0 HG3 ARG A 11 46.626 57.339 -36.354 1.00 0.00 H new ATOM 0 HD2 ARG A 11 45.733 56.817 -38.354 1.00 0.00 H new ATOM 0 HD3 ARG A 11 44.500 55.876 -37.539 1.00 0.00 H new ATOM 0 HE ARG A 11 43.392 58.316 -37.323 1.00 0.00 H new ATOM 0 HH11 ARG A 11 44.613 56.648 -40.195 1.00 0.00 H new ATOM 0 HH12 ARG A 11 43.729 57.733 -41.274 1.00 0.00 H new ATOM 0 HH21 ARG A 11 42.468 59.729 -38.783 1.00 0.00 H new ATOM 0 HH22 ARG A 11 42.575 59.391 -40.514 1.00 0.00 H new ATOM 187 N GLU A 12 42.998 58.657 -34.145 1.00 0.00 N ATOM 188 CA GLU A 12 42.672 59.903 -33.435 1.00 0.00 C ATOM 189 C GLU A 12 41.245 59.924 -32.854 1.00 0.00 C ATOM 190 O GLU A 12 41.056 60.477 -31.773 1.00 0.00 O ATOM 191 CB GLU A 12 42.951 61.121 -34.334 1.00 0.00 C ATOM 192 CG GLU A 12 42.162 61.140 -35.652 1.00 0.00 C ATOM 193 CD GLU A 12 42.492 62.402 -36.469 1.00 0.00 C ATOM 194 OE1 GLU A 12 43.488 62.382 -37.233 1.00 0.00 O ATOM 195 OE2 GLU A 12 41.753 63.412 -36.364 1.00 0.00 O ATOM 0 H GLU A 12 42.640 58.631 -35.100 1.00 0.00 H new ATOM 0 HA GLU A 12 43.330 59.956 -32.568 1.00 0.00 H new ATOM 0 HB2 GLU A 12 42.721 62.028 -33.775 1.00 0.00 H new ATOM 0 HB3 GLU A 12 44.016 61.150 -34.563 1.00 0.00 H new ATOM 0 HG2 GLU A 12 42.400 60.251 -36.236 1.00 0.00 H new ATOM 0 HG3 GLU A 12 41.093 61.107 -35.442 1.00 0.00 H new ATOM 202 N ASP A 13 40.256 59.276 -33.486 1.00 0.00 N ATOM 203 CA ASP A 13 38.901 59.104 -32.922 1.00 0.00 C ATOM 204 C ASP A 13 38.951 58.349 -31.584 1.00 0.00 C ATOM 205 O ASP A 13 38.346 58.772 -30.598 1.00 0.00 O ATOM 206 CB ASP A 13 37.998 58.312 -33.887 1.00 0.00 C ATOM 207 CG ASP A 13 37.349 59.129 -35.013 1.00 0.00 C ATOM 208 OD1 ASP A 13 37.383 60.377 -35.006 1.00 0.00 O ATOM 209 OD2 ASP A 13 36.754 58.489 -35.914 1.00 0.00 O ATOM 0 H ASP A 13 40.370 58.853 -34.407 1.00 0.00 H new ATOM 0 HA ASP A 13 38.493 60.103 -32.767 1.00 0.00 H new ATOM 0 HB2 ASP A 13 38.589 57.514 -34.336 1.00 0.00 H new ATOM 0 HB3 ASP A 13 37.208 57.835 -33.307 1.00 0.00 H new ATOM 214 N ILE A 14 39.707 57.246 -31.548 1.00 0.00 N ATOM 215 CA ILE A 14 39.905 56.390 -30.372 1.00 0.00 C ATOM 216 C ILE A 14 40.530 57.202 -29.234 1.00 0.00 C ATOM 217 O ILE A 14 39.996 57.213 -28.129 1.00 0.00 O ATOM 218 CB ILE A 14 40.762 55.162 -30.767 1.00 0.00 C ATOM 219 CG1 ILE A 14 39.992 54.271 -31.772 1.00 0.00 C ATOM 220 CG2 ILE A 14 41.182 54.317 -29.550 1.00 0.00 C ATOM 221 CD1 ILE A 14 40.906 53.300 -32.527 1.00 0.00 C ATOM 0 H ILE A 14 40.216 56.913 -32.366 1.00 0.00 H new ATOM 0 HA ILE A 14 38.947 56.018 -30.009 1.00 0.00 H new ATOM 0 HB ILE A 14 41.670 55.549 -31.229 1.00 0.00 H new ATOM 0 HG12 ILE A 14 39.230 53.704 -31.238 1.00 0.00 H new ATOM 0 HG13 ILE A 14 39.473 54.906 -32.490 1.00 0.00 H new ATOM 0 HG21 ILE A 14 41.780 53.470 -29.885 1.00 0.00 H new ATOM 0 HG22 ILE A 14 41.770 54.930 -28.867 1.00 0.00 H new ATOM 0 HG23 ILE A 14 40.293 53.953 -29.036 1.00 0.00 H new ATOM 0 HD11 ILE A 14 40.311 52.702 -33.217 1.00 0.00 H new ATOM 0 HD12 ILE A 14 41.653 53.864 -33.087 1.00 0.00 H new ATOM 0 HD13 ILE A 14 41.406 52.643 -31.815 1.00 0.00 H new ATOM 233 N VAL A 15 41.611 57.942 -29.504 1.00 0.00 N ATOM 234 CA VAL A 15 42.325 58.767 -28.506 1.00 0.00 C ATOM 235 C VAL A 15 41.508 59.988 -28.044 1.00 0.00 C ATOM 236 O VAL A 15 41.673 60.442 -26.912 1.00 0.00 O ATOM 237 CB VAL A 15 43.716 59.166 -29.051 1.00 0.00 C ATOM 238 CG1 VAL A 15 44.518 60.074 -28.107 1.00 0.00 C ATOM 239 CG2 VAL A 15 44.571 57.908 -29.255 1.00 0.00 C ATOM 0 H VAL A 15 42.026 57.990 -30.435 1.00 0.00 H new ATOM 0 HA VAL A 15 42.465 58.161 -27.611 1.00 0.00 H new ATOM 0 HB VAL A 15 43.517 59.706 -29.977 1.00 0.00 H new ATOM 0 HG11 VAL A 15 45.481 60.310 -28.560 1.00 0.00 H new ATOM 0 HG12 VAL A 15 43.964 60.996 -27.932 1.00 0.00 H new ATOM 0 HG13 VAL A 15 44.679 59.561 -27.159 1.00 0.00 H new ATOM 0 HG21 VAL A 15 45.551 58.192 -29.639 1.00 0.00 H new ATOM 0 HG22 VAL A 15 44.691 57.391 -28.303 1.00 0.00 H new ATOM 0 HG23 VAL A 15 44.080 57.246 -29.968 1.00 0.00 H new ATOM 249 N ASN A 16 40.578 60.494 -28.864 1.00 0.00 N ATOM 250 CA ASN A 16 39.605 61.525 -28.465 1.00 0.00 C ATOM 251 C ASN A 16 38.442 60.989 -27.599 1.00 0.00 C ATOM 252 O ASN A 16 37.716 61.788 -27.002 1.00 0.00 O ATOM 253 CB ASN A 16 39.060 62.236 -29.719 1.00 0.00 C ATOM 254 CG ASN A 16 39.938 63.404 -30.134 1.00 0.00 C ATOM 255 OD1 ASN A 16 39.767 64.529 -29.685 1.00 0.00 O ATOM 256 ND2 ASN A 16 40.906 63.182 -30.989 1.00 0.00 N ATOM 0 H ASN A 16 40.477 60.197 -29.835 1.00 0.00 H new ATOM 0 HA ASN A 16 40.142 62.231 -27.832 1.00 0.00 H new ATOM 0 HB2 ASN A 16 38.993 61.523 -30.540 1.00 0.00 H new ATOM 0 HB3 ASN A 16 38.049 62.593 -29.523 1.00 0.00 H new ATOM 0 HD21 ASN A 16 41.516 63.947 -31.279 1.00 0.00 H new ATOM 0 HD22 ASN A 16 41.050 62.245 -31.364 1.00 0.00 H new ATOM 263 N GLN A 17 38.254 59.668 -27.515 1.00 0.00 N ATOM 264 CA GLN A 17 37.131 59.035 -26.810 1.00 0.00 C ATOM 265 C GLN A 17 37.591 58.261 -25.568 1.00 0.00 C ATOM 266 O GLN A 17 37.056 58.478 -24.480 1.00 0.00 O ATOM 267 CB GLN A 17 36.394 58.107 -27.788 1.00 0.00 C ATOM 268 CG GLN A 17 35.487 58.868 -28.770 1.00 0.00 C ATOM 269 CD GLN A 17 34.227 59.430 -28.109 1.00 0.00 C ATOM 270 OE1 GLN A 17 33.609 58.820 -27.245 1.00 0.00 O ATOM 271 NE2 GLN A 17 33.781 60.606 -28.494 1.00 0.00 N ATOM 0 H GLN A 17 38.889 58.995 -27.943 1.00 0.00 H new ATOM 0 HA GLN A 17 36.458 59.816 -26.457 1.00 0.00 H new ATOM 0 HB2 GLN A 17 37.125 57.528 -28.352 1.00 0.00 H new ATOM 0 HB3 GLN A 17 35.792 57.396 -27.222 1.00 0.00 H new ATOM 0 HG2 GLN A 17 36.051 59.686 -29.217 1.00 0.00 H new ATOM 0 HG3 GLN A 17 35.198 58.200 -29.581 1.00 0.00 H new ATOM 0 HE21 GLN A 17 34.280 61.131 -29.212 1.00 0.00 H new ATOM 0 HE22 GLN A 17 32.936 60.993 -28.074 1.00 0.00 H new ATOM 280 N MET A 18 38.579 57.371 -25.704 1.00 0.00 N ATOM 281 CA MET A 18 39.274 56.758 -24.569 1.00 0.00 C ATOM 282 C MET A 18 40.126 57.794 -23.811 1.00 0.00 C ATOM 283 O MET A 18 40.416 58.881 -24.317 1.00 0.00 O ATOM 284 CB MET A 18 40.090 55.538 -25.043 1.00 0.00 C ATOM 285 CG MET A 18 41.424 55.853 -25.735 1.00 0.00 C ATOM 286 SD MET A 18 42.878 55.109 -24.942 1.00 0.00 S ATOM 287 CE MET A 18 42.792 53.424 -25.608 1.00 0.00 C ATOM 0 H MET A 18 38.921 57.054 -26.611 1.00 0.00 H new ATOM 0 HA MET A 18 38.537 56.394 -23.853 1.00 0.00 H new ATOM 0 HB2 MET A 18 40.291 54.902 -24.181 1.00 0.00 H new ATOM 0 HB3 MET A 18 39.474 54.958 -25.730 1.00 0.00 H new ATOM 0 HG2 MET A 18 41.373 55.509 -26.768 1.00 0.00 H new ATOM 0 HG3 MET A 18 41.556 56.935 -25.766 1.00 0.00 H new ATOM 0 HE1 MET A 18 43.621 52.835 -25.215 1.00 0.00 H new ATOM 0 HE2 MET A 18 41.848 52.964 -25.314 1.00 0.00 H new ATOM 0 HE3 MET A 18 42.855 53.459 -26.696 1.00 0.00 H new ATOM 297 N THR A 19 40.546 57.450 -22.596 1.00 0.00 N ATOM 298 CA THR A 19 41.342 58.312 -21.704 1.00 0.00 C ATOM 299 C THR A 19 42.439 57.498 -21.015 1.00 0.00 C ATOM 300 O THR A 19 42.543 56.286 -21.232 1.00 0.00 O ATOM 301 CB THR A 19 40.446 58.985 -20.644 1.00 0.00 C ATOM 302 OG1 THR A 19 39.913 58.005 -19.778 1.00 0.00 O ATOM 303 CG2 THR A 19 39.279 59.777 -21.237 1.00 0.00 C ATOM 0 H THR A 19 40.340 56.539 -22.186 1.00 0.00 H new ATOM 0 HA THR A 19 41.804 59.090 -22.312 1.00 0.00 H new ATOM 0 HB THR A 19 41.088 59.688 -20.114 1.00 0.00 H new ATOM 0 HG1 THR A 19 39.346 58.437 -19.105 1.00 0.00 H new ATOM 0 HG21 THR A 19 38.694 60.221 -20.432 1.00 0.00 H new ATOM 0 HG22 THR A 19 39.665 60.566 -21.883 1.00 0.00 H new ATOM 0 HG23 THR A 19 38.645 59.109 -21.820 1.00 0.00 H new ATOM 311 N GLU A 20 43.245 58.124 -20.147 1.00 0.00 N ATOM 312 CA GLU A 20 44.192 57.387 -19.296 1.00 0.00 C ATOM 313 C GLU A 20 43.491 56.286 -18.487 1.00 0.00 C ATOM 314 O GLU A 20 44.074 55.228 -18.320 1.00 0.00 O ATOM 315 CB GLU A 20 44.965 58.332 -18.359 1.00 0.00 C ATOM 316 CG GLU A 20 46.435 57.934 -18.110 1.00 0.00 C ATOM 317 CD GLU A 20 46.684 56.626 -17.336 1.00 0.00 C ATOM 318 OE1 GLU A 20 46.152 56.459 -16.213 1.00 0.00 O ATOM 319 OE2 GLU A 20 47.513 55.813 -17.816 1.00 0.00 O ATOM 0 H GLU A 20 43.261 59.135 -20.015 1.00 0.00 H new ATOM 0 HA GLU A 20 44.909 56.910 -19.964 1.00 0.00 H new ATOM 0 HB2 GLU A 20 44.941 59.337 -18.779 1.00 0.00 H new ATOM 0 HB3 GLU A 20 44.447 58.375 -17.401 1.00 0.00 H new ATOM 0 HG2 GLU A 20 46.933 57.856 -19.076 1.00 0.00 H new ATOM 0 HG3 GLU A 20 46.918 58.746 -17.567 1.00 0.00 H new ATOM 326 N ALA A 21 42.236 56.466 -18.055 1.00 0.00 N ATOM 327 CA ALA A 21 41.487 55.428 -17.338 1.00 0.00 C ATOM 328 C ALA A 21 41.262 54.161 -18.191 1.00 0.00 C ATOM 329 O ALA A 21 41.505 53.045 -17.725 1.00 0.00 O ATOM 330 CB ALA A 21 40.158 56.021 -16.854 1.00 0.00 C ATOM 0 H ALA A 21 41.714 57.331 -18.192 1.00 0.00 H new ATOM 0 HA ALA A 21 42.079 55.105 -16.482 1.00 0.00 H new ATOM 0 HB1 ALA A 21 39.592 55.258 -16.319 1.00 0.00 H new ATOM 0 HB2 ALA A 21 40.355 56.860 -16.187 1.00 0.00 H new ATOM 0 HB3 ALA A 21 39.580 56.367 -17.711 1.00 0.00 H new ATOM 336 N CYS A 22 40.852 54.319 -19.454 1.00 0.00 N ATOM 337 CA CYS A 22 40.690 53.202 -20.390 1.00 0.00 C ATOM 338 C CYS A 22 42.042 52.567 -20.754 1.00 0.00 C ATOM 339 O CYS A 22 42.180 51.344 -20.719 1.00 0.00 O ATOM 340 CB CYS A 22 39.978 53.690 -21.657 1.00 0.00 C ATOM 341 SG CYS A 22 38.351 54.391 -21.253 1.00 0.00 S ATOM 0 H CYS A 22 40.623 55.228 -19.857 1.00 0.00 H new ATOM 0 HA CYS A 22 40.087 52.436 -19.902 1.00 0.00 H new ATOM 0 HB2 CYS A 22 40.589 54.442 -22.156 1.00 0.00 H new ATOM 0 HB3 CYS A 22 39.859 52.861 -22.355 1.00 0.00 H new ATOM 0 HG CYS A 22 37.527 54.169 -22.234 1.00 0.00 H new ATOM 347 N LEU A 23 43.057 53.393 -21.043 1.00 0.00 N ATOM 348 CA LEU A 23 44.428 52.943 -21.299 1.00 0.00 C ATOM 349 C LEU A 23 44.997 52.161 -20.103 1.00 0.00 C ATOM 350 O LEU A 23 45.604 51.113 -20.292 1.00 0.00 O ATOM 351 CB LEU A 23 45.296 54.170 -21.638 1.00 0.00 C ATOM 352 CG LEU A 23 46.765 53.833 -21.950 1.00 0.00 C ATOM 353 CD1 LEU A 23 46.917 53.040 -23.244 1.00 0.00 C ATOM 354 CD2 LEU A 23 47.595 55.109 -22.073 1.00 0.00 C ATOM 0 H LEU A 23 42.945 54.405 -21.106 1.00 0.00 H new ATOM 0 HA LEU A 23 44.431 52.256 -22.145 1.00 0.00 H new ATOM 0 HB2 LEU A 23 44.862 54.683 -22.496 1.00 0.00 H new ATOM 0 HB3 LEU A 23 45.264 54.867 -20.800 1.00 0.00 H new ATOM 0 HG LEU A 23 47.121 53.222 -21.120 1.00 0.00 H new ATOM 0 HD11 LEU A 23 47.972 52.828 -23.419 1.00 0.00 H new ATOM 0 HD12 LEU A 23 46.367 52.103 -23.163 1.00 0.00 H new ATOM 0 HD13 LEU A 23 46.521 53.622 -24.076 1.00 0.00 H new ATOM 0 HD21 LEU A 23 48.630 54.850 -22.294 1.00 0.00 H new ATOM 0 HD22 LEU A 23 47.196 55.726 -22.878 1.00 0.00 H new ATOM 0 HD23 LEU A 23 47.552 55.663 -21.135 1.00 0.00 H new ATOM 366 N ASN A 24 44.771 52.632 -18.877 1.00 0.00 N ATOM 367 CA ASN A 24 45.186 51.990 -17.631 1.00 0.00 C ATOM 368 C ASN A 24 44.492 50.635 -17.441 1.00 0.00 C ATOM 369 O ASN A 24 45.167 49.657 -17.135 1.00 0.00 O ATOM 370 CB ASN A 24 44.913 52.965 -16.473 1.00 0.00 C ATOM 371 CG ASN A 24 45.456 52.512 -15.129 1.00 0.00 C ATOM 372 OD1 ASN A 24 45.082 51.486 -14.580 1.00 0.00 O ATOM 373 ND2 ASN A 24 46.341 53.287 -14.542 1.00 0.00 N ATOM 0 H ASN A 24 44.273 53.508 -18.719 1.00 0.00 H new ATOM 0 HA ASN A 24 46.253 51.768 -17.659 1.00 0.00 H new ATOM 0 HB2 ASN A 24 45.349 53.933 -16.719 1.00 0.00 H new ATOM 0 HB3 ASN A 24 43.837 53.113 -16.385 1.00 0.00 H new ATOM 0 HD21 ASN A 24 46.716 53.032 -13.628 1.00 0.00 H new ATOM 0 HD22 ASN A 24 46.653 54.143 -15.000 1.00 0.00 H new ATOM 380 N GLN A 25 43.183 50.531 -17.698 1.00 0.00 N ATOM 381 CA GLN A 25 42.487 49.239 -17.669 1.00 0.00 C ATOM 382 C GLN A 25 42.982 48.258 -18.752 1.00 0.00 C ATOM 383 O GLN A 25 43.017 47.053 -18.494 1.00 0.00 O ATOM 384 CB GLN A 25 40.967 49.435 -17.756 1.00 0.00 C ATOM 385 CG GLN A 25 40.347 50.054 -16.489 1.00 0.00 C ATOM 386 CD GLN A 25 39.131 49.259 -16.010 1.00 0.00 C ATOM 387 OE1 GLN A 25 39.197 48.468 -15.078 1.00 0.00 O ATOM 388 NE2 GLN A 25 37.984 49.406 -16.643 1.00 0.00 N ATOM 0 H GLN A 25 42.585 51.325 -17.928 1.00 0.00 H new ATOM 0 HA GLN A 25 42.728 48.781 -16.710 1.00 0.00 H new ATOM 0 HB2 GLN A 25 40.741 50.074 -18.610 1.00 0.00 H new ATOM 0 HB3 GLN A 25 40.496 48.471 -17.946 1.00 0.00 H new ATOM 0 HG2 GLN A 25 41.095 50.088 -15.697 1.00 0.00 H new ATOM 0 HG3 GLN A 25 40.052 51.083 -16.693 1.00 0.00 H new ATOM 0 HE21 GLN A 25 37.912 50.061 -17.422 1.00 0.00 H new ATOM 0 HE22 GLN A 25 37.169 48.865 -16.354 1.00 0.00 H new ATOM 397 N SER A 26 43.404 48.731 -19.933 1.00 0.00 N ATOM 398 CA SER A 26 44.136 47.901 -20.908 1.00 0.00 C ATOM 399 C SER A 26 45.512 47.484 -20.384 1.00 0.00 C ATOM 400 O SER A 26 45.813 46.296 -20.364 1.00 0.00 O ATOM 401 CB SER A 26 44.314 48.617 -22.253 1.00 0.00 C ATOM 402 OG SER A 26 43.119 48.537 -23.003 1.00 0.00 O ATOM 0 H SER A 26 43.251 49.691 -20.240 1.00 0.00 H new ATOM 0 HA SER A 26 43.526 47.010 -21.057 1.00 0.00 H new ATOM 0 HB2 SER A 26 44.580 49.661 -22.087 1.00 0.00 H new ATOM 0 HB3 SER A 26 45.134 48.164 -22.810 1.00 0.00 H new ATOM 0 HG SER A 26 43.239 48.998 -23.860 1.00 0.00 H new ATOM 408 N LEU A 27 46.340 48.428 -19.927 1.00 0.00 N ATOM 409 CA LEU A 27 47.696 48.180 -19.420 1.00 0.00 C ATOM 410 C LEU A 27 47.717 47.231 -18.209 1.00 0.00 C ATOM 411 O LEU A 27 48.566 46.347 -18.143 1.00 0.00 O ATOM 412 CB LEU A 27 48.362 49.527 -19.078 1.00 0.00 C ATOM 413 CG LEU A 27 48.818 50.353 -20.297 1.00 0.00 C ATOM 414 CD1 LEU A 27 49.257 51.744 -19.836 1.00 0.00 C ATOM 415 CD2 LEU A 27 50.004 49.710 -21.019 1.00 0.00 C ATOM 0 H LEU A 27 46.080 49.414 -19.898 1.00 0.00 H new ATOM 0 HA LEU A 27 48.260 47.676 -20.205 1.00 0.00 H new ATOM 0 HB2 LEU A 27 47.662 50.124 -18.494 1.00 0.00 H new ATOM 0 HB3 LEU A 27 49.227 49.337 -18.442 1.00 0.00 H new ATOM 0 HG LEU A 27 47.972 50.405 -20.982 1.00 0.00 H new ATOM 0 HD11 LEU A 27 49.579 52.328 -20.698 1.00 0.00 H new ATOM 0 HD12 LEU A 27 48.421 52.247 -19.349 1.00 0.00 H new ATOM 0 HD13 LEU A 27 50.084 51.650 -19.132 1.00 0.00 H new ATOM 0 HD21 LEU A 27 50.290 50.327 -21.871 1.00 0.00 H new ATOM 0 HD22 LEU A 27 50.846 49.627 -20.332 1.00 0.00 H new ATOM 0 HD23 LEU A 27 49.722 48.717 -21.369 1.00 0.00 H new ATOM 427 N ASP A 28 46.769 47.366 -17.281 1.00 0.00 N ATOM 428 CA ASP A 28 46.599 46.474 -16.130 1.00 0.00 C ATOM 429 C ASP A 28 46.223 45.046 -16.562 1.00 0.00 C ATOM 430 O ASP A 28 46.859 44.084 -16.127 1.00 0.00 O ATOM 431 CB ASP A 28 45.532 47.067 -15.198 1.00 0.00 C ATOM 432 CG ASP A 28 45.342 46.221 -13.929 1.00 0.00 C ATOM 433 OD1 ASP A 28 46.207 46.288 -13.022 1.00 0.00 O ATOM 434 OD2 ASP A 28 44.317 45.506 -13.824 1.00 0.00 O ATOM 0 H ASP A 28 46.080 48.117 -17.308 1.00 0.00 H new ATOM 0 HA ASP A 28 47.549 46.397 -15.600 1.00 0.00 H new ATOM 0 HB2 ASP A 28 45.818 48.081 -14.918 1.00 0.00 H new ATOM 0 HB3 ASP A 28 44.584 47.139 -15.731 1.00 0.00 H new ATOM 439 N ALA A 29 45.248 44.901 -17.470 1.00 0.00 N ATOM 440 CA ALA A 29 44.877 43.606 -18.042 1.00 0.00 C ATOM 441 C ALA A 29 46.036 42.964 -18.828 1.00 0.00 C ATOM 442 O ALA A 29 46.300 41.771 -18.676 1.00 0.00 O ATOM 443 CB ALA A 29 43.633 43.791 -18.919 1.00 0.00 C ATOM 0 H ALA A 29 44.696 45.681 -17.827 1.00 0.00 H new ATOM 0 HA ALA A 29 44.649 42.915 -17.231 1.00 0.00 H new ATOM 0 HB1 ALA A 29 43.347 42.832 -19.351 1.00 0.00 H new ATOM 0 HB2 ALA A 29 42.813 44.175 -18.311 1.00 0.00 H new ATOM 0 HB3 ALA A 29 43.853 44.498 -19.719 1.00 0.00 H new ATOM 449 N LEU A 30 46.770 43.754 -19.620 1.00 0.00 N ATOM 450 CA LEU A 30 47.973 43.335 -20.341 1.00 0.00 C ATOM 451 C LEU A 30 49.071 42.830 -19.393 1.00 0.00 C ATOM 452 O LEU A 30 49.691 41.807 -19.684 1.00 0.00 O ATOM 453 CB LEU A 30 48.501 44.512 -21.184 1.00 0.00 C ATOM 454 CG LEU A 30 47.724 44.813 -22.479 1.00 0.00 C ATOM 455 CD1 LEU A 30 48.163 46.164 -23.046 1.00 0.00 C ATOM 456 CD2 LEU A 30 47.991 43.734 -23.526 1.00 0.00 C ATOM 0 H LEU A 30 46.534 44.733 -19.780 1.00 0.00 H new ATOM 0 HA LEU A 30 47.701 42.503 -20.990 1.00 0.00 H new ATOM 0 HB2 LEU A 30 48.497 45.408 -20.564 1.00 0.00 H new ATOM 0 HB3 LEU A 30 49.540 44.310 -21.445 1.00 0.00 H new ATOM 0 HG LEU A 30 46.660 44.834 -22.242 1.00 0.00 H new ATOM 0 HD11 LEU A 30 47.610 46.371 -23.962 1.00 0.00 H new ATOM 0 HD12 LEU A 30 47.962 46.948 -22.316 1.00 0.00 H new ATOM 0 HD13 LEU A 30 49.230 46.137 -23.265 1.00 0.00 H new ATOM 0 HD21 LEU A 30 47.434 43.963 -24.435 1.00 0.00 H new ATOM 0 HD22 LEU A 30 49.057 43.702 -23.752 1.00 0.00 H new ATOM 0 HD23 LEU A 30 47.673 42.766 -23.140 1.00 0.00 H new ATOM 468 N LEU A 31 49.300 43.501 -18.257 1.00 0.00 N ATOM 469 CA LEU A 31 50.277 43.076 -17.248 1.00 0.00 C ATOM 470 C LEU A 31 49.849 41.752 -16.587 1.00 0.00 C ATOM 471 O LEU A 31 50.641 40.811 -16.518 1.00 0.00 O ATOM 472 CB LEU A 31 50.479 44.211 -16.215 1.00 0.00 C ATOM 473 CG LEU A 31 51.911 44.416 -15.680 1.00 0.00 C ATOM 474 CD1 LEU A 31 52.477 43.197 -14.953 1.00 0.00 C ATOM 475 CD2 LEU A 31 52.888 44.821 -16.786 1.00 0.00 C ATOM 0 H LEU A 31 48.809 44.360 -18.011 1.00 0.00 H new ATOM 0 HA LEU A 31 51.236 42.883 -17.730 1.00 0.00 H new ATOM 0 HB2 LEU A 31 50.148 45.146 -16.668 1.00 0.00 H new ATOM 0 HB3 LEU A 31 49.823 44.019 -15.366 1.00 0.00 H new ATOM 0 HG LEU A 31 51.813 45.226 -14.958 1.00 0.00 H new ATOM 0 HD11 LEU A 31 53.487 43.417 -14.606 1.00 0.00 H new ATOM 0 HD12 LEU A 31 51.844 42.956 -14.099 1.00 0.00 H new ATOM 0 HD13 LEU A 31 52.505 42.347 -15.635 1.00 0.00 H new ATOM 0 HD21 LEU A 31 53.883 44.954 -16.362 1.00 0.00 H new ATOM 0 HD22 LEU A 31 52.919 44.041 -17.547 1.00 0.00 H new ATOM 0 HD23 LEU A 31 52.558 45.756 -17.238 1.00 0.00 H new ATOM 487 N SER A 32 48.578 41.630 -16.182 1.00 0.00 N ATOM 488 CA SER A 32 48.012 40.395 -15.610 1.00 0.00 C ATOM 489 C SER A 32 48.008 39.206 -16.586 1.00 0.00 C ATOM 490 O SER A 32 48.169 38.061 -16.156 1.00 0.00 O ATOM 491 CB SER A 32 46.587 40.644 -15.099 1.00 0.00 C ATOM 492 OG SER A 32 46.613 41.547 -14.003 1.00 0.00 O ATOM 0 H SER A 32 47.904 42.393 -16.242 1.00 0.00 H new ATOM 0 HA SER A 32 48.668 40.123 -14.783 1.00 0.00 H new ATOM 0 HB2 SER A 32 45.971 41.051 -15.901 1.00 0.00 H new ATOM 0 HB3 SER A 32 46.132 39.702 -14.793 1.00 0.00 H new ATOM 0 HG SER A 32 45.699 41.701 -13.685 1.00 0.00 H new ATOM 498 N ARG A 33 47.872 39.457 -17.898 1.00 0.00 N ATOM 499 CA ARG A 33 47.973 38.448 -18.975 1.00 0.00 C ATOM 500 C ARG A 33 49.421 38.194 -19.447 1.00 0.00 C ATOM 501 O ARG A 33 49.647 37.332 -20.295 1.00 0.00 O ATOM 502 CB ARG A 33 47.076 38.883 -20.156 1.00 0.00 C ATOM 503 CG ARG A 33 46.555 37.697 -20.992 1.00 0.00 C ATOM 504 CD ARG A 33 46.110 38.117 -22.400 1.00 0.00 C ATOM 505 NE ARG A 33 44.952 39.035 -22.393 1.00 0.00 N ATOM 506 CZ ARG A 33 43.675 38.708 -22.512 1.00 0.00 C ATOM 507 NH1 ARG A 33 43.274 37.469 -22.564 1.00 0.00 N ATOM 508 NH2 ARG A 33 42.764 39.635 -22.583 1.00 0.00 N ATOM 0 H ARG A 33 47.683 40.394 -18.253 1.00 0.00 H new ATOM 0 HA ARG A 33 47.629 37.497 -18.568 1.00 0.00 H new ATOM 0 HB2 ARG A 33 46.227 39.448 -19.770 1.00 0.00 H new ATOM 0 HB3 ARG A 33 47.639 39.556 -20.803 1.00 0.00 H new ATOM 0 HG2 ARG A 33 47.338 36.942 -21.072 1.00 0.00 H new ATOM 0 HG3 ARG A 33 45.716 37.232 -20.473 1.00 0.00 H new ATOM 0 HD2 ARG A 33 46.945 38.599 -22.910 1.00 0.00 H new ATOM 0 HD3 ARG A 33 45.856 37.226 -22.975 1.00 0.00 H new ATOM 0 HE ARG A 33 45.159 40.028 -22.285 1.00 0.00 H new ATOM 0 HH11 ARG A 33 43.954 36.710 -22.513 1.00 0.00 H new ATOM 0 HH12 ARG A 33 42.280 37.258 -22.656 1.00 0.00 H new ATOM 0 HH21 ARG A 33 43.033 40.618 -22.547 1.00 0.00 H new ATOM 0 HH22 ARG A 33 41.781 39.378 -22.675 1.00 0.00 H new ATOM 522 N ASP A 34 50.402 38.935 -18.924 1.00 0.00 N ATOM 523 CA ASP A 34 51.800 38.976 -19.393 1.00 0.00 C ATOM 524 C ASP A 34 51.943 39.225 -20.919 1.00 0.00 C ATOM 525 O ASP A 34 52.834 38.693 -21.585 1.00 0.00 O ATOM 526 CB ASP A 34 52.554 37.737 -18.868 1.00 0.00 C ATOM 527 CG ASP A 34 54.082 37.836 -19.035 1.00 0.00 C ATOM 528 OD1 ASP A 34 54.669 38.899 -18.717 1.00 0.00 O ATOM 529 OD2 ASP A 34 54.715 36.825 -19.429 1.00 0.00 O ATOM 0 H ASP A 34 50.242 39.551 -18.127 1.00 0.00 H new ATOM 0 HA ASP A 34 52.281 39.856 -18.967 1.00 0.00 H new ATOM 0 HB2 ASP A 34 52.319 37.598 -17.813 1.00 0.00 H new ATOM 0 HB3 ASP A 34 52.195 36.852 -19.394 1.00 0.00 H new ATOM 534 N LEU A 35 51.042 40.043 -21.481 1.00 0.00 N ATOM 535 CA LEU A 35 50.993 40.437 -22.900 1.00 0.00 C ATOM 536 C LEU A 35 51.688 41.799 -23.160 1.00 0.00 C ATOM 537 O LEU A 35 51.761 42.256 -24.300 1.00 0.00 O ATOM 538 CB LEU A 35 49.516 40.361 -23.356 1.00 0.00 C ATOM 539 CG LEU A 35 49.214 40.624 -24.850 1.00 0.00 C ATOM 540 CD1 LEU A 35 50.029 39.739 -25.795 1.00 0.00 C ATOM 541 CD2 LEU A 35 47.734 40.364 -25.150 1.00 0.00 C ATOM 0 H LEU A 35 50.292 40.469 -20.936 1.00 0.00 H new ATOM 0 HA LEU A 35 51.573 39.748 -23.514 1.00 0.00 H new ATOM 0 HB2 LEU A 35 49.138 39.370 -23.106 1.00 0.00 H new ATOM 0 HB3 LEU A 35 48.945 41.078 -22.766 1.00 0.00 H new ATOM 0 HG LEU A 35 49.484 41.666 -25.023 1.00 0.00 H new ATOM 0 HD11 LEU A 35 49.770 39.974 -26.827 1.00 0.00 H new ATOM 0 HD12 LEU A 35 51.092 39.921 -25.638 1.00 0.00 H new ATOM 0 HD13 LEU A 35 49.807 38.691 -25.594 1.00 0.00 H new ATOM 0 HD21 LEU A 35 47.538 40.554 -26.205 1.00 0.00 H new ATOM 0 HD22 LEU A 35 47.492 39.327 -24.917 1.00 0.00 H new ATOM 0 HD23 LEU A 35 47.118 41.026 -24.542 1.00 0.00 H new ATOM 553 N ILE A 36 52.264 42.421 -22.123 1.00 0.00 N ATOM 554 CA ILE A 36 53.166 43.583 -22.217 1.00 0.00 C ATOM 555 C ILE A 36 54.409 43.362 -21.335 1.00 0.00 C ATOM 556 O ILE A 36 54.298 42.939 -20.182 1.00 0.00 O ATOM 557 CB ILE A 36 52.406 44.891 -21.877 1.00 0.00 C ATOM 558 CG1 ILE A 36 53.208 46.126 -22.339 1.00 0.00 C ATOM 559 CG2 ILE A 36 52.022 45.000 -20.389 1.00 0.00 C ATOM 560 CD1 ILE A 36 52.462 47.454 -22.155 1.00 0.00 C ATOM 0 H ILE A 36 52.111 42.121 -21.160 1.00 0.00 H new ATOM 0 HA ILE A 36 53.520 43.689 -23.243 1.00 0.00 H new ATOM 0 HB ILE A 36 51.467 44.857 -22.429 1.00 0.00 H new ATOM 0 HG12 ILE A 36 54.145 46.167 -21.784 1.00 0.00 H new ATOM 0 HG13 ILE A 36 53.465 46.007 -23.392 1.00 0.00 H new ATOM 0 HG21 ILE A 36 51.493 45.938 -20.217 1.00 0.00 H new ATOM 0 HG22 ILE A 36 51.377 44.164 -20.118 1.00 0.00 H new ATOM 0 HG23 ILE A 36 52.924 44.975 -19.778 1.00 0.00 H new ATOM 0 HD11 ILE A 36 53.089 48.275 -22.502 1.00 0.00 H new ATOM 0 HD12 ILE A 36 51.537 47.435 -22.732 1.00 0.00 H new ATOM 0 HD13 ILE A 36 52.228 47.597 -21.100 1.00 0.00 H new ATOM 572 N MET A 37 55.601 43.624 -21.881 1.00 0.00 N ATOM 573 CA MET A 37 56.859 43.616 -21.118 1.00 0.00 C ATOM 574 C MET A 37 57.000 44.886 -20.268 1.00 0.00 C ATOM 575 O MET A 37 56.535 45.955 -20.663 1.00 0.00 O ATOM 576 CB MET A 37 58.060 43.514 -22.073 1.00 0.00 C ATOM 577 CG MET A 37 58.219 42.106 -22.655 1.00 0.00 C ATOM 578 SD MET A 37 59.675 41.938 -23.725 1.00 0.00 S ATOM 579 CE MET A 37 59.723 40.133 -23.896 1.00 0.00 C ATOM 0 H MET A 37 55.724 43.849 -22.868 1.00 0.00 H new ATOM 0 HA MET A 37 56.839 42.750 -20.456 1.00 0.00 H new ATOM 0 HB2 MET A 37 57.937 44.230 -22.886 1.00 0.00 H new ATOM 0 HB3 MET A 37 58.970 43.790 -21.540 1.00 0.00 H new ATOM 0 HG2 MET A 37 58.291 41.388 -21.838 1.00 0.00 H new ATOM 0 HG3 MET A 37 57.325 41.852 -23.225 1.00 0.00 H new ATOM 0 HE1 MET A 37 60.564 39.850 -24.528 1.00 0.00 H new ATOM 0 HE2 MET A 37 59.839 39.677 -22.913 1.00 0.00 H new ATOM 0 HE3 MET A 37 58.795 39.786 -24.350 1.00 0.00 H new ATOM 589 N LYS A 38 57.711 44.799 -19.136 1.00 0.00 N ATOM 590 CA LYS A 38 57.999 45.945 -18.250 1.00 0.00 C ATOM 591 C LYS A 38 58.744 47.088 -18.955 1.00 0.00 C ATOM 592 O LYS A 38 58.464 48.256 -18.686 1.00 0.00 O ATOM 593 CB LYS A 38 58.737 45.428 -17.002 1.00 0.00 C ATOM 594 CG LYS A 38 59.024 46.515 -15.949 1.00 0.00 C ATOM 595 CD LYS A 38 60.492 46.975 -15.959 1.00 0.00 C ATOM 596 CE LYS A 38 60.686 48.099 -14.931 1.00 0.00 C ATOM 597 NZ LYS A 38 62.125 48.377 -14.676 1.00 0.00 N ATOM 0 H LYS A 38 58.109 43.922 -18.802 1.00 0.00 H new ATOM 0 HA LYS A 38 57.055 46.396 -17.945 1.00 0.00 H new ATOM 0 HB2 LYS A 38 58.143 44.639 -16.542 1.00 0.00 H new ATOM 0 HB3 LYS A 38 59.680 44.978 -17.311 1.00 0.00 H new ATOM 0 HG2 LYS A 38 58.377 47.373 -16.132 1.00 0.00 H new ATOM 0 HG3 LYS A 38 58.774 46.132 -14.960 1.00 0.00 H new ATOM 0 HD2 LYS A 38 61.148 46.137 -15.725 1.00 0.00 H new ATOM 0 HD3 LYS A 38 60.767 47.326 -16.954 1.00 0.00 H new ATOM 0 HE2 LYS A 38 60.199 49.006 -15.289 1.00 0.00 H new ATOM 0 HE3 LYS A 38 60.198 47.823 -13.996 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 62.212 49.142 -13.977 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 62.585 47.519 -14.310 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 62.585 48.665 -15.563 1.00 0.00 H new ATOM 611 N GLU A 39 59.642 46.770 -19.891 1.00 0.00 N ATOM 612 CA GLU A 39 60.299 47.778 -20.739 1.00 0.00 C ATOM 613 C GLU A 39 59.286 48.557 -21.590 1.00 0.00 C ATOM 614 O GLU A 39 59.286 49.785 -21.563 1.00 0.00 O ATOM 615 CB GLU A 39 61.354 47.135 -21.654 1.00 0.00 C ATOM 616 CG GLU A 39 62.582 46.638 -20.881 1.00 0.00 C ATOM 617 CD GLU A 39 63.712 46.230 -21.847 1.00 0.00 C ATOM 618 OE1 GLU A 39 63.716 45.072 -22.334 1.00 0.00 O ATOM 619 OE2 GLU A 39 64.612 47.062 -22.122 1.00 0.00 O ATOM 0 H GLU A 39 59.936 45.813 -20.085 1.00 0.00 H new ATOM 0 HA GLU A 39 60.793 48.478 -20.065 1.00 0.00 H new ATOM 0 HB2 GLU A 39 60.904 46.299 -22.190 1.00 0.00 H new ATOM 0 HB3 GLU A 39 61.670 47.861 -22.403 1.00 0.00 H new ATOM 0 HG2 GLU A 39 62.936 47.421 -20.211 1.00 0.00 H new ATOM 0 HG3 GLU A 39 62.305 45.787 -20.259 1.00 0.00 H new ATOM 626 N ASP A 40 58.386 47.870 -22.304 1.00 0.00 N ATOM 627 CA ASP A 40 57.348 48.531 -23.104 1.00 0.00 C ATOM 628 C ASP A 40 56.347 49.299 -22.223 1.00 0.00 C ATOM 629 O ASP A 40 56.000 50.434 -22.537 1.00 0.00 O ATOM 630 CB ASP A 40 56.632 47.510 -23.995 1.00 0.00 C ATOM 631 CG ASP A 40 55.728 48.214 -25.023 1.00 0.00 C ATOM 632 OD1 ASP A 40 56.265 48.813 -25.984 1.00 0.00 O ATOM 633 OD2 ASP A 40 54.487 48.145 -24.888 1.00 0.00 O ATOM 0 H ASP A 40 58.356 46.851 -22.344 1.00 0.00 H new ATOM 0 HA ASP A 40 57.837 49.267 -23.743 1.00 0.00 H new ATOM 0 HB2 ASP A 40 57.368 46.895 -24.513 1.00 0.00 H new ATOM 0 HB3 ASP A 40 56.034 46.840 -23.378 1.00 0.00 H new ATOM 638 N TYR A 41 55.948 48.729 -21.080 1.00 0.00 N ATOM 639 CA TYR A 41 55.066 49.363 -20.096 1.00 0.00 C ATOM 640 C TYR A 41 55.613 50.716 -19.602 1.00 0.00 C ATOM 641 O TYR A 41 54.870 51.698 -19.562 1.00 0.00 O ATOM 642 CB TYR A 41 54.844 48.381 -18.934 1.00 0.00 C ATOM 643 CG TYR A 41 53.789 48.787 -17.919 1.00 0.00 C ATOM 644 CD1 TYR A 41 54.125 49.633 -16.843 1.00 0.00 C ATOM 645 CD2 TYR A 41 52.485 48.262 -18.013 1.00 0.00 C ATOM 646 CE1 TYR A 41 53.161 49.953 -15.865 1.00 0.00 C ATOM 647 CE2 TYR A 41 51.527 48.559 -17.025 1.00 0.00 C ATOM 648 CZ TYR A 41 51.859 49.412 -15.952 1.00 0.00 C ATOM 649 OH TYR A 41 50.923 49.695 -15.004 1.00 0.00 O ATOM 0 H TYR A 41 56.238 47.790 -20.808 1.00 0.00 H new ATOM 0 HA TYR A 41 54.112 49.590 -20.572 1.00 0.00 H new ATOM 0 HB2 TYR A 41 54.568 47.412 -19.350 1.00 0.00 H new ATOM 0 HB3 TYR A 41 55.791 48.245 -18.412 1.00 0.00 H new ATOM 0 HD1 TYR A 41 55.124 50.037 -16.767 1.00 0.00 H new ATOM 0 HD2 TYR A 41 52.219 47.629 -18.847 1.00 0.00 H new ATOM 0 HE1 TYR A 41 53.418 50.612 -15.049 1.00 0.00 H new ATOM 0 HE2 TYR A 41 50.537 48.133 -17.089 1.00 0.00 H new ATOM 0 HH TYR A 41 50.085 49.238 -15.225 1.00 0.00 H new ATOM 659 N GLU A 42 56.912 50.806 -19.278 1.00 0.00 N ATOM 660 CA GLU A 42 57.540 52.085 -18.913 1.00 0.00 C ATOM 661 C GLU A 42 57.835 52.996 -20.115 1.00 0.00 C ATOM 662 O GLU A 42 57.657 54.206 -20.003 1.00 0.00 O ATOM 663 CB GLU A 42 58.819 51.886 -18.084 1.00 0.00 C ATOM 664 CG GLU A 42 58.511 51.481 -16.634 1.00 0.00 C ATOM 665 CD GLU A 42 59.673 51.857 -15.692 1.00 0.00 C ATOM 666 OE1 GLU A 42 60.787 51.295 -15.830 1.00 0.00 O ATOM 667 OE2 GLU A 42 59.479 52.714 -14.795 1.00 0.00 O ATOM 0 H GLU A 42 57.548 50.009 -19.261 1.00 0.00 H new ATOM 0 HA GLU A 42 56.795 52.592 -18.300 1.00 0.00 H new ATOM 0 HB2 GLU A 42 59.437 51.119 -18.551 1.00 0.00 H new ATOM 0 HB3 GLU A 42 59.399 52.809 -18.087 1.00 0.00 H new ATOM 0 HG2 GLU A 42 57.597 51.973 -16.302 1.00 0.00 H new ATOM 0 HG3 GLU A 42 58.331 50.407 -16.584 1.00 0.00 H new ATOM 674 N LEU A 43 58.221 52.473 -21.284 1.00 0.00 N ATOM 675 CA LEU A 43 58.379 53.291 -22.501 1.00 0.00 C ATOM 676 C LEU A 43 57.044 53.916 -22.967 1.00 0.00 C ATOM 677 O LEU A 43 57.036 54.997 -23.555 1.00 0.00 O ATOM 678 CB LEU A 43 59.050 52.455 -23.608 1.00 0.00 C ATOM 679 CG LEU A 43 60.546 52.167 -23.350 1.00 0.00 C ATOM 680 CD1 LEU A 43 61.055 51.092 -24.313 1.00 0.00 C ATOM 681 CD2 LEU A 43 61.420 53.412 -23.534 1.00 0.00 C ATOM 0 H LEU A 43 58.431 51.484 -21.417 1.00 0.00 H new ATOM 0 HA LEU A 43 59.029 54.133 -22.264 1.00 0.00 H new ATOM 0 HB2 LEU A 43 58.519 51.508 -23.708 1.00 0.00 H new ATOM 0 HB3 LEU A 43 58.949 52.979 -24.558 1.00 0.00 H new ATOM 0 HG LEU A 43 60.620 51.832 -22.315 1.00 0.00 H new ATOM 0 HD11 LEU A 43 62.110 50.900 -24.119 1.00 0.00 H new ATOM 0 HD12 LEU A 43 60.486 50.174 -24.167 1.00 0.00 H new ATOM 0 HD13 LEU A 43 60.932 51.436 -25.340 1.00 0.00 H new ATOM 0 HD21 LEU A 43 62.462 53.157 -23.341 1.00 0.00 H new ATOM 0 HD22 LEU A 43 61.319 53.780 -24.555 1.00 0.00 H new ATOM 0 HD23 LEU A 43 61.101 54.187 -22.837 1.00 0.00 H new ATOM 693 N VAL A 44 55.908 53.283 -22.649 1.00 0.00 N ATOM 694 CA VAL A 44 54.544 53.829 -22.791 1.00 0.00 C ATOM 695 C VAL A 44 54.212 54.900 -21.734 1.00 0.00 C ATOM 696 O VAL A 44 53.281 55.675 -21.945 1.00 0.00 O ATOM 697 CB VAL A 44 53.522 52.663 -22.829 1.00 0.00 C ATOM 698 CG1 VAL A 44 52.048 53.071 -22.697 1.00 0.00 C ATOM 699 CG2 VAL A 44 53.635 51.910 -24.165 1.00 0.00 C ATOM 0 H VAL A 44 55.910 52.336 -22.269 1.00 0.00 H new ATOM 0 HA VAL A 44 54.482 54.363 -23.739 1.00 0.00 H new ATOM 0 HB VAL A 44 53.783 52.058 -21.960 1.00 0.00 H new ATOM 0 HG11 VAL A 44 51.419 52.181 -22.736 1.00 0.00 H new ATOM 0 HG12 VAL A 44 51.896 53.582 -21.746 1.00 0.00 H new ATOM 0 HG13 VAL A 44 51.781 53.740 -23.515 1.00 0.00 H new ATOM 0 HG21 VAL A 44 52.914 51.093 -24.184 1.00 0.00 H new ATOM 0 HG22 VAL A 44 53.429 52.595 -24.987 1.00 0.00 H new ATOM 0 HG23 VAL A 44 54.642 51.508 -24.272 1.00 0.00 H new ATOM 709 N SER A 45 54.984 55.034 -20.645 1.00 0.00 N ATOM 710 CA SER A 45 54.745 56.010 -19.562 1.00 0.00 C ATOM 711 C SER A 45 55.817 57.106 -19.417 1.00 0.00 C ATOM 712 O SER A 45 55.609 58.056 -18.658 1.00 0.00 O ATOM 713 CB SER A 45 54.489 55.296 -18.225 1.00 0.00 C ATOM 714 OG SER A 45 55.681 54.788 -17.652 1.00 0.00 O ATOM 0 H SER A 45 55.810 54.457 -20.486 1.00 0.00 H new ATOM 0 HA SER A 45 53.846 56.548 -19.862 1.00 0.00 H new ATOM 0 HB2 SER A 45 54.020 55.991 -17.528 1.00 0.00 H new ATOM 0 HB3 SER A 45 53.786 54.478 -18.381 1.00 0.00 H new ATOM 0 HG SER A 45 56.365 54.697 -18.348 1.00 0.00 H new ATOM 720 N THR A 46 56.917 57.064 -20.185 1.00 0.00 N ATOM 721 CA THR A 46 57.872 58.190 -20.320 1.00 0.00 C ATOM 722 C THR A 46 57.254 59.438 -20.966 1.00 0.00 C ATOM 723 O THR A 46 57.775 60.545 -20.796 1.00 0.00 O ATOM 724 CB THR A 46 59.106 57.819 -21.161 1.00 0.00 C ATOM 725 OG1 THR A 46 58.701 57.315 -22.414 1.00 0.00 O ATOM 726 CG2 THR A 46 60.013 56.782 -20.503 1.00 0.00 C ATOM 0 H THR A 46 57.176 56.245 -20.736 1.00 0.00 H new ATOM 0 HA THR A 46 58.159 58.410 -19.292 1.00 0.00 H new ATOM 0 HB THR A 46 59.679 58.740 -21.264 1.00 0.00 H new ATOM 0 HG1 THR A 46 59.492 57.083 -22.944 1.00 0.00 H new ATOM 0 HG21 THR A 46 60.860 56.573 -21.156 1.00 0.00 H new ATOM 0 HG22 THR A 46 60.376 57.168 -19.551 1.00 0.00 H new ATOM 0 HG23 THR A 46 59.451 55.864 -20.332 1.00 0.00 H new ATOM 734 N LYS A 47 56.154 59.278 -21.717 1.00 0.00 N ATOM 735 CA LYS A 47 55.454 60.353 -22.441 1.00 0.00 C ATOM 736 C LYS A 47 54.944 61.459 -21.487 1.00 0.00 C ATOM 737 O LYS A 47 54.477 61.138 -20.390 1.00 0.00 O ATOM 738 CB LYS A 47 54.278 59.760 -23.237 1.00 0.00 C ATOM 739 CG LYS A 47 54.599 58.561 -24.151 1.00 0.00 C ATOM 740 CD LYS A 47 55.597 58.817 -25.292 1.00 0.00 C ATOM 741 CE LYS A 47 57.053 58.538 -24.890 1.00 0.00 C ATOM 742 NZ LYS A 47 57.930 58.488 -26.090 1.00 0.00 N ATOM 0 H LYS A 47 55.712 58.367 -21.842 1.00 0.00 H new ATOM 0 HA LYS A 47 56.168 60.815 -23.123 1.00 0.00 H new ATOM 0 HB2 LYS A 47 53.508 59.453 -22.529 1.00 0.00 H new ATOM 0 HB3 LYS A 47 53.849 60.551 -23.851 1.00 0.00 H new ATOM 0 HG2 LYS A 47 54.989 57.754 -23.531 1.00 0.00 H new ATOM 0 HG3 LYS A 47 53.666 58.205 -24.587 1.00 0.00 H new ATOM 0 HD2 LYS A 47 55.335 58.190 -26.144 1.00 0.00 H new ATOM 0 HD3 LYS A 47 55.508 59.853 -25.619 1.00 0.00 H new ATOM 0 HE2 LYS A 47 57.403 59.315 -24.210 1.00 0.00 H new ATOM 0 HE3 LYS A 47 57.112 57.592 -24.351 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 58.921 58.383 -25.792 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 57.660 57.678 -26.684 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 57.824 59.368 -26.635 1.00 0.00 H new ATOM 756 N PRO A 48 54.976 62.747 -21.888 1.00 0.00 N ATOM 757 CA PRO A 48 54.583 63.868 -21.026 1.00 0.00 C ATOM 758 C PRO A 48 53.061 64.034 -20.857 1.00 0.00 C ATOM 759 O PRO A 48 52.626 64.721 -19.930 1.00 0.00 O ATOM 760 CB PRO A 48 55.192 65.109 -21.687 1.00 0.00 C ATOM 761 CG PRO A 48 55.204 64.747 -23.171 1.00 0.00 C ATOM 762 CD PRO A 48 55.490 63.246 -23.157 1.00 0.00 C ATOM 0 HA PRO A 48 54.943 63.696 -20.012 1.00 0.00 H new ATOM 0 HB2 PRO A 48 54.595 66.001 -21.495 1.00 0.00 H new ATOM 0 HB3 PRO A 48 56.196 65.311 -21.314 1.00 0.00 H new ATOM 0 HG2 PRO A 48 54.250 64.972 -23.649 1.00 0.00 H new ATOM 0 HG3 PRO A 48 55.971 65.299 -23.715 1.00 0.00 H new ATOM 0 HD2 PRO A 48 55.004 62.749 -23.997 1.00 0.00 H new ATOM 0 HD3 PRO A 48 56.559 63.052 -23.247 1.00 0.00 H new ATOM 770 N THR A 49 52.249 63.422 -21.727 1.00 0.00 N ATOM 771 CA THR A 49 50.781 63.573 -21.755 1.00 0.00 C ATOM 772 C THR A 49 50.065 62.247 -22.013 1.00 0.00 C ATOM 773 O THR A 49 50.593 61.332 -22.649 1.00 0.00 O ATOM 774 CB THR A 49 50.327 64.588 -22.823 1.00 0.00 C ATOM 775 OG1 THR A 49 50.825 64.227 -24.093 1.00 0.00 O ATOM 776 CG2 THR A 49 50.787 66.013 -22.521 1.00 0.00 C ATOM 0 H THR A 49 52.598 62.792 -22.450 1.00 0.00 H new ATOM 0 HA THR A 49 50.509 63.939 -20.765 1.00 0.00 H new ATOM 0 HB THR A 49 49.237 64.567 -22.812 1.00 0.00 H new ATOM 0 HG1 THR A 49 50.526 64.881 -24.759 1.00 0.00 H new ATOM 0 HG21 THR A 49 50.438 66.682 -23.307 1.00 0.00 H new ATOM 0 HG22 THR A 49 50.376 66.333 -21.563 1.00 0.00 H new ATOM 0 HG23 THR A 49 51.876 66.042 -22.477 1.00 0.00 H new ATOM 784 N ARG A 50 48.825 62.156 -21.522 1.00 0.00 N ATOM 785 CA ARG A 50 47.965 60.958 -21.561 1.00 0.00 C ATOM 786 C ARG A 50 47.614 60.522 -22.984 1.00 0.00 C ATOM 787 O ARG A 50 47.676 59.337 -23.299 1.00 0.00 O ATOM 788 CB ARG A 50 46.699 61.264 -20.743 1.00 0.00 C ATOM 789 CG ARG A 50 47.039 61.404 -19.249 1.00 0.00 C ATOM 790 CD ARG A 50 45.920 62.082 -18.443 1.00 0.00 C ATOM 791 NE ARG A 50 46.229 63.509 -18.209 1.00 0.00 N ATOM 792 CZ ARG A 50 47.030 63.998 -17.274 1.00 0.00 C ATOM 793 NH1 ARG A 50 47.590 63.240 -16.372 1.00 0.00 N ATOM 794 NH2 ARG A 50 47.301 65.270 -17.234 1.00 0.00 N ATOM 0 H ARG A 50 48.369 62.946 -21.066 1.00 0.00 H new ATOM 0 HA ARG A 50 48.509 60.117 -21.130 1.00 0.00 H new ATOM 0 HB2 ARG A 50 46.240 62.184 -21.105 1.00 0.00 H new ATOM 0 HB3 ARG A 50 45.968 60.467 -20.882 1.00 0.00 H new ATOM 0 HG2 ARG A 50 47.233 60.416 -18.832 1.00 0.00 H new ATOM 0 HG3 ARG A 50 47.957 61.981 -19.143 1.00 0.00 H new ATOM 0 HD2 ARG A 50 44.975 61.993 -18.979 1.00 0.00 H new ATOM 0 HD3 ARG A 50 45.794 61.572 -17.488 1.00 0.00 H new ATOM 0 HE ARG A 50 45.781 64.184 -18.829 1.00 0.00 H new ATOM 0 HH11 ARG A 50 47.417 62.235 -16.371 1.00 0.00 H new ATOM 0 HH12 ARG A 50 48.201 63.652 -15.667 1.00 0.00 H new ATOM 0 HH21 ARG A 50 46.896 65.900 -17.926 1.00 0.00 H new ATOM 0 HH22 ARG A 50 47.919 65.637 -16.510 1.00 0.00 H new ATOM 808 N THR A 51 47.326 61.482 -23.860 1.00 0.00 N ATOM 809 CA THR A 51 47.127 61.268 -25.305 1.00 0.00 C ATOM 810 C THR A 51 48.378 60.683 -25.971 1.00 0.00 C ATOM 811 O THR A 51 48.283 59.743 -26.764 1.00 0.00 O ATOM 812 CB THR A 51 46.741 62.595 -25.984 1.00 0.00 C ATOM 813 OG1 THR A 51 47.640 63.615 -25.591 1.00 0.00 O ATOM 814 CG2 THR A 51 45.338 63.051 -25.576 1.00 0.00 C ATOM 0 H THR A 51 47.220 62.458 -23.585 1.00 0.00 H new ATOM 0 HA THR A 51 46.319 60.546 -25.426 1.00 0.00 H new ATOM 0 HB THR A 51 46.775 62.424 -27.060 1.00 0.00 H new ATOM 0 HG1 THR A 51 47.391 64.456 -26.027 1.00 0.00 H new ATOM 0 HG21 THR A 51 45.101 63.991 -26.075 1.00 0.00 H new ATOM 0 HG22 THR A 51 44.610 62.293 -25.866 1.00 0.00 H new ATOM 0 HG23 THR A 51 45.302 63.195 -24.496 1.00 0.00 H new ATOM 822 N SER A 52 49.565 61.175 -25.597 1.00 0.00 N ATOM 823 CA SER A 52 50.856 60.671 -26.080 1.00 0.00 C ATOM 824 C SER A 52 51.196 59.265 -25.551 1.00 0.00 C ATOM 825 O SER A 52 51.742 58.453 -26.304 1.00 0.00 O ATOM 826 CB SER A 52 51.954 61.688 -25.758 1.00 0.00 C ATOM 827 OG SER A 52 53.168 61.337 -26.398 1.00 0.00 O ATOM 0 H SER A 52 49.657 61.948 -24.938 1.00 0.00 H new ATOM 0 HA SER A 52 50.785 60.555 -27.161 1.00 0.00 H new ATOM 0 HB2 SER A 52 51.642 62.681 -26.080 1.00 0.00 H new ATOM 0 HB3 SER A 52 52.107 61.736 -24.680 1.00 0.00 H new ATOM 0 HG SER A 52 53.856 62.000 -26.181 1.00 0.00 H new ATOM 833 N LYS A 53 50.794 58.900 -24.316 1.00 0.00 N ATOM 834 CA LYS A 53 50.890 57.503 -23.826 1.00 0.00 C ATOM 835 C LYS A 53 50.192 56.521 -24.772 1.00 0.00 C ATOM 836 O LYS A 53 50.781 55.501 -25.135 1.00 0.00 O ATOM 837 CB LYS A 53 50.327 57.309 -22.406 1.00 0.00 C ATOM 838 CG LYS A 53 51.044 58.061 -21.276 1.00 0.00 C ATOM 839 CD LYS A 53 50.531 57.617 -19.891 1.00 0.00 C ATOM 840 CE LYS A 53 50.956 56.180 -19.516 1.00 0.00 C ATOM 841 NZ LYS A 53 49.800 55.278 -19.254 1.00 0.00 N ATOM 0 H LYS A 53 50.399 59.551 -23.637 1.00 0.00 H new ATOM 0 HA LYS A 53 51.959 57.292 -23.795 1.00 0.00 H new ATOM 0 HB2 LYS A 53 49.281 57.615 -22.409 1.00 0.00 H new ATOM 0 HB3 LYS A 53 50.347 56.244 -22.174 1.00 0.00 H new ATOM 0 HG2 LYS A 53 52.117 57.883 -21.342 1.00 0.00 H new ATOM 0 HG3 LYS A 53 50.891 59.133 -21.396 1.00 0.00 H new ATOM 0 HD2 LYS A 53 50.903 58.308 -19.134 1.00 0.00 H new ATOM 0 HD3 LYS A 53 49.443 57.683 -19.876 1.00 0.00 H new ATOM 0 HE2 LYS A 53 51.558 55.763 -20.323 1.00 0.00 H new ATOM 0 HE3 LYS A 53 51.590 56.215 -18.630 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 50.114 54.469 -18.681 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 49.061 55.800 -18.741 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 49.416 54.934 -20.157 1.00 0.00 H new ATOM 855 N VAL A 54 48.969 56.839 -25.221 1.00 0.00 N ATOM 856 CA VAL A 54 48.243 55.979 -26.175 1.00 0.00 C ATOM 857 C VAL A 54 49.007 55.855 -27.496 1.00 0.00 C ATOM 858 O VAL A 54 49.111 54.747 -28.008 1.00 0.00 O ATOM 859 CB VAL A 54 46.792 56.419 -26.465 1.00 0.00 C ATOM 860 CG1 VAL A 54 46.040 55.264 -27.150 1.00 0.00 C ATOM 861 CG2 VAL A 54 45.982 56.793 -25.221 1.00 0.00 C ATOM 0 H VAL A 54 48.462 57.679 -24.943 1.00 0.00 H new ATOM 0 HA VAL A 54 48.180 55.011 -25.678 1.00 0.00 H new ATOM 0 HB VAL A 54 46.879 57.308 -27.089 1.00 0.00 H new ATOM 0 HG11 VAL A 54 45.014 55.570 -27.357 1.00 0.00 H new ATOM 0 HG12 VAL A 54 46.539 55.009 -28.085 1.00 0.00 H new ATOM 0 HG13 VAL A 54 46.034 54.394 -26.494 1.00 0.00 H new ATOM 0 HG21 VAL A 54 44.976 57.089 -25.517 1.00 0.00 H new ATOM 0 HG22 VAL A 54 45.925 55.934 -24.552 1.00 0.00 H new ATOM 0 HG23 VAL A 54 46.468 57.622 -24.706 1.00 0.00 H new ATOM 871 N ARG A 55 49.607 56.937 -28.023 1.00 0.00 N ATOM 872 CA ARG A 55 50.440 56.907 -29.248 1.00 0.00 C ATOM 873 C ARG A 55 51.575 55.874 -29.185 1.00 0.00 C ATOM 874 O ARG A 55 51.754 55.123 -30.143 1.00 0.00 O ATOM 875 CB ARG A 55 51.018 58.306 -29.557 1.00 0.00 C ATOM 876 CG ARG A 55 50.322 59.066 -30.694 1.00 0.00 C ATOM 877 CD ARG A 55 48.855 59.419 -30.406 1.00 0.00 C ATOM 878 NE ARG A 55 48.425 60.607 -31.175 1.00 0.00 N ATOM 879 CZ ARG A 55 48.220 60.710 -32.477 1.00 0.00 C ATOM 880 NH1 ARG A 55 48.281 59.686 -33.281 1.00 0.00 N ATOM 881 NH2 ARG A 55 47.959 61.870 -33.007 1.00 0.00 N ATOM 0 H ARG A 55 49.529 57.867 -27.611 1.00 0.00 H new ATOM 0 HA ARG A 55 49.774 56.601 -30.055 1.00 0.00 H new ATOM 0 HB2 ARG A 55 50.965 58.911 -28.652 1.00 0.00 H new ATOM 0 HB3 ARG A 55 52.073 58.198 -29.807 1.00 0.00 H new ATOM 0 HG2 ARG A 55 50.873 59.985 -30.893 1.00 0.00 H new ATOM 0 HG3 ARG A 55 50.368 58.463 -31.601 1.00 0.00 H new ATOM 0 HD2 ARG A 55 48.219 58.571 -30.658 1.00 0.00 H new ATOM 0 HD3 ARG A 55 48.727 59.608 -29.340 1.00 0.00 H new ATOM 0 HE ARG A 55 48.266 61.455 -30.631 1.00 0.00 H new ATOM 0 HH11 ARG A 55 48.494 58.759 -32.911 1.00 0.00 H new ATOM 0 HH12 ARG A 55 48.116 59.811 -34.280 1.00 0.00 H new ATOM 0 HH21 ARG A 55 47.912 62.701 -32.418 1.00 0.00 H new ATOM 0 HH22 ARG A 55 47.801 61.948 -34.012 1.00 0.00 H new ATOM 895 N GLN A 56 52.310 55.789 -28.071 1.00 0.00 N ATOM 896 CA GLN A 56 53.382 54.792 -27.910 1.00 0.00 C ATOM 897 C GLN A 56 52.828 53.354 -27.912 1.00 0.00 C ATOM 898 O GLN A 56 53.365 52.478 -28.591 1.00 0.00 O ATOM 899 CB GLN A 56 54.164 55.063 -26.615 1.00 0.00 C ATOM 900 CG GLN A 56 55.484 54.261 -26.543 1.00 0.00 C ATOM 901 CD GLN A 56 56.713 54.946 -27.150 1.00 0.00 C ATOM 902 OE1 GLN A 56 56.785 56.153 -27.354 1.00 0.00 O ATOM 903 NE2 GLN A 56 57.756 54.196 -27.443 1.00 0.00 N ATOM 0 H GLN A 56 52.184 56.399 -27.263 1.00 0.00 H new ATOM 0 HA GLN A 56 54.055 54.885 -28.762 1.00 0.00 H new ATOM 0 HB2 GLN A 56 54.385 56.128 -26.544 1.00 0.00 H new ATOM 0 HB3 GLN A 56 53.541 54.809 -25.758 1.00 0.00 H new ATOM 0 HG2 GLN A 56 55.695 54.038 -25.497 1.00 0.00 H new ATOM 0 HG3 GLN A 56 55.336 53.307 -27.049 1.00 0.00 H new ATOM 0 HE21 GLN A 56 57.721 53.189 -27.283 1.00 0.00 H new ATOM 0 HE22 GLN A 56 58.598 54.622 -27.830 1.00 0.00 H new ATOM 912 N LEU A 57 51.723 53.114 -27.194 1.00 0.00 N ATOM 913 CA LEU A 57 51.000 51.837 -27.217 1.00 0.00 C ATOM 914 C LEU A 57 50.519 51.491 -28.644 1.00 0.00 C ATOM 915 O LEU A 57 50.641 50.345 -29.071 1.00 0.00 O ATOM 916 CB LEU A 57 49.864 51.925 -26.179 1.00 0.00 C ATOM 917 CG LEU A 57 48.892 50.725 -26.159 1.00 0.00 C ATOM 918 CD1 LEU A 57 48.919 49.987 -24.819 1.00 0.00 C ATOM 919 CD2 LEU A 57 47.468 51.202 -26.425 1.00 0.00 C ATOM 0 H LEU A 57 51.302 53.808 -26.575 1.00 0.00 H new ATOM 0 HA LEU A 57 51.654 51.010 -26.941 1.00 0.00 H new ATOM 0 HB2 LEU A 57 50.307 52.029 -25.188 1.00 0.00 H new ATOM 0 HB3 LEU A 57 49.291 52.832 -26.369 1.00 0.00 H new ATOM 0 HG LEU A 57 49.217 50.037 -26.939 1.00 0.00 H new ATOM 0 HD11 LEU A 57 48.220 49.151 -24.850 1.00 0.00 H new ATOM 0 HD12 LEU A 57 49.925 49.613 -24.630 1.00 0.00 H new ATOM 0 HD13 LEU A 57 48.631 50.671 -24.021 1.00 0.00 H new ATOM 0 HD21 LEU A 57 46.790 50.349 -26.409 1.00 0.00 H new ATOM 0 HD22 LEU A 57 47.173 51.915 -25.655 1.00 0.00 H new ATOM 0 HD23 LEU A 57 47.422 51.684 -27.402 1.00 0.00 H new ATOM 931 N LEU A 58 50.048 52.486 -29.402 1.00 0.00 N ATOM 932 CA LEU A 58 49.638 52.387 -30.809 1.00 0.00 C ATOM 933 C LEU A 58 50.787 51.934 -31.732 1.00 0.00 C ATOM 934 O LEU A 58 50.578 51.074 -32.586 1.00 0.00 O ATOM 935 CB LEU A 58 49.050 53.750 -31.244 1.00 0.00 C ATOM 936 CG LEU A 58 47.693 53.660 -31.959 1.00 0.00 C ATOM 937 CD1 LEU A 58 46.946 54.991 -31.841 1.00 0.00 C ATOM 938 CD2 LEU A 58 47.877 53.331 -33.437 1.00 0.00 C ATOM 0 H LEU A 58 49.936 53.431 -29.034 1.00 0.00 H new ATOM 0 HA LEU A 58 48.876 51.613 -30.901 1.00 0.00 H new ATOM 0 HB2 LEU A 58 48.941 54.382 -30.363 1.00 0.00 H new ATOM 0 HB3 LEU A 58 49.762 54.244 -31.905 1.00 0.00 H new ATOM 0 HG LEU A 58 47.118 52.866 -31.483 1.00 0.00 H new ATOM 0 HD11 LEU A 58 45.986 54.916 -32.351 1.00 0.00 H new ATOM 0 HD12 LEU A 58 46.781 55.223 -30.789 1.00 0.00 H new ATOM 0 HD13 LEU A 58 47.539 55.783 -32.299 1.00 0.00 H new ATOM 0 HD21 LEU A 58 46.902 53.273 -33.921 1.00 0.00 H new ATOM 0 HD22 LEU A 58 48.472 54.111 -33.912 1.00 0.00 H new ATOM 0 HD23 LEU A 58 48.389 52.374 -33.536 1.00 0.00 H new ATOM 950 N ASP A 59 52.010 52.442 -31.538 1.00 0.00 N ATOM 951 CA ASP A 59 53.193 51.960 -32.269 1.00 0.00 C ATOM 952 C ASP A 59 53.484 50.475 -31.982 1.00 0.00 C ATOM 953 O ASP A 59 53.650 49.690 -32.919 1.00 0.00 O ATOM 954 CB ASP A 59 54.434 52.813 -31.949 1.00 0.00 C ATOM 955 CG ASP A 59 54.456 54.152 -32.705 1.00 0.00 C ATOM 956 OD1 ASP A 59 54.400 54.142 -33.959 1.00 0.00 O ATOM 957 OD2 ASP A 59 54.590 55.217 -32.057 1.00 0.00 O ATOM 0 H ASP A 59 52.209 53.192 -30.876 1.00 0.00 H new ATOM 0 HA ASP A 59 52.965 52.058 -33.330 1.00 0.00 H new ATOM 0 HB2 ASP A 59 54.468 53.007 -30.877 1.00 0.00 H new ATOM 0 HB3 ASP A 59 55.331 52.247 -32.199 1.00 0.00 H new ATOM 962 N THR A 60 53.492 50.057 -30.710 1.00 0.00 N ATOM 963 CA THR A 60 53.700 48.643 -30.335 1.00 0.00 C ATOM 964 C THR A 60 52.546 47.738 -30.787 1.00 0.00 C ATOM 965 O THR A 60 52.778 46.587 -31.158 1.00 0.00 O ATOM 966 CB THR A 60 53.983 48.493 -28.828 1.00 0.00 C ATOM 967 OG1 THR A 60 55.153 49.225 -28.526 1.00 0.00 O ATOM 968 CG2 THR A 60 54.237 47.038 -28.421 1.00 0.00 C ATOM 0 H THR A 60 53.356 50.680 -29.914 1.00 0.00 H new ATOM 0 HA THR A 60 54.586 48.306 -30.872 1.00 0.00 H new ATOM 0 HB THR A 60 53.107 48.854 -28.289 1.00 0.00 H new ATOM 0 HG1 THR A 60 55.451 49.006 -27.619 1.00 0.00 H new ATOM 0 HG21 THR A 60 54.431 46.988 -27.350 1.00 0.00 H new ATOM 0 HG22 THR A 60 53.361 46.435 -28.659 1.00 0.00 H new ATOM 0 HG23 THR A 60 55.100 46.654 -28.964 1.00 0.00 H new ATOM 976 N THR A 61 51.314 48.249 -30.864 1.00 0.00 N ATOM 977 CA THR A 61 50.162 47.532 -31.438 1.00 0.00 C ATOM 978 C THR A 61 50.422 47.053 -32.868 1.00 0.00 C ATOM 979 O THR A 61 50.075 45.924 -33.221 1.00 0.00 O ATOM 980 CB THR A 61 48.885 48.394 -31.331 1.00 0.00 C ATOM 981 OG1 THR A 61 47.936 47.692 -30.575 1.00 0.00 O ATOM 982 CG2 THR A 61 48.168 48.774 -32.624 1.00 0.00 C ATOM 0 H THR A 61 51.081 49.183 -30.527 1.00 0.00 H new ATOM 0 HA THR A 61 50.008 46.627 -30.850 1.00 0.00 H new ATOM 0 HB THR A 61 49.252 49.324 -30.898 1.00 0.00 H new ATOM 0 HG1 THR A 61 47.583 48.275 -29.870 1.00 0.00 H new ATOM 0 HG21 THR A 61 47.291 49.378 -32.390 1.00 0.00 H new ATOM 0 HG22 THR A 61 48.844 49.346 -33.260 1.00 0.00 H new ATOM 0 HG23 THR A 61 47.856 47.870 -33.147 1.00 0.00 H new ATOM 990 N ASP A 62 51.086 47.877 -33.682 1.00 0.00 N ATOM 991 CA ASP A 62 51.428 47.556 -35.071 1.00 0.00 C ATOM 992 C ASP A 62 52.538 46.484 -35.185 1.00 0.00 C ATOM 993 O ASP A 62 52.664 45.813 -36.211 1.00 0.00 O ATOM 994 CB ASP A 62 51.812 48.854 -35.802 1.00 0.00 C ATOM 995 CG ASP A 62 51.230 48.901 -37.223 1.00 0.00 C ATOM 996 OD1 ASP A 62 50.048 49.301 -37.369 1.00 0.00 O ATOM 997 OD2 ASP A 62 51.957 48.580 -38.194 1.00 0.00 O ATOM 0 H ASP A 62 51.406 48.801 -33.391 1.00 0.00 H new ATOM 0 HA ASP A 62 50.552 47.115 -35.547 1.00 0.00 H new ATOM 0 HB2 ASP A 62 51.453 49.712 -35.233 1.00 0.00 H new ATOM 0 HB3 ASP A 62 52.898 48.936 -35.851 1.00 0.00 H new ATOM 1002 N ILE A 63 53.326 46.294 -34.116 1.00 0.00 N ATOM 1003 CA ILE A 63 54.358 45.249 -33.991 1.00 0.00 C ATOM 1004 C ILE A 63 53.729 43.924 -33.521 1.00 0.00 C ATOM 1005 O ILE A 63 54.039 42.863 -34.067 1.00 0.00 O ATOM 1006 CB ILE A 63 55.480 45.713 -33.020 1.00 0.00 C ATOM 1007 CG1 ILE A 63 56.130 47.028 -33.519 1.00 0.00 C ATOM 1008 CG2 ILE A 63 56.552 44.620 -32.840 1.00 0.00 C ATOM 1009 CD1 ILE A 63 57.154 47.642 -32.556 1.00 0.00 C ATOM 0 H ILE A 63 53.262 46.883 -33.286 1.00 0.00 H new ATOM 0 HA ILE A 63 54.806 45.079 -34.970 1.00 0.00 H new ATOM 0 HB ILE A 63 55.020 45.899 -32.049 1.00 0.00 H new ATOM 0 HG12 ILE A 63 56.619 46.836 -34.474 1.00 0.00 H new ATOM 0 HG13 ILE A 63 55.343 47.759 -33.705 1.00 0.00 H new ATOM 0 HG21 ILE A 63 57.322 44.975 -32.156 1.00 0.00 H new ATOM 0 HG22 ILE A 63 56.090 43.721 -32.432 1.00 0.00 H new ATOM 0 HG23 ILE A 63 57.003 44.390 -33.805 1.00 0.00 H new ATOM 0 HD11 ILE A 63 57.556 48.558 -32.988 1.00 0.00 H new ATOM 0 HD12 ILE A 63 56.669 47.871 -31.607 1.00 0.00 H new ATOM 0 HD13 ILE A 63 57.965 46.934 -32.388 1.00 0.00 H new ATOM 1021 N GLN A 64 52.840 43.975 -32.522 1.00 0.00 N ATOM 1022 CA GLN A 64 52.227 42.788 -31.909 1.00 0.00 C ATOM 1023 C GLN A 64 51.211 42.074 -32.816 1.00 0.00 C ATOM 1024 O GLN A 64 51.212 40.841 -32.876 1.00 0.00 O ATOM 1025 CB GLN A 64 51.529 43.193 -30.602 1.00 0.00 C ATOM 1026 CG GLN A 64 52.501 43.559 -29.469 1.00 0.00 C ATOM 1027 CD GLN A 64 53.363 42.378 -29.024 1.00 0.00 C ATOM 1028 OE1 GLN A 64 52.881 41.306 -28.683 1.00 0.00 O ATOM 1029 NE2 GLN A 64 54.673 42.516 -29.026 1.00 0.00 N ATOM 0 H GLN A 64 52.521 44.852 -32.111 1.00 0.00 H new ATOM 0 HA GLN A 64 53.038 42.083 -31.728 1.00 0.00 H new ATOM 0 HB2 GLN A 64 50.876 44.044 -30.798 1.00 0.00 H new ATOM 0 HB3 GLN A 64 50.892 42.372 -30.271 1.00 0.00 H new ATOM 0 HG2 GLN A 64 53.148 44.371 -29.800 1.00 0.00 H new ATOM 0 HG3 GLN A 64 51.934 43.931 -28.616 1.00 0.00 H new ATOM 0 HE21 GLN A 64 55.092 43.402 -29.307 1.00 0.00 H new ATOM 0 HE22 GLN A 64 55.268 41.736 -28.746 1.00 0.00 H new ATOM 1038 N GLY A 65 50.343 42.823 -33.509 1.00 0.00 N ATOM 1039 CA GLY A 65 49.309 42.264 -34.388 1.00 0.00 C ATOM 1040 C GLY A 65 47.894 42.326 -33.800 1.00 0.00 C ATOM 1041 O GLY A 65 47.579 43.155 -32.944 1.00 0.00 O ATOM 0 H GLY A 65 50.339 43.842 -33.475 1.00 0.00 H new ATOM 0 HA2 GLY A 65 49.322 42.802 -35.336 1.00 0.00 H new ATOM 0 HA3 GLY A 65 49.555 41.225 -34.608 1.00 0.00 H new ATOM 1045 N GLU A 66 47.017 41.443 -34.283 1.00 0.00 N ATOM 1046 CA GLU A 66 45.577 41.350 -33.962 1.00 0.00 C ATOM 1047 C GLU A 66 45.269 40.823 -32.535 1.00 0.00 C ATOM 1048 O GLU A 66 44.293 40.112 -32.304 1.00 0.00 O ATOM 1049 CB GLU A 66 44.903 40.527 -35.079 1.00 0.00 C ATOM 1050 CG GLU A 66 43.410 40.838 -35.266 1.00 0.00 C ATOM 1051 CD GLU A 66 42.931 40.279 -36.618 1.00 0.00 C ATOM 1052 OE1 GLU A 66 42.523 39.095 -36.681 1.00 0.00 O ATOM 1053 OE2 GLU A 66 42.977 41.035 -37.620 1.00 0.00 O ATOM 0 H GLU A 66 47.303 40.727 -34.950 1.00 0.00 H new ATOM 0 HA GLU A 66 45.157 42.355 -33.935 1.00 0.00 H new ATOM 0 HB2 GLU A 66 45.423 40.713 -36.019 1.00 0.00 H new ATOM 0 HB3 GLU A 66 45.018 39.466 -34.855 1.00 0.00 H new ATOM 0 HG2 GLU A 66 42.832 40.397 -34.454 1.00 0.00 H new ATOM 0 HG3 GLU A 66 43.245 41.915 -35.227 1.00 0.00 H new ATOM 1060 N GLU A 67 46.112 41.171 -31.558 1.00 0.00 N ATOM 1061 CA GLU A 67 46.016 40.775 -30.143 1.00 0.00 C ATOM 1062 C GLU A 67 46.107 42.008 -29.232 1.00 0.00 C ATOM 1063 O GLU A 67 45.168 42.305 -28.495 1.00 0.00 O ATOM 1064 CB GLU A 67 47.130 39.771 -29.793 1.00 0.00 C ATOM 1065 CG GLU A 67 46.962 38.415 -30.489 1.00 0.00 C ATOM 1066 CD GLU A 67 48.078 37.440 -30.062 1.00 0.00 C ATOM 1067 OE1 GLU A 67 49.152 37.414 -30.712 1.00 0.00 O ATOM 1068 OE2 GLU A 67 47.885 36.685 -29.078 1.00 0.00 O ATOM 0 H GLU A 67 46.921 41.766 -31.738 1.00 0.00 H new ATOM 0 HA GLU A 67 45.050 40.297 -29.983 1.00 0.00 H new ATOM 0 HB2 GLU A 67 48.094 40.197 -30.070 1.00 0.00 H new ATOM 0 HB3 GLU A 67 47.147 39.619 -28.714 1.00 0.00 H new ATOM 0 HG2 GLU A 67 45.988 37.992 -30.241 1.00 0.00 H new ATOM 0 HG3 GLU A 67 46.985 38.551 -31.570 1.00 0.00 H new ATOM 1075 N PHE A 68 47.190 42.782 -29.347 1.00 0.00 N ATOM 1076 CA PHE A 68 47.364 44.063 -28.651 1.00 0.00 C ATOM 1077 C PHE A 68 46.404 45.123 -29.218 1.00 0.00 C ATOM 1078 O PHE A 68 45.732 45.826 -28.463 1.00 0.00 O ATOM 1079 CB PHE A 68 48.836 44.477 -28.798 1.00 0.00 C ATOM 1080 CG PHE A 68 49.456 45.280 -27.672 1.00 0.00 C ATOM 1081 CD1 PHE A 68 49.908 44.614 -26.516 1.00 0.00 C ATOM 1082 CD2 PHE A 68 49.729 46.654 -27.822 1.00 0.00 C ATOM 1083 CE1 PHE A 68 50.635 45.311 -25.535 1.00 0.00 C ATOM 1084 CE2 PHE A 68 50.464 47.346 -26.846 1.00 0.00 C ATOM 1085 CZ PHE A 68 50.918 46.676 -25.702 1.00 0.00 C ATOM 0 H PHE A 68 47.985 42.533 -29.936 1.00 0.00 H new ATOM 0 HA PHE A 68 47.121 43.966 -27.593 1.00 0.00 H new ATOM 0 HB2 PHE A 68 49.428 43.571 -28.930 1.00 0.00 H new ATOM 0 HB3 PHE A 68 48.932 45.057 -29.716 1.00 0.00 H new ATOM 0 HD1 PHE A 68 49.695 43.564 -26.383 1.00 0.00 H new ATOM 0 HD2 PHE A 68 49.370 47.179 -28.695 1.00 0.00 H new ATOM 0 HE1 PHE A 68 50.977 44.795 -24.650 1.00 0.00 H new ATOM 0 HE2 PHE A 68 50.680 48.396 -26.977 1.00 0.00 H new ATOM 0 HZ PHE A 68 51.484 47.208 -24.951 1.00 0.00 H new ATOM 1095 N ALA A 69 46.240 45.161 -30.549 1.00 0.00 N ATOM 1096 CA ALA A 69 45.251 46.018 -31.208 1.00 0.00 C ATOM 1097 C ALA A 69 43.818 45.617 -30.827 1.00 0.00 C ATOM 1098 O ALA A 69 42.991 46.472 -30.509 1.00 0.00 O ATOM 1099 CB ALA A 69 45.479 45.948 -32.721 1.00 0.00 C ATOM 0 H ALA A 69 46.791 44.597 -31.196 1.00 0.00 H new ATOM 0 HA ALA A 69 45.377 47.048 -30.873 1.00 0.00 H new ATOM 0 HB1 ALA A 69 44.751 46.581 -33.228 1.00 0.00 H new ATOM 0 HB2 ALA A 69 46.486 46.295 -32.954 1.00 0.00 H new ATOM 0 HB3 ALA A 69 45.363 44.918 -33.059 1.00 0.00 H new ATOM 1105 N LYS A 70 43.540 44.305 -30.791 1.00 0.00 N ATOM 1106 CA LYS A 70 42.266 43.749 -30.312 1.00 0.00 C ATOM 1107 C LYS A 70 41.962 44.182 -28.875 1.00 0.00 C ATOM 1108 O LYS A 70 40.845 44.630 -28.629 1.00 0.00 O ATOM 1109 CB LYS A 70 42.263 42.219 -30.515 1.00 0.00 C ATOM 1110 CG LYS A 70 41.224 41.473 -29.656 1.00 0.00 C ATOM 1111 CD LYS A 70 40.978 40.023 -30.098 1.00 0.00 C ATOM 1112 CE LYS A 70 42.260 39.175 -30.145 1.00 0.00 C ATOM 1113 NZ LYS A 70 42.099 37.861 -29.470 1.00 0.00 N ATOM 0 H LYS A 70 44.202 43.592 -31.097 1.00 0.00 H new ATOM 0 HA LYS A 70 41.446 44.156 -30.904 1.00 0.00 H new ATOM 0 HB2 LYS A 70 42.072 42.003 -31.566 1.00 0.00 H new ATOM 0 HB3 LYS A 70 43.255 41.831 -30.285 1.00 0.00 H new ATOM 0 HG2 LYS A 70 41.556 41.475 -28.618 1.00 0.00 H new ATOM 0 HG3 LYS A 70 40.281 42.018 -29.689 1.00 0.00 H new ATOM 0 HD2 LYS A 70 40.268 39.558 -29.414 1.00 0.00 H new ATOM 0 HD3 LYS A 70 40.516 40.025 -31.085 1.00 0.00 H new ATOM 0 HE2 LYS A 70 42.547 39.013 -31.184 1.00 0.00 H new ATOM 0 HE3 LYS A 70 43.073 39.725 -29.672 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 42.990 37.329 -29.530 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 41.852 38.012 -28.471 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 41.342 37.322 -29.936 1.00 0.00 H new ATOM 1127 N VAL A 71 42.922 44.111 -27.944 1.00 0.00 N ATOM 1128 CA VAL A 71 42.679 44.472 -26.531 1.00 0.00 C ATOM 1129 C VAL A 71 42.205 45.919 -26.362 1.00 0.00 C ATOM 1130 O VAL A 71 41.303 46.156 -25.563 1.00 0.00 O ATOM 1131 CB VAL A 71 43.877 44.134 -25.609 1.00 0.00 C ATOM 1132 CG1 VAL A 71 44.737 45.328 -25.167 1.00 0.00 C ATOM 1133 CG2 VAL A 71 43.373 43.452 -24.332 1.00 0.00 C ATOM 0 H VAL A 71 43.876 43.807 -28.138 1.00 0.00 H new ATOM 0 HA VAL A 71 41.854 43.839 -26.203 1.00 0.00 H new ATOM 0 HB VAL A 71 44.510 43.492 -26.222 1.00 0.00 H new ATOM 0 HG11 VAL A 71 45.545 44.977 -24.526 1.00 0.00 H new ATOM 0 HG12 VAL A 71 45.157 45.819 -26.045 1.00 0.00 H new ATOM 0 HG13 VAL A 71 44.119 46.037 -24.616 1.00 0.00 H new ATOM 0 HG21 VAL A 71 44.219 43.216 -23.687 1.00 0.00 H new ATOM 0 HG22 VAL A 71 42.692 44.121 -23.807 1.00 0.00 H new ATOM 0 HG23 VAL A 71 42.849 42.533 -24.593 1.00 0.00 H new ATOM 1143 N ILE A 72 42.735 46.867 -27.150 1.00 0.00 N ATOM 1144 CA ILE A 72 42.286 48.271 -27.156 1.00 0.00 C ATOM 1145 C ILE A 72 40.797 48.335 -27.502 1.00 0.00 C ATOM 1146 O ILE A 72 39.988 48.840 -26.726 1.00 0.00 O ATOM 1147 CB ILE A 72 43.110 49.124 -28.155 1.00 0.00 C ATOM 1148 CG1 ILE A 72 44.601 49.154 -27.763 1.00 0.00 C ATOM 1149 CG2 ILE A 72 42.557 50.561 -28.238 1.00 0.00 C ATOM 1150 CD1 ILE A 72 45.512 49.684 -28.880 1.00 0.00 C ATOM 0 H ILE A 72 43.493 46.681 -27.807 1.00 0.00 H new ATOM 0 HA ILE A 72 42.444 48.685 -26.160 1.00 0.00 H new ATOM 0 HB ILE A 72 43.021 48.658 -29.136 1.00 0.00 H new ATOM 0 HG12 ILE A 72 44.724 49.777 -26.877 1.00 0.00 H new ATOM 0 HG13 ILE A 72 44.919 48.147 -27.492 1.00 0.00 H new ATOM 0 HG21 ILE A 72 43.152 51.139 -28.945 1.00 0.00 H new ATOM 0 HG22 ILE A 72 41.520 50.533 -28.573 1.00 0.00 H new ATOM 0 HG23 ILE A 72 42.608 51.028 -27.254 1.00 0.00 H new ATOM 0 HD11 ILE A 72 46.547 49.679 -28.539 1.00 0.00 H new ATOM 0 HD12 ILE A 72 45.417 49.048 -29.760 1.00 0.00 H new ATOM 0 HD13 ILE A 72 45.219 50.702 -29.136 1.00 0.00 H new ATOM 1162 N VAL A 73 40.423 47.779 -28.654 1.00 0.00 N ATOM 1163 CA VAL A 73 39.049 47.833 -29.162 1.00 0.00 C ATOM 1164 C VAL A 73 38.075 47.103 -28.228 1.00 0.00 C ATOM 1165 O VAL A 73 37.014 47.641 -27.913 1.00 0.00 O ATOM 1166 CB VAL A 73 38.996 47.277 -30.593 1.00 0.00 C ATOM 1167 CG1 VAL A 73 37.598 47.426 -31.187 1.00 0.00 C ATOM 1168 CG2 VAL A 73 39.977 48.009 -31.518 1.00 0.00 C ATOM 0 H VAL A 73 41.066 47.276 -29.265 1.00 0.00 H new ATOM 0 HA VAL A 73 38.730 48.875 -29.190 1.00 0.00 H new ATOM 0 HB VAL A 73 39.268 46.224 -30.525 1.00 0.00 H new ATOM 0 HG11 VAL A 73 37.589 47.025 -32.200 1.00 0.00 H new ATOM 0 HG12 VAL A 73 36.882 46.879 -30.573 1.00 0.00 H new ATOM 0 HG13 VAL A 73 37.324 48.481 -31.212 1.00 0.00 H new ATOM 0 HG21 VAL A 73 39.912 47.589 -32.522 1.00 0.00 H new ATOM 0 HG22 VAL A 73 39.724 49.069 -31.551 1.00 0.00 H new ATOM 0 HG23 VAL A 73 40.992 47.889 -31.139 1.00 0.00 H new ATOM 1178 N GLN A 74 38.451 45.927 -27.712 1.00 0.00 N ATOM 1179 CA GLN A 74 37.690 45.206 -26.684 1.00 0.00 C ATOM 1180 C GLN A 74 37.517 46.037 -25.405 1.00 0.00 C ATOM 1181 O GLN A 74 36.420 46.052 -24.850 1.00 0.00 O ATOM 1182 CB GLN A 74 38.350 43.844 -26.371 1.00 0.00 C ATOM 1183 CG GLN A 74 37.591 42.642 -26.961 1.00 0.00 C ATOM 1184 CD GLN A 74 36.642 41.994 -25.952 1.00 0.00 C ATOM 1185 OE1 GLN A 74 36.996 41.067 -25.235 1.00 0.00 O ATOM 1186 NE2 GLN A 74 35.407 42.441 -25.853 1.00 0.00 N ATOM 0 H GLN A 74 39.302 45.443 -28.000 1.00 0.00 H new ATOM 0 HA GLN A 74 36.693 45.025 -27.086 1.00 0.00 H new ATOM 0 HB2 GLN A 74 39.369 43.846 -26.759 1.00 0.00 H new ATOM 0 HB3 GLN A 74 38.420 43.724 -25.290 1.00 0.00 H new ATOM 0 HG2 GLN A 74 37.022 42.968 -27.832 1.00 0.00 H new ATOM 0 HG3 GLN A 74 38.309 41.899 -27.309 1.00 0.00 H new ATOM 0 HE21 GLN A 74 35.095 43.213 -26.443 1.00 0.00 H new ATOM 0 HE22 GLN A 74 34.763 42.016 -25.187 1.00 0.00 H new ATOM 1195 N LYS A 75 38.545 46.775 -24.958 1.00 0.00 N ATOM 1196 CA LYS A 75 38.459 47.635 -23.769 1.00 0.00 C ATOM 1197 C LYS A 75 37.511 48.819 -23.960 1.00 0.00 C ATOM 1198 O LYS A 75 36.699 49.078 -23.073 1.00 0.00 O ATOM 1199 CB LYS A 75 39.861 48.115 -23.353 1.00 0.00 C ATOM 1200 CG LYS A 75 39.878 48.795 -21.971 1.00 0.00 C ATOM 1201 CD LYS A 75 39.445 47.884 -20.810 1.00 0.00 C ATOM 1202 CE LYS A 75 40.332 46.633 -20.709 1.00 0.00 C ATOM 1203 NZ LYS A 75 40.013 45.812 -19.511 1.00 0.00 N ATOM 0 H LYS A 75 39.459 46.792 -25.411 1.00 0.00 H new ATOM 0 HA LYS A 75 38.037 47.029 -22.967 1.00 0.00 H new ATOM 0 HB2 LYS A 75 40.542 47.264 -23.342 1.00 0.00 H new ATOM 0 HB3 LYS A 75 40.237 48.814 -24.100 1.00 0.00 H new ATOM 0 HG2 LYS A 75 40.885 49.162 -21.773 1.00 0.00 H new ATOM 0 HG3 LYS A 75 39.221 49.664 -21.999 1.00 0.00 H new ATOM 0 HD2 LYS A 75 39.492 48.440 -19.874 1.00 0.00 H new ATOM 0 HD3 LYS A 75 38.407 47.584 -20.951 1.00 0.00 H new ATOM 0 HE2 LYS A 75 40.206 46.027 -21.606 1.00 0.00 H new ATOM 0 HE3 LYS A 75 41.379 46.934 -20.672 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 40.636 44.980 -19.485 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 40.158 46.380 -18.652 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 39.022 45.501 -19.557 1.00 0.00 H new ATOM 1217 N LEU A 76 37.547 49.498 -25.112 1.00 0.00 N ATOM 1218 CA LEU A 76 36.553 50.531 -25.439 1.00 0.00 C ATOM 1219 C LEU A 76 35.123 49.954 -25.475 1.00 0.00 C ATOM 1220 O LEU A 76 34.182 50.613 -25.027 1.00 0.00 O ATOM 1221 CB LEU A 76 36.883 51.240 -26.769 1.00 0.00 C ATOM 1222 CG LEU A 76 37.941 52.362 -26.665 1.00 0.00 C ATOM 1223 CD1 LEU A 76 39.370 51.876 -26.878 1.00 0.00 C ATOM 1224 CD2 LEU A 76 37.649 53.440 -27.707 1.00 0.00 C ATOM 0 H LEU A 76 38.252 49.352 -25.834 1.00 0.00 H new ATOM 0 HA LEU A 76 36.598 51.273 -24.642 1.00 0.00 H new ATOM 0 HB2 LEU A 76 37.234 50.495 -27.483 1.00 0.00 H new ATOM 0 HB3 LEU A 76 35.965 51.664 -27.175 1.00 0.00 H new ATOM 0 HG LEU A 76 37.870 52.749 -25.649 1.00 0.00 H new ATOM 0 HD11 LEU A 76 40.057 52.717 -26.791 1.00 0.00 H new ATOM 0 HD12 LEU A 76 39.616 51.127 -26.125 1.00 0.00 H new ATOM 0 HD13 LEU A 76 39.460 51.435 -27.871 1.00 0.00 H new ATOM 0 HD21 LEU A 76 38.396 54.230 -27.632 1.00 0.00 H new ATOM 0 HD22 LEU A 76 37.684 53.001 -28.704 1.00 0.00 H new ATOM 0 HD23 LEU A 76 36.659 53.859 -27.529 1.00 0.00 H new ATOM 1236 N LYS A 77 34.960 48.715 -25.964 1.00 0.00 N ATOM 1237 CA LYS A 77 33.674 47.997 -25.979 1.00 0.00 C ATOM 1238 C LYS A 77 33.196 47.600 -24.576 1.00 0.00 C ATOM 1239 O LYS A 77 32.023 47.784 -24.269 1.00 0.00 O ATOM 1240 CB LYS A 77 33.764 46.780 -26.922 1.00 0.00 C ATOM 1241 CG LYS A 77 32.518 46.673 -27.819 1.00 0.00 C ATOM 1242 CD LYS A 77 32.643 45.562 -28.876 1.00 0.00 C ATOM 1243 CE LYS A 77 33.709 45.886 -29.940 1.00 0.00 C ATOM 1244 NZ LYS A 77 33.835 44.784 -30.934 1.00 0.00 N ATOM 0 H LYS A 77 35.727 48.176 -26.366 1.00 0.00 H new ATOM 0 HA LYS A 77 32.917 48.681 -26.361 1.00 0.00 H new ATOM 0 HB2 LYS A 77 34.656 46.864 -27.543 1.00 0.00 H new ATOM 0 HB3 LYS A 77 33.870 45.869 -26.334 1.00 0.00 H new ATOM 0 HG2 LYS A 77 31.643 46.481 -27.198 1.00 0.00 H new ATOM 0 HG3 LYS A 77 32.351 47.627 -28.318 1.00 0.00 H new ATOM 0 HD2 LYS A 77 32.897 44.623 -28.385 1.00 0.00 H new ATOM 0 HD3 LYS A 77 31.679 45.417 -29.363 1.00 0.00 H new ATOM 0 HE2 LYS A 77 33.445 46.812 -30.452 1.00 0.00 H new ATOM 0 HE3 LYS A 77 34.671 46.053 -29.455 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 34.560 45.032 -31.637 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 34.110 43.907 -30.447 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 32.923 44.642 -31.413 1.00 0.00 H new ATOM 1258 N ASP A 78 34.090 47.143 -23.695 1.00 0.00 N ATOM 1259 CA ASP A 78 33.801 46.892 -22.271 1.00 0.00 C ATOM 1260 C ASP A 78 33.403 48.183 -21.532 1.00 0.00 C ATOM 1261 O ASP A 78 32.487 48.176 -20.708 1.00 0.00 O ATOM 1262 CB ASP A 78 35.019 46.261 -21.568 1.00 0.00 C ATOM 1263 CG ASP A 78 35.281 44.787 -21.927 1.00 0.00 C ATOM 1264 OD1 ASP A 78 34.311 44.019 -22.145 1.00 0.00 O ATOM 1265 OD2 ASP A 78 36.466 44.376 -21.909 1.00 0.00 O ATOM 0 H ASP A 78 35.054 46.932 -23.951 1.00 0.00 H new ATOM 0 HA ASP A 78 32.960 46.199 -22.237 1.00 0.00 H new ATOM 0 HB2 ASP A 78 35.906 46.844 -21.816 1.00 0.00 H new ATOM 0 HB3 ASP A 78 34.878 46.338 -20.490 1.00 0.00 H new ATOM 1270 N ASN A 79 34.049 49.307 -21.863 1.00 0.00 N ATOM 1271 CA ASN A 79 33.723 50.643 -21.357 1.00 0.00 C ATOM 1272 C ASN A 79 32.458 51.264 -22.015 1.00 0.00 C ATOM 1273 O ASN A 79 32.028 52.344 -21.605 1.00 0.00 O ATOM 1274 CB ASN A 79 34.984 51.518 -21.510 1.00 0.00 C ATOM 1275 CG ASN A 79 34.924 52.805 -20.697 1.00 0.00 C ATOM 1276 OD1 ASN A 79 34.636 53.886 -21.189 1.00 0.00 O ATOM 1277 ND2 ASN A 79 35.200 52.733 -19.413 1.00 0.00 N ATOM 0 H ASN A 79 34.837 49.311 -22.510 1.00 0.00 H new ATOM 0 HA ASN A 79 33.448 50.576 -20.304 1.00 0.00 H new ATOM 0 HB2 ASN A 79 35.857 50.942 -21.203 1.00 0.00 H new ATOM 0 HB3 ASN A 79 35.120 51.767 -22.562 1.00 0.00 H new ATOM 0 HD21 ASN A 79 35.172 53.575 -18.837 1.00 0.00 H new ATOM 0 HD22 ASN A 79 35.441 51.835 -18.993 1.00 0.00 H new ATOM 1284 N LYS A 80 31.831 50.578 -22.991 1.00 0.00 N ATOM 1285 CA LYS A 80 30.592 50.979 -23.700 1.00 0.00 C ATOM 1286 C LYS A 80 30.640 52.415 -24.248 1.00 0.00 C ATOM 1287 O LYS A 80 29.803 53.264 -23.934 1.00 0.00 O ATOM 1288 CB LYS A 80 29.365 50.641 -22.820 1.00 0.00 C ATOM 1289 CG LYS A 80 29.053 49.133 -22.895 1.00 0.00 C ATOM 1290 CD LYS A 80 28.380 48.549 -21.639 1.00 0.00 C ATOM 1291 CE LYS A 80 29.177 47.322 -21.168 1.00 0.00 C ATOM 1292 NZ LYS A 80 28.599 46.706 -19.948 1.00 0.00 N ATOM 0 H LYS A 80 32.190 49.684 -23.326 1.00 0.00 H new ATOM 0 HA LYS A 80 30.494 50.391 -24.613 1.00 0.00 H new ATOM 0 HB2 LYS A 80 29.560 50.928 -21.787 1.00 0.00 H new ATOM 0 HB3 LYS A 80 28.501 51.215 -23.153 1.00 0.00 H new ATOM 0 HG2 LYS A 80 28.406 48.952 -23.754 1.00 0.00 H new ATOM 0 HG3 LYS A 80 29.982 48.593 -23.077 1.00 0.00 H new ATOM 0 HD2 LYS A 80 28.342 49.299 -20.849 1.00 0.00 H new ATOM 0 HD3 LYS A 80 27.351 48.267 -21.860 1.00 0.00 H new ATOM 0 HE2 LYS A 80 29.205 46.581 -21.967 1.00 0.00 H new ATOM 0 HE3 LYS A 80 30.208 47.616 -20.970 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 29.171 45.883 -19.670 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 28.596 47.402 -19.176 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 27.624 46.400 -20.142 1.00 0.00 H new ATOM 1306 N GLN A 81 31.652 52.683 -25.075 1.00 0.00 N ATOM 1307 CA GLN A 81 31.947 54.007 -25.637 1.00 0.00 C ATOM 1308 C GLN A 81 31.222 54.263 -26.974 1.00 0.00 C ATOM 1309 O GLN A 81 31.694 53.895 -28.051 1.00 0.00 O ATOM 1310 CB GLN A 81 33.469 54.182 -25.746 1.00 0.00 C ATOM 1311 CG GLN A 81 34.104 54.183 -24.345 1.00 0.00 C ATOM 1312 CD GLN A 81 35.592 54.498 -24.370 1.00 0.00 C ATOM 1313 OE1 GLN A 81 36.438 53.752 -23.903 1.00 0.00 O ATOM 1314 NE2 GLN A 81 35.975 55.627 -24.917 1.00 0.00 N ATOM 0 H GLN A 81 32.309 51.966 -25.383 1.00 0.00 H new ATOM 0 HA GLN A 81 31.556 54.766 -24.959 1.00 0.00 H new ATOM 0 HB2 GLN A 81 33.893 53.376 -26.345 1.00 0.00 H new ATOM 0 HB3 GLN A 81 33.699 55.116 -26.259 1.00 0.00 H new ATOM 0 HG2 GLN A 81 33.593 54.916 -23.721 1.00 0.00 H new ATOM 0 HG3 GLN A 81 33.952 53.208 -23.882 1.00 0.00 H new ATOM 0 HE21 GLN A 81 35.282 56.263 -25.312 1.00 0.00 H new ATOM 0 HE22 GLN A 81 36.965 55.869 -24.947 1.00 0.00 H new ATOM 1323 N MET A 82 30.057 54.918 -26.903 1.00 0.00 N ATOM 1324 CA MET A 82 29.151 55.162 -28.042 1.00 0.00 C ATOM 1325 C MET A 82 29.756 55.972 -29.208 1.00 0.00 C ATOM 1326 O MET A 82 29.233 55.921 -30.321 1.00 0.00 O ATOM 1327 CB MET A 82 27.872 55.864 -27.553 1.00 0.00 C ATOM 1328 CG MET A 82 27.068 55.082 -26.504 1.00 0.00 C ATOM 1329 SD MET A 82 26.444 53.460 -27.038 1.00 0.00 S ATOM 1330 CE MET A 82 27.635 52.358 -26.227 1.00 0.00 C ATOM 0 H MET A 82 29.704 55.306 -26.028 1.00 0.00 H new ATOM 0 HA MET A 82 28.939 54.173 -28.447 1.00 0.00 H new ATOM 0 HB2 MET A 82 28.144 56.833 -27.134 1.00 0.00 H new ATOM 0 HB3 MET A 82 27.230 56.058 -28.412 1.00 0.00 H new ATOM 0 HG2 MET A 82 27.696 54.938 -25.625 1.00 0.00 H new ATOM 0 HG3 MET A 82 26.220 55.693 -26.193 1.00 0.00 H new ATOM 0 HE1 MET A 82 27.388 51.322 -26.458 1.00 0.00 H new ATOM 0 HE2 MET A 82 28.640 52.580 -26.587 1.00 0.00 H new ATOM 0 HE3 MET A 82 27.594 52.509 -25.148 1.00 0.00 H new ATOM 1340 N GLY A 83 30.863 56.694 -28.996 1.00 0.00 N ATOM 1341 CA GLY A 83 31.554 57.454 -30.047 1.00 0.00 C ATOM 1342 C GLY A 83 32.152 56.604 -31.181 1.00 0.00 C ATOM 1343 O GLY A 83 32.467 57.148 -32.240 1.00 0.00 O ATOM 0 H GLY A 83 31.309 56.768 -28.082 1.00 0.00 H new ATOM 0 HA2 GLY A 83 30.852 58.167 -30.480 1.00 0.00 H new ATOM 0 HA3 GLY A 83 32.355 58.034 -29.588 1.00 0.00 H new ATOM 1347 N LEU A 84 32.299 55.285 -30.982 1.00 0.00 N ATOM 1348 CA LEU A 84 33.001 54.366 -31.891 1.00 0.00 C ATOM 1349 C LEU A 84 32.087 53.248 -32.447 1.00 0.00 C ATOM 1350 O LEU A 84 32.586 52.224 -32.913 1.00 0.00 O ATOM 1351 CB LEU A 84 34.238 53.755 -31.198 1.00 0.00 C ATOM 1352 CG LEU A 84 35.322 54.649 -30.568 1.00 0.00 C ATOM 1353 CD1 LEU A 84 35.799 55.789 -31.469 1.00 0.00 C ATOM 1354 CD2 LEU A 84 34.907 55.204 -29.208 1.00 0.00 C ATOM 0 H LEU A 84 31.921 54.815 -30.160 1.00 0.00 H new ATOM 0 HA LEU A 84 33.323 54.962 -32.745 1.00 0.00 H new ATOM 0 HB2 LEU A 84 33.869 53.098 -30.410 1.00 0.00 H new ATOM 0 HB3 LEU A 84 34.735 53.122 -31.934 1.00 0.00 H new ATOM 0 HG LEU A 84 36.168 53.976 -30.431 1.00 0.00 H new ATOM 0 HD11 LEU A 84 36.561 56.369 -30.949 1.00 0.00 H new ATOM 0 HD12 LEU A 84 36.220 55.376 -32.386 1.00 0.00 H new ATOM 0 HD13 LEU A 84 34.956 56.435 -31.715 1.00 0.00 H new ATOM 0 HD21 LEU A 84 35.708 55.827 -28.809 1.00 0.00 H new ATOM 0 HD22 LEU A 84 34.003 55.803 -29.320 1.00 0.00 H new ATOM 0 HD23 LEU A 84 34.713 54.379 -28.522 1.00 0.00 H new ATOM 1366 N GLN A 85 30.760 53.437 -32.415 1.00 0.00 N ATOM 1367 CA GLN A 85 29.727 52.479 -32.863 1.00 0.00 C ATOM 1368 C GLN A 85 30.050 51.596 -34.098 1.00 0.00 C ATOM 1369 O GLN A 85 29.769 50.395 -34.022 1.00 0.00 O ATOM 1370 CB GLN A 85 28.389 53.222 -33.053 1.00 0.00 C ATOM 1371 CG GLN A 85 27.576 53.329 -31.749 1.00 0.00 C ATOM 1372 CD GLN A 85 26.922 52.019 -31.299 1.00 0.00 C ATOM 1373 OE1 GLN A 85 26.785 51.051 -32.037 1.00 0.00 O ATOM 1374 NE2 GLN A 85 26.487 51.929 -30.060 1.00 0.00 N ATOM 0 H GLN A 85 30.353 54.302 -32.060 1.00 0.00 H new ATOM 0 HA GLN A 85 29.676 51.746 -32.058 1.00 0.00 H new ATOM 0 HB2 GLN A 85 28.586 54.223 -33.436 1.00 0.00 H new ATOM 0 HB3 GLN A 85 27.794 52.704 -33.805 1.00 0.00 H new ATOM 0 HG2 GLN A 85 28.232 53.684 -30.955 1.00 0.00 H new ATOM 0 HG3 GLN A 85 26.799 54.082 -31.881 1.00 0.00 H new ATOM 0 HE21 GLN A 85 26.589 52.721 -29.425 1.00 0.00 H new ATOM 0 HE22 GLN A 85 26.048 51.068 -29.735 1.00 0.00 H new ATOM 1383 N PRO A 86 30.649 52.094 -35.206 1.00 0.00 N ATOM 1384 CA PRO A 86 31.182 51.256 -36.294 1.00 0.00 C ATOM 1385 C PRO A 86 32.464 50.483 -35.892 1.00 0.00 C ATOM 1386 O PRO A 86 33.540 50.657 -36.475 1.00 0.00 O ATOM 1387 CB PRO A 86 31.359 52.206 -37.487 1.00 0.00 C ATOM 1388 CG PRO A 86 31.649 53.546 -36.820 1.00 0.00 C ATOM 1389 CD PRO A 86 30.770 53.503 -35.572 1.00 0.00 C ATOM 0 HA PRO A 86 30.500 50.446 -36.554 1.00 0.00 H new ATOM 0 HB2 PRO A 86 32.178 51.892 -38.135 1.00 0.00 H new ATOM 0 HB3 PRO A 86 30.462 52.249 -38.105 1.00 0.00 H new ATOM 0 HG2 PRO A 86 32.704 53.652 -36.568 1.00 0.00 H new ATOM 0 HG3 PRO A 86 31.391 54.384 -37.467 1.00 0.00 H new ATOM 0 HD2 PRO A 86 31.217 54.079 -34.761 1.00 0.00 H new ATOM 0 HD3 PRO A 86 29.791 53.939 -35.770 1.00 0.00 H new ATOM 1397 N TYR A 87 32.359 49.635 -34.866 1.00 0.00 N ATOM 1398 CA TYR A 87 33.412 48.735 -34.382 1.00 0.00 C ATOM 1399 C TYR A 87 33.811 47.649 -35.415 1.00 0.00 C ATOM 1400 O TYR A 87 32.983 47.258 -36.246 1.00 0.00 O ATOM 1401 CB TYR A 87 32.928 48.058 -33.089 1.00 0.00 C ATOM 1402 CG TYR A 87 32.988 48.920 -31.841 1.00 0.00 C ATOM 1403 CD1 TYR A 87 34.237 49.209 -31.257 1.00 0.00 C ATOM 1404 CD2 TYR A 87 31.804 49.368 -31.222 1.00 0.00 C ATOM 1405 CE1 TYR A 87 34.309 49.923 -30.045 1.00 0.00 C ATOM 1406 CE2 TYR A 87 31.871 50.093 -30.015 1.00 0.00 C ATOM 1407 CZ TYR A 87 33.122 50.361 -29.419 1.00 0.00 C ATOM 1408 OH TYR A 87 33.175 51.027 -28.234 1.00 0.00 O ATOM 0 H TYR A 87 31.499 49.552 -34.324 1.00 0.00 H new ATOM 0 HA TYR A 87 34.301 49.340 -34.204 1.00 0.00 H new ATOM 0 HB2 TYR A 87 31.899 47.730 -33.234 1.00 0.00 H new ATOM 0 HB3 TYR A 87 33.527 47.163 -32.921 1.00 0.00 H new ATOM 0 HD1 TYR A 87 35.145 48.881 -31.742 1.00 0.00 H new ATOM 0 HD2 TYR A 87 30.846 49.156 -31.672 1.00 0.00 H new ATOM 0 HE1 TYR A 87 35.268 50.134 -29.596 1.00 0.00 H new ATOM 0 HE2 TYR A 87 30.964 50.444 -29.546 1.00 0.00 H new ATOM 0 HH TYR A 87 32.691 51.876 -28.314 1.00 0.00 H new ATOM 1418 N PRO A 88 35.048 47.114 -35.345 1.00 0.00 N ATOM 1419 CA PRO A 88 35.550 46.042 -36.202 1.00 0.00 C ATOM 1420 C PRO A 88 35.296 44.641 -35.603 1.00 0.00 C ATOM 1421 O PRO A 88 34.965 44.484 -34.422 1.00 0.00 O ATOM 1422 CB PRO A 88 37.047 46.342 -36.293 1.00 0.00 C ATOM 1423 CG PRO A 88 37.379 46.804 -34.878 1.00 0.00 C ATOM 1424 CD PRO A 88 36.103 47.521 -34.431 1.00 0.00 C ATOM 0 HA PRO A 88 35.051 46.018 -37.171 1.00 0.00 H new ATOM 0 HB2 PRO A 88 37.621 45.460 -36.577 1.00 0.00 H new ATOM 0 HB3 PRO A 88 37.262 47.113 -37.032 1.00 0.00 H new ATOM 0 HG2 PRO A 88 37.617 45.963 -34.226 1.00 0.00 H new ATOM 0 HG3 PRO A 88 38.241 47.471 -34.865 1.00 0.00 H new ATOM 0 HD2 PRO A 88 35.849 47.254 -33.405 1.00 0.00 H new ATOM 0 HD3 PRO A 88 36.239 48.602 -34.455 1.00 0.00 H new ATOM 1432 N GLU A 89 35.491 43.598 -36.412 1.00 0.00 N ATOM 1433 CA GLU A 89 35.168 42.203 -36.075 1.00 0.00 C ATOM 1434 C GLU A 89 36.328 41.464 -35.371 1.00 0.00 C ATOM 1435 O GLU A 89 36.979 40.584 -35.935 1.00 0.00 O ATOM 1436 CB GLU A 89 34.689 41.435 -37.316 1.00 0.00 C ATOM 1437 CG GLU A 89 33.369 41.936 -37.924 1.00 0.00 C ATOM 1438 CD GLU A 89 33.477 43.291 -38.654 1.00 0.00 C ATOM 1439 OE1 GLU A 89 34.485 43.539 -39.362 1.00 0.00 O ATOM 1440 OE2 GLU A 89 32.537 44.113 -38.535 1.00 0.00 O ATOM 0 H GLU A 89 35.889 43.699 -37.346 1.00 0.00 H new ATOM 0 HA GLU A 89 34.351 42.240 -35.354 1.00 0.00 H new ATOM 0 HB2 GLU A 89 35.466 41.488 -38.079 1.00 0.00 H new ATOM 0 HB3 GLU A 89 34.573 40.384 -37.051 1.00 0.00 H new ATOM 0 HG2 GLU A 89 32.999 41.188 -38.625 1.00 0.00 H new ATOM 0 HG3 GLU A 89 32.627 42.023 -37.130 1.00 0.00 H new ATOM 1447 N ILE A 90 36.584 41.823 -34.110 1.00 0.00 N ATOM 1448 CA ILE A 90 37.711 41.334 -33.284 1.00 0.00 C ATOM 1449 C ILE A 90 37.300 40.282 -32.227 1.00 0.00 C ATOM 1450 O ILE A 90 37.944 40.136 -31.188 1.00 0.00 O ATOM 1451 CB ILE A 90 38.449 42.542 -32.663 1.00 0.00 C ATOM 1452 CG1 ILE A 90 37.513 43.444 -31.821 1.00 0.00 C ATOM 1453 CG2 ILE A 90 39.126 43.367 -33.769 1.00 0.00 C ATOM 1454 CD1 ILE A 90 38.054 43.661 -30.412 1.00 0.00 C ATOM 0 H ILE A 90 35.994 42.488 -33.610 1.00 0.00 H new ATOM 0 HA ILE A 90 38.395 40.796 -33.940 1.00 0.00 H new ATOM 0 HB ILE A 90 39.203 42.145 -31.984 1.00 0.00 H new ATOM 0 HG12 ILE A 90 37.393 44.407 -32.317 1.00 0.00 H new ATOM 0 HG13 ILE A 90 36.524 42.989 -31.765 1.00 0.00 H new ATOM 0 HG21 ILE A 90 39.644 44.216 -33.324 1.00 0.00 H new ATOM 0 HG22 ILE A 90 39.844 42.743 -34.301 1.00 0.00 H new ATOM 0 HG23 ILE A 90 38.371 43.728 -34.468 1.00 0.00 H new ATOM 0 HD11 ILE A 90 37.369 44.299 -29.853 1.00 0.00 H new ATOM 0 HD12 ILE A 90 38.149 42.700 -29.907 1.00 0.00 H new ATOM 0 HD13 ILE A 90 39.032 44.140 -30.467 1.00 0.00 H new