USER MOD reduce.3.24.130724 H: found=0, std=0, add=1017, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 0 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 29 GLN : amide:sc= -8.69! C(o=-8.6!,f=-4.6!) USER MOD Set 1.2: A 94 THR OG1 : rot 180:sc= -1.04 USER MOD Set 1.3: A 97 GLN : amide:sc=-0.00769 K(o=-8.6,f=-7.1) USER MOD Set 1.4: A 101 SER OG : rot 95:sc= 1.19 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -173:sc= 0 (180deg=-0.0106) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 ASN : amide:sc= -0.285 K(o=-0.29,f=-1.8!) USER MOD Single : A 16 GLN : amide:sc= -1.7 K(o=-1.7,f=-0.39) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 HIS : no HE2:sc= -1.9 K(o=-1.9,f=-2.8!) USER MOD Single : A 24 SER OG : rot -173:sc= 1.87 USER MOD Single : A 27 ASN : amide:sc= -7.81! C(o=-7.8!,f=-19!) USER MOD Single : A 34 THR OG1 : rot -14:sc= 0.555 USER MOD Single : A 35 CYS SG : rot 60:sc= -3.38 USER MOD Single : A 36 ASN : amide:sc= -0.612 K(o=-0.61,f=-3.5!) USER MOD Single : A 37 ASN : amide:sc= -6! C(o=-6!,f=-21!) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 HIS : no HD1:sc= -3.93 X(o=-3.9,f=-3.6!) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 ASN : amide:sc= -0.194 X(o=-0.19,f=0) USER MOD Single : A 60 ASN : amide:sc= -0.0273 X(o=-0.027,f=-0.2) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 ASN : amide:sc= -6.98! C(o=-7!,f=-8.1!) USER MOD Single : A 71 LYS NZ :NH3+ -110:sc= 0.738 (180deg=-0.00196) USER MOD Single : A 73 HIS : no HE2:sc= -2.21 X(o=-2.2,f=-2.4) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 76 HIS : no HD1:sc= -6.88! C(o=-6.9!,f=-5.2!) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 GLN : amide:sc= -0.157 K(o=-0.16,f=-1.5!) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 MET CE :methyl 159:sc= -4.07! (180deg=-6.21!) USER MOD Single : A 95 THR OG1 : rot 180:sc= -1.25 USER MOD Single : A 99 GLN : amide:sc= 0.507 K(o=0.51,f=-0.098) USER MOD Single : A 100 ASN : amide:sc= -0.0227 X(o=-0.023,f=-0.1) USER MOD Single : A 104 HIS : no HE2:sc= -6.12! C(o=-6.1!,f=-5.2!) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 ASN : amide:sc= -8.46! C(o=-8.5!,f=-18!) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 LYS NZ :NH3+ -142:sc= 0.505 (180deg=-0.372) USER MOD Single : A 117 LYS NZ :NH3+ 152:sc= -0.218 (180deg=-1.13) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -17.575 -17.820 -11.894 1.00 0.00 N ATOM 2 CA MET A 1 -18.008 -16.542 -11.356 1.00 0.00 C ATOM 3 C MET A 1 -16.997 -15.439 -11.680 1.00 0.00 C ATOM 4 O MET A 1 -16.933 -14.964 -12.812 1.00 0.00 O ATOM 5 CB MET A 1 -18.172 -16.654 -9.840 1.00 0.00 C ATOM 6 CG MET A 1 -19.396 -17.499 -9.482 1.00 0.00 C ATOM 7 SD MET A 1 -18.917 -18.848 -8.415 1.00 0.00 S ATOM 8 CE MET A 1 -19.766 -20.196 -9.220 1.00 0.00 C ATOM 0 H1 MET A 1 -18.329 -18.524 -11.765 1.00 0.00 H new ATOM 0 H2 MET A 1 -17.366 -17.717 -12.908 1.00 0.00 H new ATOM 0 H3 MET A 1 -16.719 -18.135 -11.395 1.00 0.00 H new ATOM 0 HA MET A 1 -18.962 -16.281 -11.815 1.00 0.00 H new ATOM 0 HB2 MET A 1 -17.278 -17.101 -9.406 1.00 0.00 H new ATOM 0 HB3 MET A 1 -18.273 -15.659 -9.407 1.00 0.00 H new ATOM 0 HG2 MET A 1 -20.143 -16.880 -8.986 1.00 0.00 H new ATOM 0 HG3 MET A 1 -19.857 -17.889 -10.390 1.00 0.00 H new ATOM 0 HE1 MET A 1 -19.573 -21.122 -8.679 1.00 0.00 H new ATOM 0 HE2 MET A 1 -20.838 -19.997 -9.229 1.00 0.00 H new ATOM 0 HE3 MET A 1 -19.406 -20.293 -10.244 1.00 0.00 H new ATOM 9 N LEU A 2 -16.231 -15.067 -10.665 1.00 0.00 N ATOM 10 CA LEU A 2 -15.226 -14.030 -10.827 1.00 0.00 C ATOM 11 C LEU A 2 -14.843 -13.477 -9.453 1.00 0.00 C ATOM 12 O LEU A 2 -15.296 -13.984 -8.428 1.00 0.00 O ATOM 13 CB LEU A 2 -15.713 -12.960 -11.807 1.00 0.00 C ATOM 14 CG LEU A 2 -15.210 -13.089 -13.246 1.00 0.00 C ATOM 15 CD1 LEU A 2 -16.323 -12.769 -14.246 1.00 0.00 C ATOM 16 CD2 LEU A 2 -13.969 -12.223 -13.472 1.00 0.00 C ATOM 0 H LEU A 2 -16.286 -15.465 -9.727 1.00 0.00 H new ATOM 0 HA LEU A 2 -14.319 -14.444 -11.268 1.00 0.00 H new ATOM 0 HB2 LEU A 2 -16.803 -12.978 -11.821 1.00 0.00 H new ATOM 0 HB3 LEU A 2 -15.415 -11.983 -11.425 1.00 0.00 H new ATOM 0 HG LEU A 2 -14.915 -14.125 -13.414 1.00 0.00 H new ATOM 0 HD11 LEU A 2 -15.939 -12.868 -15.261 1.00 0.00 H new ATOM 0 HD12 LEU A 2 -17.152 -13.462 -14.102 1.00 0.00 H new ATOM 0 HD13 LEU A 2 -16.672 -11.748 -14.088 1.00 0.00 H new ATOM 0 HD21 LEU A 2 -13.631 -12.333 -14.503 1.00 0.00 H new ATOM 0 HD22 LEU A 2 -14.214 -11.178 -13.280 1.00 0.00 H new ATOM 0 HD23 LEU A 2 -13.176 -12.540 -12.795 1.00 0.00 H new ATOM 17 N LEU A 3 -14.012 -12.445 -9.476 1.00 0.00 N ATOM 18 CA LEU A 3 -13.564 -11.818 -8.245 1.00 0.00 C ATOM 19 C LEU A 3 -14.161 -10.413 -8.145 1.00 0.00 C ATOM 20 O LEU A 3 -14.963 -10.015 -8.989 1.00 0.00 O ATOM 21 CB LEU A 3 -12.036 -11.844 -8.155 1.00 0.00 C ATOM 22 CG LEU A 3 -11.333 -10.492 -8.287 1.00 0.00 C ATOM 23 CD1 LEU A 3 -9.916 -10.553 -7.714 1.00 0.00 C ATOM 24 CD2 LEU A 3 -11.345 -10.006 -9.738 1.00 0.00 C ATOM 0 H LEU A 3 -13.637 -12.028 -10.328 1.00 0.00 H new ATOM 0 HA LEU A 3 -13.921 -12.379 -7.381 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -11.756 -12.285 -7.198 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -11.657 -12.506 -8.934 1.00 0.00 H new ATOM 0 HG LEU A 3 -11.887 -9.760 -7.699 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -9.438 -9.579 -7.820 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -9.962 -10.822 -6.659 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -9.337 -11.302 -8.254 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -10.839 -9.043 -9.803 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -10.830 -10.730 -10.369 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -12.375 -9.898 -10.077 1.00 0.00 H new ATOM 25 N GLU A 4 -13.748 -9.700 -7.108 1.00 0.00 N ATOM 26 CA GLU A 4 -14.232 -8.349 -6.887 1.00 0.00 C ATOM 27 C GLU A 4 -13.142 -7.493 -6.240 1.00 0.00 C ATOM 28 O GLU A 4 -11.956 -7.696 -6.493 1.00 0.00 O ATOM 29 CB GLU A 4 -15.504 -8.354 -6.036 1.00 0.00 C ATOM 30 CG GLU A 4 -16.613 -7.538 -6.703 1.00 0.00 C ATOM 31 CD GLU A 4 -17.925 -7.657 -5.924 1.00 0.00 C ATOM 32 OE1 GLU A 4 -17.931 -7.219 -4.754 1.00 0.00 O ATOM 33 OE2 GLU A 4 -18.891 -8.182 -6.518 1.00 0.00 O ATOM 0 H GLU A 4 -13.082 -10.033 -6.411 1.00 0.00 H new ATOM 0 HA GLU A 4 -14.483 -7.912 -7.853 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -15.842 -9.379 -5.887 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -15.288 -7.943 -5.050 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -16.314 -6.491 -6.762 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -16.760 -7.885 -7.726 1.00 0.00 H new ATOM 34 N LYS A 5 -13.583 -6.554 -5.416 1.00 0.00 N ATOM 35 CA LYS A 5 -12.659 -5.666 -4.729 1.00 0.00 C ATOM 36 C LYS A 5 -11.678 -6.500 -3.902 1.00 0.00 C ATOM 37 O LYS A 5 -10.744 -5.959 -3.311 1.00 0.00 O ATOM 38 CB LYS A 5 -13.425 -4.625 -3.910 1.00 0.00 C ATOM 39 CG LYS A 5 -14.244 -5.293 -2.804 1.00 0.00 C ATOM 40 CD LYS A 5 -15.007 -4.251 -1.983 1.00 0.00 C ATOM 41 CE LYS A 5 -15.451 -4.832 -0.639 1.00 0.00 C ATOM 42 NZ LYS A 5 -16.899 -4.604 -0.429 1.00 0.00 N ATOM 0 H LYS A 5 -14.568 -6.388 -5.208 1.00 0.00 H new ATOM 0 HA LYS A 5 -12.068 -5.099 -5.449 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -12.724 -3.915 -3.470 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -14.086 -4.057 -4.564 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -14.947 -6.001 -3.244 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -13.583 -5.863 -2.151 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -14.374 -3.380 -1.816 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -15.878 -3.909 -2.542 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -15.237 -5.900 -0.609 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -14.883 -4.371 0.169 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -17.184 -5.004 0.488 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -17.094 -3.583 -0.436 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -17.437 -5.065 -1.190 1.00 0.00 H new ATOM 43 N ALA A 6 -11.923 -7.801 -3.886 1.00 0.00 N ATOM 44 CA ALA A 6 -11.073 -8.714 -3.141 1.00 0.00 C ATOM 45 C ALA A 6 -9.617 -8.265 -3.267 1.00 0.00 C ATOM 46 O ALA A 6 -8.817 -8.477 -2.357 1.00 0.00 O ATOM 47 CB ALA A 6 -11.289 -10.142 -3.648 1.00 0.00 C ATOM 0 H ALA A 6 -12.699 -8.245 -4.377 1.00 0.00 H new ATOM 0 HA ALA A 6 -11.332 -8.702 -2.082 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -10.651 -10.827 -3.089 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -12.333 -10.423 -3.509 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -11.037 -10.194 -4.707 1.00 0.00 H new ATOM 48 N TYR A 7 -9.315 -7.651 -4.402 1.00 0.00 N ATOM 49 CA TYR A 7 -7.969 -7.170 -4.658 1.00 0.00 C ATOM 50 C TYR A 7 -7.434 -6.377 -3.464 1.00 0.00 C ATOM 51 O TYR A 7 -6.225 -6.195 -3.328 1.00 0.00 O ATOM 52 CB TYR A 7 -8.077 -6.238 -5.867 1.00 0.00 C ATOM 53 CG TYR A 7 -8.397 -6.955 -7.179 1.00 0.00 C ATOM 54 CD1 TYR A 7 -7.781 -8.153 -7.479 1.00 0.00 C ATOM 55 CD2 TYR A 7 -9.303 -6.406 -8.064 1.00 0.00 C ATOM 56 CE1 TYR A 7 -8.082 -8.829 -8.714 1.00 0.00 C ATOM 57 CE2 TYR A 7 -9.605 -7.081 -9.299 1.00 0.00 C ATOM 58 CZ TYR A 7 -8.980 -8.260 -9.564 1.00 0.00 C ATOM 0 H TYR A 7 -9.981 -7.476 -5.155 1.00 0.00 H new ATOM 0 HA TYR A 7 -7.290 -8.005 -4.833 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -8.851 -5.496 -5.672 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -7.138 -5.697 -5.980 1.00 0.00 H new ATOM 0 HD1 TYR A 7 -7.073 -8.584 -6.787 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -9.786 -5.469 -7.830 1.00 0.00 H new ATOM 0 HE1 TYR A 7 -7.606 -9.767 -8.960 1.00 0.00 H new ATOM 0 HE2 TYR A 7 -10.312 -6.661 -9.999 1.00 0.00 H new ATOM 59 N ARG A 8 -8.359 -5.927 -2.630 1.00 0.00 N ATOM 60 CA ARG A 8 -7.996 -5.158 -1.452 1.00 0.00 C ATOM 61 C ARG A 8 -7.447 -6.082 -0.364 1.00 0.00 C ATOM 62 O ARG A 8 -7.972 -7.172 -0.146 1.00 0.00 O ATOM 63 CB ARG A 8 -9.200 -4.392 -0.901 1.00 0.00 C ATOM 64 CG ARG A 8 -10.162 -5.332 -0.172 1.00 0.00 C ATOM 65 CD ARG A 8 -11.340 -4.558 0.422 1.00 0.00 C ATOM 66 NE ARG A 8 -11.858 -3.588 -0.568 1.00 0.00 N ATOM 67 CZ ARG A 8 -12.547 -2.484 -0.247 1.00 0.00 C ATOM 0 H ARG A 8 -9.361 -6.080 -2.747 1.00 0.00 H new ATOM 0 HA ARG A 8 -7.229 -4.442 -1.747 1.00 0.00 H new ATOM 0 HB2 ARG A 8 -8.859 -3.614 -0.218 1.00 0.00 H new ATOM 0 HB3 ARG A 8 -9.722 -3.893 -1.717 1.00 0.00 H new ATOM 0 HG2 ARG A 8 -10.531 -6.089 -0.864 1.00 0.00 H new ATOM 0 HG3 ARG A 8 -9.631 -5.858 0.621 1.00 0.00 H new ATOM 0 HD2 ARG A 8 -12.130 -5.250 0.714 1.00 0.00 H new ATOM 0 HD3 ARG A 8 -11.024 -4.035 1.325 1.00 0.00 H new ATOM 0 HE ARG A 8 -11.680 -3.771 -1.556 1.00 0.00 H new ATOM 68 N ILE A 9 -6.395 -5.613 0.291 1.00 0.00 N ATOM 69 CA ILE A 9 -5.768 -6.383 1.351 1.00 0.00 C ATOM 70 C ILE A 9 -6.720 -6.467 2.547 1.00 0.00 C ATOM 71 O ILE A 9 -6.673 -5.626 3.443 1.00 0.00 O ATOM 72 CB ILE A 9 -4.397 -5.801 1.699 1.00 0.00 C ATOM 73 CG1 ILE A 9 -3.549 -5.607 0.439 1.00 0.00 C ATOM 74 CG2 ILE A 9 -3.683 -6.662 2.742 1.00 0.00 C ATOM 75 CD1 ILE A 9 -2.950 -6.935 -0.029 1.00 0.00 C ATOM 0 H ILE A 9 -5.961 -4.708 0.108 1.00 0.00 H new ATOM 0 HA ILE A 9 -5.581 -7.404 1.018 1.00 0.00 H new ATOM 0 HB ILE A 9 -4.547 -4.817 2.143 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -4.163 -5.181 -0.355 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -2.749 -4.894 0.641 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -2.711 -6.225 2.971 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -4.284 -6.706 3.650 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -3.545 -7.669 2.349 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -2.352 -6.769 -0.925 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -2.317 -7.346 0.758 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -3.753 -7.637 -0.253 1.00 0.00 H new ATOM 76 N LYS A 10 -7.563 -7.488 2.519 1.00 0.00 N ATOM 77 CA LYS A 10 -8.525 -7.693 3.590 1.00 0.00 C ATOM 78 C LYS A 10 -7.793 -8.171 4.844 1.00 0.00 C ATOM 79 O LYS A 10 -8.048 -7.679 5.942 1.00 0.00 O ATOM 80 CB LYS A 10 -9.642 -8.634 3.133 1.00 0.00 C ATOM 81 CG LYS A 10 -10.637 -7.905 2.228 1.00 0.00 C ATOM 82 CD LYS A 10 -11.996 -8.610 2.229 1.00 0.00 C ATOM 83 CE LYS A 10 -12.388 -9.044 0.815 1.00 0.00 C ATOM 84 NZ LYS A 10 -13.660 -9.802 0.840 1.00 0.00 N ATOM 0 H LYS A 10 -7.601 -8.182 1.773 1.00 0.00 H new ATOM 0 HA LYS A 10 -9.015 -6.754 3.846 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -9.213 -9.482 2.599 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -10.162 -9.036 4.002 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -10.757 -6.876 2.567 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -10.246 -7.862 1.211 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -11.958 -9.481 2.883 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -12.757 -7.941 2.632 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -12.492 -8.168 0.175 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -11.599 -9.661 0.385 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -13.912 -10.089 -0.127 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -13.548 -10.648 1.434 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -14.414 -9.202 1.230 1.00 0.00 H new ATOM 85 N LYS A 11 -6.896 -9.124 4.639 1.00 0.00 N ATOM 86 CA LYS A 11 -6.124 -9.675 5.740 1.00 0.00 C ATOM 87 C LYS A 11 -4.843 -8.856 5.919 1.00 0.00 C ATOM 88 O LYS A 11 -4.179 -8.516 4.942 1.00 0.00 O ATOM 89 CB LYS A 11 -5.874 -11.169 5.526 1.00 0.00 C ATOM 90 CG LYS A 11 -6.973 -12.008 6.180 1.00 0.00 C ATOM 91 CD LYS A 11 -7.133 -13.353 5.468 1.00 0.00 C ATOM 92 CE LYS A 11 -7.567 -14.444 6.449 1.00 0.00 C ATOM 93 NZ LYS A 11 -8.529 -15.367 5.805 1.00 0.00 N ATOM 0 H LYS A 11 -6.686 -9.529 3.727 1.00 0.00 H new ATOM 0 HA LYS A 11 -6.684 -9.600 6.672 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -5.833 -11.385 4.458 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -4.905 -11.443 5.944 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -6.732 -12.175 7.230 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -7.917 -11.463 6.152 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -7.871 -13.261 4.671 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -6.190 -13.635 4.999 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -6.695 -15.000 6.793 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -8.023 -13.990 7.329 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -8.813 -16.101 6.484 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -9.368 -14.835 5.498 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -8.082 -15.814 4.979 1.00 0.00 H new ATOM 94 N ASN A 12 -4.536 -8.565 7.174 1.00 0.00 N ATOM 95 CA ASN A 12 -3.346 -7.793 7.493 1.00 0.00 C ATOM 96 C ASN A 12 -2.104 -8.586 7.084 1.00 0.00 C ATOM 97 O ASN A 12 -1.124 -8.011 6.611 1.00 0.00 O ATOM 98 CB ASN A 12 -3.257 -7.516 8.996 1.00 0.00 C ATOM 99 CG ASN A 12 -3.701 -6.087 9.316 1.00 0.00 C ATOM 100 OD1 ASN A 12 -3.593 -5.179 8.510 1.00 0.00 O ATOM 101 ND2 ASN A 12 -4.207 -5.940 10.538 1.00 0.00 N ATOM 0 H ASN A 12 -5.090 -8.849 7.982 1.00 0.00 H new ATOM 0 HA ASN A 12 -3.402 -6.847 6.954 1.00 0.00 H new ATOM 0 HB2 ASN A 12 -3.883 -8.225 9.538 1.00 0.00 H new ATOM 0 HB3 ASN A 12 -2.233 -7.668 9.338 1.00 0.00 H new ATOM 0 HD21 ASN A 12 -4.533 -5.025 10.848 1.00 0.00 H new ATOM 0 HD22 ASN A 12 -4.269 -6.743 11.164 1.00 0.00 H new ATOM 102 N ALA A 13 -2.184 -9.894 7.281 1.00 0.00 N ATOM 103 CA ALA A 13 -1.079 -10.772 6.938 1.00 0.00 C ATOM 104 C ALA A 13 -0.588 -10.440 5.528 1.00 0.00 C ATOM 105 O ALA A 13 0.608 -10.251 5.311 1.00 0.00 O ATOM 106 CB ALA A 13 -1.522 -12.230 7.073 1.00 0.00 C ATOM 0 H ALA A 13 -2.998 -10.367 7.674 1.00 0.00 H new ATOM 0 HA ALA A 13 -0.244 -10.621 7.622 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -0.692 -12.888 6.815 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -1.832 -12.422 8.100 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -2.358 -12.420 6.400 1.00 0.00 H new ATOM 107 N ASP A 14 -1.536 -10.379 4.605 1.00 0.00 N ATOM 108 CA ASP A 14 -1.216 -10.073 3.221 1.00 0.00 C ATOM 109 C ASP A 14 -0.377 -8.794 3.167 1.00 0.00 C ATOM 110 O ASP A 14 0.484 -8.650 2.301 1.00 0.00 O ATOM 111 CB ASP A 14 -2.485 -9.841 2.400 1.00 0.00 C ATOM 112 CG ASP A 14 -3.458 -11.021 2.366 1.00 0.00 C ATOM 113 OD1 ASP A 14 -2.961 -12.167 2.385 1.00 0.00 O ATOM 114 OD2 ASP A 14 -4.678 -10.750 2.320 1.00 0.00 O ATOM 0 H ASP A 14 -2.527 -10.536 4.788 1.00 0.00 H new ATOM 0 HA ASP A 14 -0.669 -10.920 2.806 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -3.006 -8.972 2.802 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -2.198 -9.596 1.377 1.00 0.00 H new ATOM 115 N PHE A 15 -0.658 -7.901 4.103 1.00 0.00 N ATOM 116 CA PHE A 15 0.059 -6.640 4.173 1.00 0.00 C ATOM 117 C PHE A 15 1.368 -6.795 4.949 1.00 0.00 C ATOM 118 O PHE A 15 2.395 -6.239 4.561 1.00 0.00 O ATOM 119 CB PHE A 15 -0.845 -5.651 4.913 1.00 0.00 C ATOM 120 CG PHE A 15 -1.053 -4.327 4.175 1.00 0.00 C ATOM 121 CD1 PHE A 15 -1.531 -4.325 2.902 1.00 0.00 C ATOM 122 CD2 PHE A 15 -0.763 -3.150 4.794 1.00 0.00 C ATOM 123 CE1 PHE A 15 -1.725 -3.096 2.218 1.00 0.00 C ATOM 124 CE2 PHE A 15 -0.956 -1.922 4.110 1.00 0.00 C ATOM 125 CZ PHE A 15 -1.433 -1.920 2.836 1.00 0.00 C ATOM 0 H PHE A 15 -1.373 -8.026 4.820 1.00 0.00 H new ATOM 0 HA PHE A 15 0.303 -6.295 3.168 1.00 0.00 H new ATOM 0 HB2 PHE A 15 -1.816 -6.118 5.082 1.00 0.00 H new ATOM 0 HB3 PHE A 15 -0.415 -5.445 5.893 1.00 0.00 H new ATOM 0 HD1 PHE A 15 -1.763 -5.259 2.411 1.00 0.00 H new ATOM 0 HD2 PHE A 15 -0.386 -3.151 5.806 1.00 0.00 H new ATOM 0 HE1 PHE A 15 -2.104 -3.095 1.207 1.00 0.00 H new ATOM 0 HE2 PHE A 15 -0.724 -0.988 4.601 1.00 0.00 H new ATOM 0 HZ PHE A 15 -1.580 -0.985 2.316 1.00 0.00 H new ATOM 126 N GLN A 16 1.290 -7.554 6.033 1.00 0.00 N ATOM 127 CA GLN A 16 2.455 -7.791 6.867 1.00 0.00 C ATOM 128 C GLN A 16 3.500 -8.606 6.102 1.00 0.00 C ATOM 129 O GLN A 16 4.690 -8.301 6.152 1.00 0.00 O ATOM 130 CB GLN A 16 2.064 -8.488 8.171 1.00 0.00 C ATOM 131 CG GLN A 16 2.244 -10.003 8.059 1.00 0.00 C ATOM 132 CD GLN A 16 1.842 -10.701 9.360 1.00 0.00 C ATOM 133 OE1 GLN A 16 2.569 -11.514 9.908 1.00 0.00 O ATOM 134 NE2 GLN A 16 0.648 -10.341 9.820 1.00 0.00 N ATOM 0 H GLN A 16 0.437 -8.013 6.352 1.00 0.00 H new ATOM 0 HA GLN A 16 2.893 -6.827 7.126 1.00 0.00 H new ATOM 0 HB2 GLN A 16 2.674 -8.105 8.989 1.00 0.00 H new ATOM 0 HB3 GLN A 16 1.026 -8.259 8.413 1.00 0.00 H new ATOM 0 HG2 GLN A 16 1.640 -10.385 7.236 1.00 0.00 H new ATOM 0 HG3 GLN A 16 3.283 -10.233 7.825 1.00 0.00 H new ATOM 0 HE21 GLN A 16 0.091 -9.654 9.311 1.00 0.00 H new ATOM 0 HE22 GLN A 16 0.289 -10.751 10.682 1.00 0.00 H new ATOM 135 N ARG A 17 3.016 -9.628 5.410 1.00 0.00 N ATOM 136 CA ARG A 17 3.893 -10.488 4.635 1.00 0.00 C ATOM 137 C ARG A 17 4.867 -9.648 3.808 1.00 0.00 C ATOM 138 O ARG A 17 6.025 -10.024 3.635 1.00 0.00 O ATOM 139 CB ARG A 17 3.089 -11.394 3.700 1.00 0.00 C ATOM 140 CG ARG A 17 3.484 -12.860 3.884 1.00 0.00 C ATOM 141 CD ARG A 17 4.292 -13.366 2.686 1.00 0.00 C ATOM 142 NE ARG A 17 5.515 -14.055 3.155 1.00 0.00 N ATOM 143 CZ ARG A 17 5.513 -15.230 3.800 1.00 0.00 C ATOM 0 H ARG A 17 2.028 -9.879 5.370 1.00 0.00 H new ATOM 0 HA ARG A 17 4.451 -11.110 5.335 1.00 0.00 H new ATOM 0 HB2 ARG A 17 2.024 -11.273 3.898 1.00 0.00 H new ATOM 0 HB3 ARG A 17 3.257 -11.095 2.665 1.00 0.00 H new ATOM 0 HG2 ARG A 17 4.071 -12.970 4.796 1.00 0.00 H new ATOM 0 HG3 ARG A 17 2.588 -13.469 4.006 1.00 0.00 H new ATOM 0 HD2 ARG A 17 3.686 -14.049 2.090 1.00 0.00 H new ATOM 0 HD3 ARG A 17 4.561 -12.531 2.039 1.00 0.00 H new ATOM 0 HE ARG A 17 6.414 -13.608 2.976 1.00 0.00 H new ATOM 144 N ILE A 18 4.361 -8.525 3.317 1.00 0.00 N ATOM 145 CA ILE A 18 5.172 -7.629 2.512 1.00 0.00 C ATOM 146 C ILE A 18 6.123 -6.851 3.424 1.00 0.00 C ATOM 147 O ILE A 18 7.329 -6.812 3.181 1.00 0.00 O ATOM 148 CB ILE A 18 4.282 -6.735 1.646 1.00 0.00 C ATOM 149 CG1 ILE A 18 2.963 -7.433 1.311 1.00 0.00 C ATOM 150 CG2 ILE A 18 5.024 -6.278 0.387 1.00 0.00 C ATOM 151 CD1 ILE A 18 2.315 -6.815 0.071 1.00 0.00 C ATOM 0 H ILE A 18 3.400 -8.216 3.462 1.00 0.00 H new ATOM 0 HA ILE A 18 5.790 -8.196 1.816 1.00 0.00 H new ATOM 0 HB ILE A 18 4.036 -5.841 2.219 1.00 0.00 H new ATOM 0 HG12 ILE A 18 3.142 -8.495 1.141 1.00 0.00 H new ATOM 0 HG13 ILE A 18 2.282 -7.356 2.158 1.00 0.00 H new ATOM 0 HG21 ILE A 18 4.369 -5.644 -0.211 1.00 0.00 H new ATOM 0 HG22 ILE A 18 5.913 -5.715 0.673 1.00 0.00 H new ATOM 0 HG23 ILE A 18 5.319 -7.149 -0.198 1.00 0.00 H new ATOM 0 HD11 ILE A 18 1.379 -7.330 -0.145 1.00 0.00 H new ATOM 0 HD12 ILE A 18 2.115 -5.759 0.253 1.00 0.00 H new ATOM 0 HD13 ILE A 18 2.989 -6.915 -0.780 1.00 0.00 H new ATOM 152 N TYR A 19 5.546 -6.250 4.454 1.00 0.00 N ATOM 153 CA TYR A 19 6.327 -5.476 5.403 1.00 0.00 C ATOM 154 C TYR A 19 7.381 -6.349 6.087 1.00 0.00 C ATOM 155 O TYR A 19 8.299 -5.835 6.725 1.00 0.00 O ATOM 156 CB TYR A 19 5.336 -4.975 6.455 1.00 0.00 C ATOM 157 CG TYR A 19 4.775 -3.581 6.167 1.00 0.00 C ATOM 158 CD1 TYR A 19 5.628 -2.548 5.836 1.00 0.00 C ATOM 159 CD2 TYR A 19 3.415 -3.356 6.239 1.00 0.00 C ATOM 160 CE1 TYR A 19 5.101 -1.236 5.566 1.00 0.00 C ATOM 161 CE2 TYR A 19 2.887 -2.044 5.968 1.00 0.00 C ATOM 162 CZ TYR A 19 3.756 -1.048 5.645 1.00 0.00 C ATOM 0 H TYR A 19 4.546 -6.284 4.652 1.00 0.00 H new ATOM 0 HA TYR A 19 6.848 -4.662 4.898 1.00 0.00 H new ATOM 0 HB2 TYR A 19 4.509 -5.681 6.525 1.00 0.00 H new ATOM 0 HB3 TYR A 19 5.829 -4.963 7.427 1.00 0.00 H new ATOM 0 HD1 TYR A 19 6.692 -2.724 5.779 1.00 0.00 H new ATOM 0 HD2 TYR A 19 2.747 -4.164 6.499 1.00 0.00 H new ATOM 0 HE1 TYR A 19 5.758 -0.419 5.307 1.00 0.00 H new ATOM 0 HE2 TYR A 19 1.825 -1.855 6.020 1.00 0.00 H new ATOM 163 N LYS A 20 7.213 -7.654 5.932 1.00 0.00 N ATOM 164 CA LYS A 20 8.139 -8.603 6.526 1.00 0.00 C ATOM 165 C LYS A 20 9.503 -8.475 5.845 1.00 0.00 C ATOM 166 O LYS A 20 10.354 -7.706 6.291 1.00 0.00 O ATOM 167 CB LYS A 20 7.559 -10.018 6.479 1.00 0.00 C ATOM 168 CG LYS A 20 8.476 -11.010 7.198 1.00 0.00 C ATOM 169 CD LYS A 20 7.691 -11.847 8.211 1.00 0.00 C ATOM 170 CE LYS A 20 8.342 -11.788 9.593 1.00 0.00 C ATOM 171 NZ LYS A 20 7.399 -11.227 10.586 1.00 0.00 N ATOM 0 H LYS A 20 6.450 -8.076 5.404 1.00 0.00 H new ATOM 0 HA LYS A 20 8.288 -8.379 7.582 1.00 0.00 H new ATOM 0 HB2 LYS A 20 6.573 -10.026 6.943 1.00 0.00 H new ATOM 0 HB3 LYS A 20 7.426 -10.326 5.442 1.00 0.00 H new ATOM 0 HG2 LYS A 20 8.951 -11.666 6.469 1.00 0.00 H new ATOM 0 HG3 LYS A 20 9.274 -10.470 7.708 1.00 0.00 H new ATOM 0 HD2 LYS A 20 6.666 -11.482 8.272 1.00 0.00 H new ATOM 0 HD3 LYS A 20 7.642 -12.882 7.872 1.00 0.00 H new ATOM 0 HE2 LYS A 20 8.650 -12.788 9.899 1.00 0.00 H new ATOM 0 HE3 LYS A 20 9.243 -11.176 9.551 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 7.857 -11.194 11.519 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 7.125 -10.265 10.300 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 6.551 -11.827 10.637 1.00 0.00 H new ATOM 172 N LYS A 21 9.669 -9.238 4.775 1.00 0.00 N ATOM 173 CA LYS A 21 10.915 -9.219 4.027 1.00 0.00 C ATOM 174 C LYS A 21 10.615 -8.955 2.551 1.00 0.00 C ATOM 175 O LYS A 21 11.471 -9.164 1.693 1.00 0.00 O ATOM 176 CB LYS A 21 11.707 -10.505 4.273 1.00 0.00 C ATOM 177 CG LYS A 21 12.968 -10.224 5.092 1.00 0.00 C ATOM 178 CD LYS A 21 13.492 -11.503 5.748 1.00 0.00 C ATOM 179 CE LYS A 21 14.573 -11.185 6.783 1.00 0.00 C ATOM 180 NZ LYS A 21 14.824 -12.359 7.649 1.00 0.00 N ATOM 0 H LYS A 21 8.961 -9.874 4.408 1.00 0.00 H new ATOM 0 HA LYS A 21 11.554 -8.407 4.373 1.00 0.00 H new ATOM 0 HB2 LYS A 21 11.081 -11.227 4.798 1.00 0.00 H new ATOM 0 HB3 LYS A 21 11.981 -10.955 3.319 1.00 0.00 H new ATOM 0 HG2 LYS A 21 13.738 -9.800 4.447 1.00 0.00 H new ATOM 0 HG3 LYS A 21 12.750 -9.481 5.859 1.00 0.00 H new ATOM 0 HD2 LYS A 21 12.669 -12.033 6.227 1.00 0.00 H new ATOM 0 HD3 LYS A 21 13.898 -12.167 4.985 1.00 0.00 H new ATOM 0 HE2 LYS A 21 15.494 -10.895 6.278 1.00 0.00 H new ATOM 0 HE3 LYS A 21 14.263 -10.336 7.392 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 15.560 -12.126 8.345 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 13.948 -12.618 8.145 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 15.141 -13.159 7.065 1.00 0.00 H new ATOM 181 N GLY A 22 9.396 -8.499 2.299 1.00 0.00 N ATOM 182 CA GLY A 22 8.973 -8.204 0.942 1.00 0.00 C ATOM 183 C GLY A 22 9.985 -7.299 0.236 1.00 0.00 C ATOM 184 O GLY A 22 11.047 -7.003 0.783 1.00 0.00 O ATOM 0 H GLY A 22 8.688 -8.327 3.013 1.00 0.00 H new ATOM 0 HA2 GLY A 22 8.859 -9.133 0.383 1.00 0.00 H new ATOM 0 HA3 GLY A 22 7.997 -7.720 0.959 1.00 0.00 H new ATOM 185 N HIS A 23 9.621 -6.885 -0.969 1.00 0.00 N ATOM 186 CA HIS A 23 10.484 -6.020 -1.755 1.00 0.00 C ATOM 187 C HIS A 23 9.680 -4.826 -2.274 1.00 0.00 C ATOM 188 O HIS A 23 8.776 -4.991 -3.092 1.00 0.00 O ATOM 189 CB HIS A 23 11.167 -6.807 -2.876 1.00 0.00 C ATOM 190 CG HIS A 23 11.966 -5.950 -3.828 1.00 0.00 C ATOM 191 ND1 HIS A 23 13.336 -6.078 -3.982 1.00 0.00 N ATOM 192 CD2 HIS A 23 11.574 -4.956 -4.675 1.00 0.00 C ATOM 193 CE1 HIS A 23 13.739 -5.193 -4.882 1.00 0.00 C ATOM 194 NE2 HIS A 23 12.647 -4.498 -5.311 1.00 0.00 N ATOM 0 H HIS A 23 8.740 -7.133 -1.420 1.00 0.00 H new ATOM 0 HA HIS A 23 11.283 -5.629 -1.125 1.00 0.00 H new ATOM 0 HB2 HIS A 23 11.827 -7.552 -2.433 1.00 0.00 H new ATOM 0 HB3 HIS A 23 10.408 -7.349 -3.440 1.00 0.00 H new ATOM 0 HD1 HIS A 23 13.933 -6.741 -3.487 1.00 0.00 H new ATOM 0 HD2 HIS A 23 10.563 -4.601 -4.807 1.00 0.00 H new ATOM 0 HE1 HIS A 23 14.755 -5.047 -5.217 1.00 0.00 H new ATOM 195 N SER A 24 10.037 -3.651 -1.776 1.00 0.00 N ATOM 196 CA SER A 24 9.360 -2.431 -2.180 1.00 0.00 C ATOM 197 C SER A 24 10.304 -1.557 -3.006 1.00 0.00 C ATOM 198 O SER A 24 11.520 -1.604 -2.824 1.00 0.00 O ATOM 199 CB SER A 24 8.850 -1.657 -0.962 1.00 0.00 C ATOM 200 OG SER A 24 9.891 -0.930 -0.316 1.00 0.00 O ATOM 0 H SER A 24 10.786 -3.518 -1.097 1.00 0.00 H new ATOM 0 HA SER A 24 8.500 -2.703 -2.792 1.00 0.00 H new ATOM 0 HB2 SER A 24 8.066 -0.967 -1.274 1.00 0.00 H new ATOM 0 HB3 SER A 24 8.400 -2.352 -0.253 1.00 0.00 H new ATOM 0 HG SER A 24 9.551 -0.542 0.517 1.00 0.00 H new ATOM 201 N VAL A 25 9.710 -0.778 -3.898 1.00 0.00 N ATOM 202 CA VAL A 25 10.484 0.106 -4.754 1.00 0.00 C ATOM 203 C VAL A 25 9.848 1.497 -4.751 1.00 0.00 C ATOM 204 O VAL A 25 8.657 1.641 -5.023 1.00 0.00 O ATOM 205 CB VAL A 25 10.601 -0.495 -6.157 1.00 0.00 C ATOM 206 CG1 VAL A 25 11.472 -1.753 -6.144 1.00 0.00 C ATOM 207 CG2 VAL A 25 9.219 -0.789 -6.744 1.00 0.00 C ATOM 0 H VAL A 25 8.702 -0.740 -4.047 1.00 0.00 H new ATOM 0 HA VAL A 25 11.500 0.212 -4.374 1.00 0.00 H new ATOM 0 HB VAL A 25 11.087 0.241 -6.798 1.00 0.00 H new ATOM 0 HG11 VAL A 25 11.539 -2.160 -7.153 1.00 0.00 H new ATOM 0 HG12 VAL A 25 12.471 -1.500 -5.788 1.00 0.00 H new ATOM 0 HG13 VAL A 25 11.028 -2.496 -5.482 1.00 0.00 H new ATOM 0 HG21 VAL A 25 9.330 -1.215 -7.741 1.00 0.00 H new ATOM 0 HG22 VAL A 25 8.695 -1.498 -6.103 1.00 0.00 H new ATOM 0 HG23 VAL A 25 8.646 0.136 -6.807 1.00 0.00 H new ATOM 208 N ALA A 26 10.670 2.489 -4.439 1.00 0.00 N ATOM 209 CA ALA A 26 10.204 3.864 -4.397 1.00 0.00 C ATOM 210 C ALA A 26 10.849 4.652 -5.538 1.00 0.00 C ATOM 211 O ALA A 26 12.032 4.480 -5.825 1.00 0.00 O ATOM 212 CB ALA A 26 10.512 4.466 -3.024 1.00 0.00 C ATOM 0 H ALA A 26 11.657 2.367 -4.213 1.00 0.00 H new ATOM 0 HA ALA A 26 9.124 3.908 -4.537 1.00 0.00 H new ATOM 0 HB1 ALA A 26 10.162 5.498 -2.992 1.00 0.00 H new ATOM 0 HB2 ALA A 26 10.006 3.888 -2.251 1.00 0.00 H new ATOM 0 HB3 ALA A 26 11.588 4.442 -2.849 1.00 0.00 H new ATOM 213 N ASN A 27 10.042 5.501 -6.157 1.00 0.00 N ATOM 214 CA ASN A 27 10.519 6.317 -7.261 1.00 0.00 C ATOM 215 C ASN A 27 10.354 7.795 -6.905 1.00 0.00 C ATOM 216 O ASN A 27 10.520 8.182 -5.749 1.00 0.00 O ATOM 217 CB ASN A 27 9.717 6.045 -8.535 1.00 0.00 C ATOM 218 CG ASN A 27 8.315 6.650 -8.440 1.00 0.00 C ATOM 219 OD1 ASN A 27 7.817 6.962 -7.371 1.00 0.00 O ATOM 220 ND2 ASN A 27 7.708 6.796 -9.614 1.00 0.00 N ATOM 0 H ASN A 27 9.061 5.642 -5.915 1.00 0.00 H new ATOM 0 HA ASN A 27 11.566 6.069 -7.435 1.00 0.00 H new ATOM 0 HB2 ASN A 27 10.240 6.464 -9.395 1.00 0.00 H new ATOM 0 HB3 ASN A 27 9.643 4.970 -8.700 1.00 0.00 H new ATOM 0 HD21 ASN A 27 6.768 7.190 -9.657 1.00 0.00 H new ATOM 0 HD22 ASN A 27 8.182 6.514 -10.472 1.00 0.00 H new ATOM 221 N ARG A 28 10.029 8.583 -7.920 1.00 0.00 N ATOM 222 CA ARG A 28 9.839 10.011 -7.729 1.00 0.00 C ATOM 223 C ARG A 28 9.258 10.288 -6.341 1.00 0.00 C ATOM 224 O ARG A 28 9.980 10.695 -5.431 1.00 0.00 O ATOM 225 CB ARG A 28 8.903 10.590 -8.791 1.00 0.00 C ATOM 226 CG ARG A 28 9.675 10.968 -10.056 1.00 0.00 C ATOM 227 CD ARG A 28 9.202 10.144 -11.255 1.00 0.00 C ATOM 228 NE ARG A 28 8.066 10.821 -11.919 1.00 0.00 N ATOM 229 CZ ARG A 28 8.181 11.937 -12.653 1.00 0.00 C ATOM 0 H ARG A 28 9.892 8.259 -8.878 1.00 0.00 H new ATOM 0 HA ARG A 28 10.814 10.490 -7.821 1.00 0.00 H new ATOM 0 HB2 ARG A 28 8.131 9.861 -9.036 1.00 0.00 H new ATOM 0 HB3 ARG A 28 8.396 11.469 -8.394 1.00 0.00 H new ATOM 0 HG2 ARG A 28 9.541 12.029 -10.264 1.00 0.00 H new ATOM 0 HG3 ARG A 28 10.741 10.806 -9.897 1.00 0.00 H new ATOM 0 HD2 ARG A 28 10.021 10.013 -11.962 1.00 0.00 H new ATOM 0 HD3 ARG A 28 8.901 9.149 -10.927 1.00 0.00 H new ATOM 0 HE ARG A 28 7.137 10.413 -11.812 1.00 0.00 H new ATOM 230 N GLN A 29 7.959 10.056 -6.221 1.00 0.00 N ATOM 231 CA GLN A 29 7.273 10.275 -4.959 1.00 0.00 C ATOM 232 C GLN A 29 6.275 9.146 -4.694 1.00 0.00 C ATOM 233 O GLN A 29 5.195 9.382 -4.155 1.00 0.00 O ATOM 234 CB GLN A 29 6.576 11.637 -4.943 1.00 0.00 C ATOM 235 CG GLN A 29 7.227 12.598 -5.941 1.00 0.00 C ATOM 236 CD GLN A 29 6.514 12.550 -7.294 1.00 0.00 C ATOM 237 OE1 GLN A 29 6.558 13.481 -8.081 1.00 0.00 O ATOM 238 NE2 GLN A 29 5.857 11.416 -7.518 1.00 0.00 N ATOM 0 H GLN A 29 7.363 9.719 -6.977 1.00 0.00 H new ATOM 0 HA GLN A 29 8.015 10.273 -4.160 1.00 0.00 H new ATOM 0 HB2 GLN A 29 5.521 11.513 -5.188 1.00 0.00 H new ATOM 0 HB3 GLN A 29 6.623 12.062 -3.940 1.00 0.00 H new ATOM 0 HG2 GLN A 29 7.197 13.613 -5.546 1.00 0.00 H new ATOM 0 HG3 GLN A 29 8.277 12.337 -6.070 1.00 0.00 H new ATOM 0 HE21 GLN A 29 5.862 10.677 -6.815 1.00 0.00 H new ATOM 0 HE22 GLN A 29 5.348 11.285 -8.392 1.00 0.00 H new ATOM 239 N PHE A 30 6.673 7.945 -5.085 1.00 0.00 N ATOM 240 CA PHE A 30 5.827 6.778 -4.896 1.00 0.00 C ATOM 241 C PHE A 30 6.624 5.612 -4.306 1.00 0.00 C ATOM 242 O PHE A 30 7.822 5.489 -4.549 1.00 0.00 O ATOM 243 CB PHE A 30 5.305 6.376 -6.278 1.00 0.00 C ATOM 244 CG PHE A 30 3.782 6.265 -6.359 1.00 0.00 C ATOM 245 CD1 PHE A 30 3.115 5.422 -5.527 1.00 0.00 C ATOM 246 CD2 PHE A 30 3.094 7.010 -7.266 1.00 0.00 C ATOM 247 CE1 PHE A 30 1.701 5.320 -5.603 1.00 0.00 C ATOM 248 CE2 PHE A 30 1.680 6.908 -7.342 1.00 0.00 C ATOM 249 CZ PHE A 30 1.013 6.064 -6.509 1.00 0.00 C ATOM 0 H PHE A 30 7.570 7.754 -5.532 1.00 0.00 H new ATOM 0 HA PHE A 30 5.016 7.014 -4.207 1.00 0.00 H new ATOM 0 HB2 PHE A 30 5.645 7.108 -7.011 1.00 0.00 H new ATOM 0 HB3 PHE A 30 5.744 5.418 -6.557 1.00 0.00 H new ATOM 0 HD1 PHE A 30 3.661 4.830 -4.808 1.00 0.00 H new ATOM 0 HD2 PHE A 30 3.624 7.679 -7.928 1.00 0.00 H new ATOM 0 HE1 PHE A 30 1.172 4.651 -4.941 1.00 0.00 H new ATOM 0 HE2 PHE A 30 1.134 7.500 -8.061 1.00 0.00 H new ATOM 0 HZ PHE A 30 -0.063 5.985 -6.568 1.00 0.00 H new ATOM 250 N VAL A 31 5.925 4.788 -3.540 1.00 0.00 N ATOM 251 CA VAL A 31 6.551 3.637 -2.913 1.00 0.00 C ATOM 252 C VAL A 31 5.613 2.433 -3.012 1.00 0.00 C ATOM 253 O VAL A 31 4.605 2.367 -2.310 1.00 0.00 O ATOM 254 CB VAL A 31 6.940 3.973 -1.472 1.00 0.00 C ATOM 255 CG1 VAL A 31 5.962 4.979 -0.861 1.00 0.00 C ATOM 256 CG2 VAL A 31 7.030 2.708 -0.618 1.00 0.00 C ATOM 0 H VAL A 31 4.931 4.895 -3.339 1.00 0.00 H new ATOM 0 HA VAL A 31 7.473 3.375 -3.433 1.00 0.00 H new ATOM 0 HB VAL A 31 7.928 4.434 -1.491 1.00 0.00 H new ATOM 0 HG11 VAL A 31 6.261 5.201 0.163 1.00 0.00 H new ATOM 0 HG12 VAL A 31 5.970 5.897 -1.448 1.00 0.00 H new ATOM 0 HG13 VAL A 31 4.957 4.556 -0.862 1.00 0.00 H new ATOM 0 HG21 VAL A 31 7.308 2.976 0.401 1.00 0.00 H new ATOM 0 HG22 VAL A 31 6.063 2.205 -0.610 1.00 0.00 H new ATOM 0 HG23 VAL A 31 7.783 2.040 -1.036 1.00 0.00 H new ATOM 257 N VAL A 32 5.977 1.510 -3.891 1.00 0.00 N ATOM 258 CA VAL A 32 5.180 0.312 -4.091 1.00 0.00 C ATOM 259 C VAL A 32 5.849 -0.866 -3.381 1.00 0.00 C ATOM 260 O VAL A 32 7.008 -1.179 -3.647 1.00 0.00 O ATOM 261 CB VAL A 32 4.972 0.066 -5.587 1.00 0.00 C ATOM 262 CG1 VAL A 32 4.097 1.159 -6.205 1.00 0.00 C ATOM 263 CG2 VAL A 32 6.312 -0.041 -6.318 1.00 0.00 C ATOM 0 H VAL A 32 6.813 1.568 -4.472 1.00 0.00 H new ATOM 0 HA VAL A 32 4.189 0.436 -3.653 1.00 0.00 H new ATOM 0 HB VAL A 32 4.452 -0.885 -5.701 1.00 0.00 H new ATOM 0 HG11 VAL A 32 3.964 0.961 -7.269 1.00 0.00 H new ATOM 0 HG12 VAL A 32 3.124 1.168 -5.713 1.00 0.00 H new ATOM 0 HG13 VAL A 32 4.578 2.128 -6.074 1.00 0.00 H new ATOM 0 HG21 VAL A 32 6.135 -0.216 -7.379 1.00 0.00 H new ATOM 0 HG22 VAL A 32 6.871 0.886 -6.191 1.00 0.00 H new ATOM 0 HG23 VAL A 32 6.887 -0.870 -5.905 1.00 0.00 H new ATOM 264 N TYR A 33 5.090 -1.486 -2.489 1.00 0.00 N ATOM 265 CA TYR A 33 5.595 -2.623 -1.738 1.00 0.00 C ATOM 266 C TYR A 33 4.982 -3.931 -2.242 1.00 0.00 C ATOM 267 O TYR A 33 3.761 -4.087 -2.248 1.00 0.00 O ATOM 268 CB TYR A 33 5.163 -2.396 -0.288 1.00 0.00 C ATOM 269 CG TYR A 33 6.246 -1.776 0.595 1.00 0.00 C ATOM 270 CD1 TYR A 33 6.585 -0.447 0.441 1.00 0.00 C ATOM 271 CD2 TYR A 33 6.886 -2.545 1.545 1.00 0.00 C ATOM 272 CE1 TYR A 33 7.606 0.137 1.273 1.00 0.00 C ATOM 273 CE2 TYR A 33 7.906 -1.962 2.378 1.00 0.00 C ATOM 274 CZ TYR A 33 8.216 -0.649 2.200 1.00 0.00 C ATOM 0 H TYR A 33 4.129 -1.222 -2.270 1.00 0.00 H new ATOM 0 HA TYR A 33 6.677 -2.703 -1.845 1.00 0.00 H new ATOM 0 HB2 TYR A 33 4.286 -1.748 -0.278 1.00 0.00 H new ATOM 0 HB3 TYR A 33 4.859 -3.350 0.143 1.00 0.00 H new ATOM 0 HD1 TYR A 33 6.085 0.155 -0.303 1.00 0.00 H new ATOM 0 HD2 TYR A 33 6.622 -3.585 1.664 1.00 0.00 H new ATOM 0 HE1 TYR A 33 7.881 1.176 1.163 1.00 0.00 H new ATOM 0 HE2 TYR A 33 8.413 -2.553 3.126 1.00 0.00 H new ATOM 275 N THR A 34 5.856 -4.837 -2.655 1.00 0.00 N ATOM 276 CA THR A 34 5.416 -6.127 -3.159 1.00 0.00 C ATOM 277 C THR A 34 6.225 -7.255 -2.518 1.00 0.00 C ATOM 278 O THR A 34 7.305 -7.020 -1.979 1.00 0.00 O ATOM 279 CB THR A 34 5.518 -6.096 -4.686 1.00 0.00 C ATOM 280 OG1 THR A 34 6.914 -5.968 -4.938 1.00 0.00 O ATOM 281 CG2 THR A 34 4.913 -4.826 -5.288 1.00 0.00 C ATOM 0 H THR A 34 6.867 -4.703 -2.651 1.00 0.00 H new ATOM 0 HA THR A 34 4.378 -6.324 -2.892 1.00 0.00 H new ATOM 0 HB THR A 34 5.015 -6.969 -5.101 1.00 0.00 H new ATOM 0 HG1 THR A 34 7.373 -5.710 -4.112 1.00 0.00 H new ATOM 0 HG21 THR A 34 5.012 -4.855 -6.373 1.00 0.00 H new ATOM 0 HG22 THR A 34 3.858 -4.764 -5.021 1.00 0.00 H new ATOM 0 HG23 THR A 34 5.438 -3.953 -4.899 1.00 0.00 H new ATOM 282 N CYS A 35 5.672 -8.457 -2.599 1.00 0.00 N ATOM 283 CA CYS A 35 6.330 -9.623 -2.034 1.00 0.00 C ATOM 284 C CYS A 35 5.917 -10.849 -2.850 1.00 0.00 C ATOM 285 O CYS A 35 4.846 -10.866 -3.454 1.00 0.00 O ATOM 286 CB CYS A 35 6.004 -9.790 -0.548 1.00 0.00 C ATOM 287 SG CYS A 35 4.318 -10.474 -0.350 1.00 0.00 S ATOM 0 H CYS A 35 4.776 -8.648 -3.047 1.00 0.00 H new ATOM 0 HA CYS A 35 7.411 -9.498 -2.090 1.00 0.00 H new ATOM 0 HB2 CYS A 35 6.732 -10.453 -0.080 1.00 0.00 H new ATOM 0 HB3 CYS A 35 6.077 -8.828 -0.041 1.00 0.00 H new ATOM 0 HG CYS A 35 4.248 -11.632 -0.937 1.00 0.00 H new ATOM 288 N ASN A 36 6.790 -11.846 -2.842 1.00 0.00 N ATOM 289 CA ASN A 36 6.530 -13.074 -3.574 1.00 0.00 C ATOM 290 C ASN A 36 5.100 -13.538 -3.292 1.00 0.00 C ATOM 291 O ASN A 36 4.659 -13.542 -2.145 1.00 0.00 O ATOM 292 CB ASN A 36 7.483 -14.188 -3.136 1.00 0.00 C ATOM 293 CG ASN A 36 7.361 -14.455 -1.635 1.00 0.00 C ATOM 294 OD1 ASN A 36 7.383 -13.553 -0.814 1.00 0.00 O ATOM 295 ND2 ASN A 36 7.232 -15.742 -1.322 1.00 0.00 N ATOM 0 H ASN A 36 7.678 -11.828 -2.340 1.00 0.00 H new ATOM 0 HA ASN A 36 6.675 -12.871 -4.635 1.00 0.00 H new ATOM 0 HB2 ASN A 36 7.261 -15.100 -3.690 1.00 0.00 H new ATOM 0 HB3 ASN A 36 8.509 -13.910 -3.377 1.00 0.00 H new ATOM 0 HD21 ASN A 36 7.144 -16.023 -0.345 1.00 0.00 H new ATOM 0 HD22 ASN A 36 7.221 -16.447 -2.059 1.00 0.00 H new ATOM 296 N ASN A 37 4.414 -13.917 -4.361 1.00 0.00 N ATOM 297 CA ASN A 37 3.042 -14.381 -4.244 1.00 0.00 C ATOM 298 C ASN A 37 2.911 -15.261 -3.000 1.00 0.00 C ATOM 299 O ASN A 37 3.703 -16.180 -2.797 1.00 0.00 O ATOM 300 CB ASN A 37 2.638 -15.218 -5.460 1.00 0.00 C ATOM 301 CG ASN A 37 1.116 -15.304 -5.585 1.00 0.00 C ATOM 302 OD1 ASN A 37 0.373 -14.967 -4.678 1.00 0.00 O ATOM 303 ND2 ASN A 37 0.695 -15.774 -6.756 1.00 0.00 N ATOM 0 H ASN A 37 4.783 -13.912 -5.312 1.00 0.00 H new ATOM 0 HA ASN A 37 2.395 -13.507 -4.177 1.00 0.00 H new ATOM 0 HB2 ASN A 37 3.056 -14.777 -6.365 1.00 0.00 H new ATOM 0 HB3 ASN A 37 3.056 -16.221 -5.371 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -0.304 -15.870 -6.937 1.00 0.00 H new ATOM 0 HD22 ASN A 37 1.371 -16.038 -7.473 1.00 0.00 H new ATOM 304 N LYS A 38 1.904 -14.947 -2.197 1.00 0.00 N ATOM 305 CA LYS A 38 1.658 -15.699 -0.977 1.00 0.00 C ATOM 306 C LYS A 38 0.694 -16.848 -1.276 1.00 0.00 C ATOM 307 O LYS A 38 0.016 -17.344 -0.377 1.00 0.00 O ATOM 308 CB LYS A 38 1.178 -14.767 0.138 1.00 0.00 C ATOM 309 CG LYS A 38 -0.337 -14.567 0.070 1.00 0.00 C ATOM 310 CD LYS A 38 -1.029 -15.201 1.279 1.00 0.00 C ATOM 311 CE LYS A 38 -0.691 -14.442 2.564 1.00 0.00 C ATOM 312 NZ LYS A 38 -0.076 -15.351 3.556 1.00 0.00 N ATOM 0 H LYS A 38 1.250 -14.183 -2.367 1.00 0.00 H new ATOM 0 HA LYS A 38 2.583 -16.146 -0.612 1.00 0.00 H new ATOM 0 HB2 LYS A 38 1.450 -15.184 1.108 1.00 0.00 H new ATOM 0 HB3 LYS A 38 1.680 -13.803 0.053 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -0.565 -13.502 0.033 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -0.725 -15.008 -0.848 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -2.108 -15.202 1.126 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -0.720 -16.242 1.375 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -0.008 -13.623 2.340 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -1.596 -13.998 2.980 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 0.147 -14.820 4.422 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -0.740 -16.119 3.782 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 0.798 -15.754 3.162 1.00 0.00 H new ATOM 313 N GLU A 39 0.663 -17.238 -2.541 1.00 0.00 N ATOM 314 CA GLU A 39 -0.207 -18.320 -2.970 1.00 0.00 C ATOM 315 C GLU A 39 -1.579 -17.771 -3.369 1.00 0.00 C ATOM 316 O GLU A 39 -2.608 -18.320 -2.979 1.00 0.00 O ATOM 317 CB GLU A 39 -0.339 -19.384 -1.879 1.00 0.00 C ATOM 318 CG GLU A 39 -0.405 -20.787 -2.485 1.00 0.00 C ATOM 319 CD GLU A 39 0.992 -21.398 -2.607 1.00 0.00 C ATOM 320 OE1 GLU A 39 1.777 -20.864 -3.420 1.00 0.00 O ATOM 321 OE2 GLU A 39 1.244 -22.386 -1.884 1.00 0.00 O ATOM 0 H GLU A 39 1.227 -16.824 -3.284 1.00 0.00 H new ATOM 0 HA GLU A 39 0.241 -18.796 -3.842 1.00 0.00 H new ATOM 0 HB2 GLU A 39 0.509 -19.318 -1.198 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -1.237 -19.196 -1.290 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -1.032 -21.426 -1.864 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -0.873 -20.741 -3.469 1.00 0.00 H new ATOM 322 N ILE A 40 -1.549 -16.695 -4.141 1.00 0.00 N ATOM 323 CA ILE A 40 -2.777 -16.066 -4.597 1.00 0.00 C ATOM 324 C ILE A 40 -2.991 -16.390 -6.077 1.00 0.00 C ATOM 325 O ILE A 40 -2.766 -17.519 -6.508 1.00 0.00 O ATOM 326 CB ILE A 40 -2.757 -14.567 -4.291 1.00 0.00 C ATOM 327 CG1 ILE A 40 -4.177 -14.002 -4.230 1.00 0.00 C ATOM 328 CG2 ILE A 40 -1.883 -13.814 -5.297 1.00 0.00 C ATOM 329 CD1 ILE A 40 -4.818 -14.277 -2.868 1.00 0.00 C ATOM 0 H ILE A 40 -0.693 -16.242 -4.463 1.00 0.00 H new ATOM 0 HA ILE A 40 -3.634 -16.466 -4.056 1.00 0.00 H new ATOM 0 HB ILE A 40 -2.311 -14.424 -3.307 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -4.153 -12.928 -4.415 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -4.784 -14.448 -5.018 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -1.886 -12.751 -5.057 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -0.863 -14.194 -5.249 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -2.277 -13.960 -6.303 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -5.827 -13.865 -2.851 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -4.862 -15.353 -2.697 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -4.222 -13.809 -2.084 1.00 0.00 H new ATOM 330 N ASP A 41 -3.424 -15.377 -6.814 1.00 0.00 N ATOM 331 CA ASP A 41 -3.670 -15.538 -8.237 1.00 0.00 C ATOM 332 C ASP A 41 -4.662 -14.471 -8.702 1.00 0.00 C ATOM 333 O ASP A 41 -5.277 -14.607 -9.760 1.00 0.00 O ATOM 334 CB ASP A 41 -4.278 -16.911 -8.538 1.00 0.00 C ATOM 335 CG ASP A 41 -5.350 -17.375 -7.550 1.00 0.00 C ATOM 336 OD1 ASP A 41 -5.461 -16.725 -6.488 1.00 0.00 O ATOM 337 OD2 ASP A 41 -6.033 -18.368 -7.879 1.00 0.00 O ATOM 0 H ASP A 41 -3.611 -14.442 -6.452 1.00 0.00 H new ATOM 0 HA ASP A 41 -2.717 -15.442 -8.758 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -4.712 -16.888 -9.537 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -3.477 -17.650 -8.555 1.00 0.00 H new ATOM 338 N HIS A 42 -4.787 -13.431 -7.891 1.00 0.00 N ATOM 339 CA HIS A 42 -5.693 -12.340 -8.207 1.00 0.00 C ATOM 340 C HIS A 42 -5.076 -11.014 -7.759 1.00 0.00 C ATOM 341 O HIS A 42 -5.738 -9.977 -7.782 1.00 0.00 O ATOM 342 CB HIS A 42 -7.074 -12.587 -7.597 1.00 0.00 C ATOM 343 CG HIS A 42 -7.852 -13.697 -8.264 1.00 0.00 C ATOM 344 ND1 HIS A 42 -8.956 -13.462 -9.065 1.00 0.00 N ATOM 345 CD2 HIS A 42 -7.673 -15.048 -8.242 1.00 0.00 C ATOM 346 CE1 HIS A 42 -9.413 -14.626 -9.499 1.00 0.00 C ATOM 347 NE2 HIS A 42 -8.616 -15.609 -8.987 1.00 0.00 N ATOM 0 H HIS A 42 -4.276 -13.321 -7.015 1.00 0.00 H new ATOM 0 HA HIS A 42 -5.840 -12.286 -9.286 1.00 0.00 H new ATOM 0 HB2 HIS A 42 -6.955 -12.825 -6.540 1.00 0.00 H new ATOM 0 HB3 HIS A 42 -7.654 -11.666 -7.653 1.00 0.00 H new ATOM 0 HD2 HIS A 42 -6.895 -15.573 -7.708 1.00 0.00 H new ATOM 0 HE1 HIS A 42 -10.266 -14.772 -10.145 1.00 0.00 H new ATOM 0 HE2 HIS A 42 -8.727 -16.610 -9.150 1.00 0.00 H new ATOM 348 N PHE A 43 -3.814 -11.089 -7.364 1.00 0.00 N ATOM 349 CA PHE A 43 -3.099 -9.907 -6.912 1.00 0.00 C ATOM 350 C PHE A 43 -3.933 -9.116 -5.903 1.00 0.00 C ATOM 351 O PHE A 43 -5.161 -9.184 -5.917 1.00 0.00 O ATOM 352 CB PHE A 43 -2.849 -9.037 -8.144 1.00 0.00 C ATOM 353 CG PHE A 43 -4.092 -8.809 -9.007 1.00 0.00 C ATOM 354 CD1 PHE A 43 -4.394 -9.677 -10.009 1.00 0.00 C ATOM 355 CD2 PHE A 43 -4.895 -7.737 -8.772 1.00 0.00 C ATOM 356 CE1 PHE A 43 -5.547 -9.466 -10.810 1.00 0.00 C ATOM 357 CE2 PHE A 43 -6.049 -7.525 -9.572 1.00 0.00 C ATOM 358 CZ PHE A 43 -6.350 -8.394 -10.574 1.00 0.00 C ATOM 0 H PHE A 43 -3.268 -11.950 -7.347 1.00 0.00 H new ATOM 0 HA PHE A 43 -2.168 -10.198 -6.425 1.00 0.00 H new ATOM 0 HB2 PHE A 43 -2.461 -8.071 -7.821 1.00 0.00 H new ATOM 0 HB3 PHE A 43 -2.076 -9.503 -8.755 1.00 0.00 H new ATOM 0 HD1 PHE A 43 -3.756 -10.528 -10.196 1.00 0.00 H new ATOM 0 HD2 PHE A 43 -4.655 -7.047 -7.977 1.00 0.00 H new ATOM 0 HE1 PHE A 43 -5.786 -10.156 -11.606 1.00 0.00 H new ATOM 0 HE2 PHE A 43 -6.687 -6.674 -9.385 1.00 0.00 H new ATOM 0 HZ PHE A 43 -7.227 -8.233 -11.183 1.00 0.00 H new ATOM 359 N ARG A 44 -3.233 -8.381 -5.051 1.00 0.00 N ATOM 360 CA ARG A 44 -3.892 -7.576 -4.038 1.00 0.00 C ATOM 361 C ARG A 44 -3.140 -6.260 -3.831 1.00 0.00 C ATOM 362 O ARG A 44 -2.135 -6.220 -3.123 1.00 0.00 O ATOM 363 CB ARG A 44 -3.972 -8.325 -2.706 1.00 0.00 C ATOM 364 CG ARG A 44 -4.800 -9.604 -2.844 1.00 0.00 C ATOM 365 CD ARG A 44 -4.288 -10.693 -1.900 1.00 0.00 C ATOM 366 NE ARG A 44 -2.950 -11.152 -2.337 1.00 0.00 N ATOM 367 CZ ARG A 44 -2.330 -12.235 -1.846 1.00 0.00 C ATOM 0 H ARG A 44 -2.214 -8.327 -5.042 1.00 0.00 H new ATOM 0 HA ARG A 44 -4.903 -7.368 -4.387 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -2.967 -8.573 -2.364 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -4.417 -7.680 -1.948 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -5.846 -9.390 -2.624 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -4.757 -9.960 -3.873 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -4.235 -10.308 -0.882 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -4.984 -11.532 -1.888 1.00 0.00 H new ATOM 0 HE ARG A 44 -2.470 -10.611 -3.056 1.00 0.00 H new ATOM 368 N LEU A 45 -3.655 -5.215 -4.463 1.00 0.00 N ATOM 369 CA LEU A 45 -3.044 -3.902 -4.357 1.00 0.00 C ATOM 370 C LEU A 45 -3.648 -3.158 -3.164 1.00 0.00 C ATOM 371 O LEU A 45 -4.858 -3.201 -2.949 1.00 0.00 O ATOM 372 CB LEU A 45 -3.169 -3.144 -5.681 1.00 0.00 C ATOM 373 CG LEU A 45 -4.466 -2.360 -5.886 1.00 0.00 C ATOM 374 CD1 LEU A 45 -5.680 -3.291 -5.856 1.00 0.00 C ATOM 375 CD2 LEU A 45 -4.588 -1.226 -4.866 1.00 0.00 C ATOM 0 H LEU A 45 -4.488 -5.252 -5.050 1.00 0.00 H new ATOM 0 HA LEU A 45 -1.974 -3.994 -4.168 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -2.332 -2.450 -5.760 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -3.068 -3.859 -6.497 1.00 0.00 H new ATOM 0 HG LEU A 45 -4.436 -1.902 -6.875 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -6.589 -2.708 -6.004 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -5.590 -4.032 -6.651 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -5.727 -3.797 -4.892 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -5.519 -0.684 -5.034 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -4.586 -1.641 -3.858 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -3.746 -0.543 -4.978 1.00 0.00 H new ATOM 376 N GLY A 46 -2.777 -2.491 -2.421 1.00 0.00 N ATOM 377 CA GLY A 46 -3.208 -1.739 -1.255 1.00 0.00 C ATOM 378 C GLY A 46 -3.118 -0.233 -1.511 1.00 0.00 C ATOM 379 O GLY A 46 -2.695 0.195 -2.584 1.00 0.00 O ATOM 0 H GLY A 46 -1.774 -2.456 -2.604 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -4.234 -2.008 -1.003 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -2.589 -2.004 -0.398 1.00 0.00 H new ATOM 380 N ILE A 47 -3.524 0.530 -0.507 1.00 0.00 N ATOM 381 CA ILE A 47 -3.495 1.979 -0.609 1.00 0.00 C ATOM 382 C ILE A 47 -3.021 2.571 0.720 1.00 0.00 C ATOM 383 O ILE A 47 -3.740 2.522 1.717 1.00 0.00 O ATOM 384 CB ILE A 47 -4.854 2.512 -1.070 1.00 0.00 C ATOM 385 CG1 ILE A 47 -5.379 1.713 -2.264 1.00 0.00 C ATOM 386 CG2 ILE A 47 -4.783 4.011 -1.368 1.00 0.00 C ATOM 387 CD1 ILE A 47 -6.086 0.437 -1.803 1.00 0.00 C ATOM 0 H ILE A 47 -3.875 0.172 0.381 1.00 0.00 H new ATOM 0 HA ILE A 47 -2.781 2.292 -1.371 1.00 0.00 H new ATOM 0 HB ILE A 47 -5.567 2.380 -0.256 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -6.070 2.327 -2.841 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -4.552 1.456 -2.926 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -5.762 4.364 -1.693 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -4.485 4.547 -0.467 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -4.052 4.191 -2.156 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -6.449 -0.112 -2.672 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -5.386 -0.186 -1.247 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -6.927 0.699 -1.161 1.00 0.00 H new ATOM 388 N SER A 48 -1.815 3.117 0.691 1.00 0.00 N ATOM 389 CA SER A 48 -1.236 3.716 1.882 1.00 0.00 C ATOM 390 C SER A 48 -0.796 5.151 1.583 1.00 0.00 C ATOM 391 O SER A 48 -0.626 5.524 0.424 1.00 0.00 O ATOM 392 CB SER A 48 -0.051 2.894 2.394 1.00 0.00 C ATOM 393 OG SER A 48 -0.470 1.661 2.973 1.00 0.00 O ATOM 0 H SER A 48 -1.222 3.158 -0.138 1.00 0.00 H new ATOM 0 HA SER A 48 -1.997 3.729 2.662 1.00 0.00 H new ATOM 0 HB2 SER A 48 0.635 2.694 1.571 1.00 0.00 H new ATOM 0 HB3 SER A 48 0.500 3.474 3.134 1.00 0.00 H new ATOM 0 HG SER A 48 0.314 1.164 3.287 1.00 0.00 H new ATOM 394 N VAL A 49 -0.624 5.918 2.651 1.00 0.00 N ATOM 395 CA VAL A 49 -0.208 7.303 2.517 1.00 0.00 C ATOM 396 C VAL A 49 0.674 7.683 3.709 1.00 0.00 C ATOM 397 O VAL A 49 0.749 6.945 4.690 1.00 0.00 O ATOM 398 CB VAL A 49 -1.433 8.207 2.368 1.00 0.00 C ATOM 399 CG1 VAL A 49 -1.035 9.683 2.415 1.00 0.00 C ATOM 400 CG2 VAL A 49 -2.198 7.885 1.083 1.00 0.00 C ATOM 0 H VAL A 49 -0.765 5.606 3.612 1.00 0.00 H new ATOM 0 HA VAL A 49 0.388 7.437 1.614 1.00 0.00 H new ATOM 0 HB VAL A 49 -2.097 8.013 3.211 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -1.925 10.303 2.307 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -0.555 9.900 3.369 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -0.341 9.899 1.602 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -3.064 8.542 1.001 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -1.545 8.036 0.223 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -2.530 6.847 1.108 1.00 0.00 H new ATOM 401 N SER A 50 1.320 8.833 3.584 1.00 0.00 N ATOM 402 CA SER A 50 2.193 9.319 4.639 1.00 0.00 C ATOM 403 C SER A 50 1.418 10.252 5.572 1.00 0.00 C ATOM 404 O SER A 50 0.285 10.631 5.275 1.00 0.00 O ATOM 405 CB SER A 50 3.409 10.042 4.057 1.00 0.00 C ATOM 406 OG SER A 50 4.633 9.532 4.580 1.00 0.00 O ATOM 0 H SER A 50 1.256 9.442 2.768 1.00 0.00 H new ATOM 0 HA SER A 50 2.551 8.461 5.209 1.00 0.00 H new ATOM 0 HB2 SER A 50 3.407 9.939 2.972 1.00 0.00 H new ATOM 0 HB3 SER A 50 3.337 11.107 4.276 1.00 0.00 H new ATOM 0 HG SER A 50 5.386 10.018 4.183 1.00 0.00 H new ATOM 407 N LYS A 51 2.059 10.597 6.678 1.00 0.00 N ATOM 408 CA LYS A 51 1.444 11.478 7.656 1.00 0.00 C ATOM 409 C LYS A 51 2.122 12.848 7.600 1.00 0.00 C ATOM 410 O LYS A 51 1.730 13.769 8.314 1.00 0.00 O ATOM 411 CB LYS A 51 1.466 10.837 9.045 1.00 0.00 C ATOM 412 CG LYS A 51 0.290 9.874 9.223 1.00 0.00 C ATOM 413 CD LYS A 51 -0.791 10.488 10.114 1.00 0.00 C ATOM 414 CE LYS A 51 -1.847 11.210 9.275 1.00 0.00 C ATOM 415 NZ LYS A 51 -2.312 12.433 9.968 1.00 0.00 N ATOM 0 H LYS A 51 2.999 10.282 6.919 1.00 0.00 H new ATOM 0 HA LYS A 51 0.391 11.633 7.419 1.00 0.00 H new ATOM 0 HB2 LYS A 51 2.404 10.301 9.187 1.00 0.00 H new ATOM 0 HB3 LYS A 51 1.424 11.614 9.809 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -0.133 9.627 8.249 1.00 0.00 H new ATOM 0 HG3 LYS A 51 0.643 8.941 9.663 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -1.265 9.707 10.708 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -0.336 11.189 10.814 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -1.431 11.472 8.302 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -2.691 10.545 9.092 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -3.028 12.911 9.385 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -2.728 12.175 10.886 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -1.507 13.073 10.121 1.00 0.00 H new ATOM 416 N LYS A 52 3.131 12.938 6.745 1.00 0.00 N ATOM 417 CA LYS A 52 3.868 14.180 6.586 1.00 0.00 C ATOM 418 C LYS A 52 3.439 14.861 5.284 1.00 0.00 C ATOM 419 O LYS A 52 3.723 16.039 5.074 1.00 0.00 O ATOM 420 CB LYS A 52 5.373 13.925 6.679 1.00 0.00 C ATOM 421 CG LYS A 52 5.903 14.269 8.073 1.00 0.00 C ATOM 422 CD LYS A 52 6.078 13.006 8.920 1.00 0.00 C ATOM 423 CE LYS A 52 7.546 12.576 8.965 1.00 0.00 C ATOM 424 NZ LYS A 52 7.873 11.990 10.284 1.00 0.00 N ATOM 0 H LYS A 52 3.455 12.171 6.156 1.00 0.00 H new ATOM 0 HA LYS A 52 3.633 14.868 7.398 1.00 0.00 H new ATOM 0 HB2 LYS A 52 5.583 12.879 6.454 1.00 0.00 H new ATOM 0 HB3 LYS A 52 5.894 14.522 5.931 1.00 0.00 H new ATOM 0 HG2 LYS A 52 6.858 14.788 7.985 1.00 0.00 H new ATOM 0 HG3 LYS A 52 5.214 14.952 8.570 1.00 0.00 H new ATOM 0 HD2 LYS A 52 5.718 13.190 9.932 1.00 0.00 H new ATOM 0 HD3 LYS A 52 5.472 12.200 8.507 1.00 0.00 H new ATOM 0 HE2 LYS A 52 7.742 11.848 8.178 1.00 0.00 H new ATOM 0 HE3 LYS A 52 8.189 13.435 8.772 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 8.873 11.703 10.298 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 7.705 12.696 11.029 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 7.272 11.158 10.453 1.00 0.00 H new ATOM 425 N LEU A 53 2.764 14.089 4.446 1.00 0.00 N ATOM 426 CA LEU A 53 2.293 14.603 3.171 1.00 0.00 C ATOM 427 C LEU A 53 1.795 16.038 3.356 1.00 0.00 C ATOM 428 O LEU A 53 2.493 16.990 3.012 1.00 0.00 O ATOM 429 CB LEU A 53 1.248 13.663 2.568 1.00 0.00 C ATOM 430 CG LEU A 53 1.529 13.170 1.146 1.00 0.00 C ATOM 431 CD1 LEU A 53 1.539 11.641 1.088 1.00 0.00 C ATOM 432 CD2 LEU A 53 0.540 13.776 0.149 1.00 0.00 C ATOM 0 H LEU A 53 2.532 13.112 4.624 1.00 0.00 H new ATOM 0 HA LEU A 53 3.110 14.639 2.450 1.00 0.00 H new ATOM 0 HB2 LEU A 53 1.150 12.795 3.220 1.00 0.00 H new ATOM 0 HB3 LEU A 53 0.285 14.173 2.571 1.00 0.00 H new ATOM 0 HG LEU A 53 2.524 13.509 0.857 1.00 0.00 H new ATOM 0 HD11 LEU A 53 1.741 11.317 0.067 1.00 0.00 H new ATOM 0 HD12 LEU A 53 2.315 11.257 1.751 1.00 0.00 H new ATOM 0 HD13 LEU A 53 0.569 11.259 1.405 1.00 0.00 H new ATOM 0 HD21 LEU A 53 0.762 13.409 -0.853 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -0.475 13.489 0.423 1.00 0.00 H new ATOM 0 HD23 LEU A 53 0.627 14.862 0.165 1.00 0.00 H new ATOM 433 N GLY A 54 0.592 16.147 3.899 1.00 0.00 N ATOM 434 CA GLY A 54 -0.008 17.449 4.134 1.00 0.00 C ATOM 435 C GLY A 54 -1.422 17.309 4.702 1.00 0.00 C ATOM 436 O GLY A 54 -1.596 16.909 5.852 1.00 0.00 O ATOM 0 H GLY A 54 0.016 15.355 4.183 1.00 0.00 H new ATOM 0 HA2 GLY A 54 0.611 18.018 4.827 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -0.042 18.011 3.201 1.00 0.00 H new ATOM 437 N ASN A 55 -2.396 17.644 3.869 1.00 0.00 N ATOM 438 CA ASN A 55 -3.789 17.560 4.274 1.00 0.00 C ATOM 439 C ASN A 55 -4.401 16.273 3.715 1.00 0.00 C ATOM 440 O ASN A 55 -3.740 15.531 2.990 1.00 0.00 O ATOM 441 CB ASN A 55 -4.594 18.741 3.728 1.00 0.00 C ATOM 442 CG ASN A 55 -5.480 19.349 4.816 1.00 0.00 C ATOM 443 OD1 ASN A 55 -5.032 20.087 5.678 1.00 0.00 O ATOM 444 ND2 ASN A 55 -6.760 18.999 4.729 1.00 0.00 N ATOM 0 H ASN A 55 -2.248 17.974 2.915 1.00 0.00 H new ATOM 0 HA ASN A 55 -3.825 17.572 5.363 1.00 0.00 H new ATOM 0 HB2 ASN A 55 -3.915 19.500 3.340 1.00 0.00 H new ATOM 0 HB3 ASN A 55 -5.212 18.410 2.893 1.00 0.00 H new ATOM 0 HD21 ASN A 55 -7.433 19.352 5.409 1.00 0.00 H new ATOM 0 HD22 ASN A 55 -7.069 18.377 3.982 1.00 0.00 H new ATOM 445 N ALA A 56 -5.657 16.048 4.073 1.00 0.00 N ATOM 446 CA ALA A 56 -6.364 14.865 3.617 1.00 0.00 C ATOM 447 C ALA A 56 -6.576 14.953 2.104 1.00 0.00 C ATOM 448 O ALA A 56 -6.731 13.934 1.435 1.00 0.00 O ATOM 449 CB ALA A 56 -7.682 14.731 4.383 1.00 0.00 C ATOM 0 H ALA A 56 -6.203 16.666 4.674 1.00 0.00 H new ATOM 0 HA ALA A 56 -5.778 13.968 3.816 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -8.213 13.843 4.041 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -7.476 14.642 5.450 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -8.298 15.613 4.205 1.00 0.00 H new ATOM 450 N VAL A 57 -6.574 16.182 1.610 1.00 0.00 N ATOM 451 CA VAL A 57 -6.765 16.418 0.189 1.00 0.00 C ATOM 452 C VAL A 57 -5.730 15.613 -0.599 1.00 0.00 C ATOM 453 O VAL A 57 -6.048 15.031 -1.636 1.00 0.00 O ATOM 454 CB VAL A 57 -6.706 17.919 -0.106 1.00 0.00 C ATOM 455 CG1 VAL A 57 -5.263 18.428 -0.070 1.00 0.00 C ATOM 456 CG2 VAL A 57 -7.368 18.240 -1.447 1.00 0.00 C ATOM 0 H VAL A 57 -6.443 17.025 2.169 1.00 0.00 H new ATOM 0 HA VAL A 57 -7.752 16.078 -0.126 1.00 0.00 H new ATOM 0 HB VAL A 57 -7.263 18.437 0.675 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -5.249 19.497 -0.283 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -4.839 18.249 0.918 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -4.673 17.901 -0.819 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -7.313 19.313 -1.633 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -6.851 17.706 -2.245 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -8.413 17.930 -1.421 1.00 0.00 H new ATOM 457 N LEU A 58 -4.511 15.605 -0.079 1.00 0.00 N ATOM 458 CA LEU A 58 -3.427 14.880 -0.721 1.00 0.00 C ATOM 459 C LEU A 58 -3.673 13.376 -0.585 1.00 0.00 C ATOM 460 O LEU A 58 -3.513 12.629 -1.547 1.00 0.00 O ATOM 461 CB LEU A 58 -2.076 15.336 -0.166 1.00 0.00 C ATOM 462 CG LEU A 58 -1.879 16.848 -0.036 1.00 0.00 C ATOM 463 CD1 LEU A 58 -0.954 17.181 1.137 1.00 0.00 C ATOM 464 CD2 LEU A 58 -1.377 17.450 -1.350 1.00 0.00 C ATOM 0 H LEU A 58 -4.250 16.089 0.780 1.00 0.00 H new ATOM 0 HA LEU A 58 -3.399 15.102 -1.788 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -1.939 14.886 0.817 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -1.290 14.941 -0.809 1.00 0.00 H new ATOM 0 HG LEU A 58 -2.847 17.302 0.178 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -0.830 18.262 1.208 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -1.390 16.804 2.062 1.00 0.00 H new ATOM 0 HD13 LEU A 58 0.018 16.714 0.978 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -1.245 18.525 -1.231 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -0.423 16.995 -1.618 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -2.104 17.259 -2.139 1.00 0.00 H new ATOM 465 N ARG A 59 -4.059 12.979 0.619 1.00 0.00 N ATOM 466 CA ARG A 59 -4.329 11.578 0.893 1.00 0.00 C ATOM 467 C ARG A 59 -5.583 11.123 0.145 1.00 0.00 C ATOM 468 O ARG A 59 -5.898 9.934 0.120 1.00 0.00 O ATOM 469 CB ARG A 59 -4.523 11.338 2.392 1.00 0.00 C ATOM 470 CG ARG A 59 -4.732 9.851 2.687 1.00 0.00 C ATOM 471 CD ARG A 59 -4.714 9.583 4.193 1.00 0.00 C ATOM 472 NE ARG A 59 -4.394 8.161 4.450 1.00 0.00 N ATOM 473 CZ ARG A 59 -3.942 7.693 5.621 1.00 0.00 C ATOM 0 H ARG A 59 -4.191 13.603 1.415 1.00 0.00 H new ATOM 0 HA ARG A 59 -3.469 11.002 0.552 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -3.652 11.702 2.938 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -5.382 11.907 2.747 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -5.683 9.523 2.267 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -3.951 9.267 2.201 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -3.976 10.223 4.676 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -5.683 9.830 4.626 1.00 0.00 H new ATOM 0 HE ARG A 59 -4.526 7.496 3.688 1.00 0.00 H new ATOM 474 N ASN A 60 -6.265 12.092 -0.448 1.00 0.00 N ATOM 475 CA ASN A 60 -7.477 11.805 -1.195 1.00 0.00 C ATOM 476 C ASN A 60 -7.146 11.734 -2.687 1.00 0.00 C ATOM 477 O ASN A 60 -7.808 11.021 -3.441 1.00 0.00 O ATOM 478 CB ASN A 60 -8.521 12.906 -0.995 1.00 0.00 C ATOM 479 CG ASN A 60 -9.716 12.387 -0.193 1.00 0.00 C ATOM 480 OD1 ASN A 60 -10.289 11.351 -0.483 1.00 0.00 O ATOM 481 ND2 ASN A 60 -10.060 13.166 0.829 1.00 0.00 N ATOM 0 H ASN A 60 -6.001 13.077 -0.426 1.00 0.00 H new ATOM 0 HA ASN A 60 -7.878 10.857 -0.836 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -8.069 13.751 -0.476 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -8.860 13.272 -1.964 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -10.847 12.908 1.425 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -9.537 14.021 1.017 1.00 0.00 H new ATOM 482 N LYS A 61 -6.122 12.481 -3.070 1.00 0.00 N ATOM 483 CA LYS A 61 -5.695 12.512 -4.459 1.00 0.00 C ATOM 484 C LYS A 61 -4.748 11.339 -4.723 1.00 0.00 C ATOM 485 O LYS A 61 -4.749 10.768 -5.812 1.00 0.00 O ATOM 486 CB LYS A 61 -5.096 13.876 -4.806 1.00 0.00 C ATOM 487 CG LYS A 61 -5.944 14.596 -5.857 1.00 0.00 C ATOM 488 CD LYS A 61 -5.979 16.103 -5.595 1.00 0.00 C ATOM 489 CE LYS A 61 -6.057 16.886 -6.908 1.00 0.00 C ATOM 490 NZ LYS A 61 -4.702 17.266 -7.365 1.00 0.00 N ATOM 0 H LYS A 61 -5.575 13.070 -2.443 1.00 0.00 H new ATOM 0 HA LYS A 61 -6.550 12.388 -5.123 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -5.029 14.487 -3.906 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -4.080 13.747 -5.179 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -5.538 14.405 -6.850 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -6.959 14.198 -5.846 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -6.838 16.347 -4.970 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -5.088 16.401 -5.042 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -6.548 16.281 -7.670 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -6.665 17.780 -6.770 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -4.772 17.796 -8.257 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -4.246 17.861 -6.644 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -4.133 16.408 -7.516 1.00 0.00 H new ATOM 491 N ILE A 62 -3.962 11.016 -3.707 1.00 0.00 N ATOM 492 CA ILE A 62 -3.011 9.922 -3.815 1.00 0.00 C ATOM 493 C ILE A 62 -3.762 8.591 -3.752 1.00 0.00 C ATOM 494 O ILE A 62 -3.432 7.653 -4.475 1.00 0.00 O ATOM 495 CB ILE A 62 -1.913 10.059 -2.758 1.00 0.00 C ATOM 496 CG1 ILE A 62 -1.004 11.252 -3.063 1.00 0.00 C ATOM 497 CG2 ILE A 62 -1.122 8.758 -2.616 1.00 0.00 C ATOM 498 CD1 ILE A 62 -0.056 11.532 -1.896 1.00 0.00 C ATOM 0 H ILE A 62 -3.964 11.492 -2.805 1.00 0.00 H new ATOM 0 HA ILE A 62 -2.500 9.955 -4.777 1.00 0.00 H new ATOM 0 HB ILE A 62 -2.388 10.253 -1.796 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -0.426 11.052 -3.965 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -1.611 12.135 -3.262 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -0.348 8.883 -1.858 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -1.795 7.954 -2.318 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -0.658 8.508 -3.570 1.00 0.00 H new ATOM 0 HD11 ILE A 62 0.578 12.384 -2.139 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -0.637 11.755 -1.001 1.00 0.00 H new ATOM 0 HD13 ILE A 62 0.567 10.656 -1.715 1.00 0.00 H new ATOM 499 N LYS A 63 -4.759 8.551 -2.879 1.00 0.00 N ATOM 500 CA LYS A 63 -5.560 7.351 -2.712 1.00 0.00 C ATOM 501 C LYS A 63 -6.432 7.148 -3.952 1.00 0.00 C ATOM 502 O LYS A 63 -6.343 6.117 -4.616 1.00 0.00 O ATOM 503 CB LYS A 63 -6.354 7.415 -1.405 1.00 0.00 C ATOM 504 CG LYS A 63 -5.479 7.024 -0.213 1.00 0.00 C ATOM 505 CD LYS A 63 -6.286 6.244 0.827 1.00 0.00 C ATOM 506 CE LYS A 63 -5.363 5.572 1.846 1.00 0.00 C ATOM 507 NZ LYS A 63 -6.114 5.217 3.071 1.00 0.00 N ATOM 0 H LYS A 63 -5.030 9.331 -2.280 1.00 0.00 H new ATOM 0 HA LYS A 63 -4.919 6.474 -2.626 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -6.743 8.423 -1.260 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -7.214 6.747 -1.464 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -4.640 6.419 -0.556 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -5.060 7.920 0.244 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -6.971 6.918 1.341 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -6.895 5.489 0.329 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -4.922 4.676 1.410 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -4.541 6.242 2.098 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -5.473 4.762 3.752 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -6.514 6.078 3.495 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -6.884 4.561 2.829 1.00 0.00 H new ATOM 508 N ARG A 64 -7.256 8.149 -4.228 1.00 0.00 N ATOM 509 CA ARG A 64 -8.143 8.093 -5.376 1.00 0.00 C ATOM 510 C ARG A 64 -7.365 7.685 -6.629 1.00 0.00 C ATOM 511 O ARG A 64 -7.848 6.888 -7.433 1.00 0.00 O ATOM 512 CB ARG A 64 -8.815 9.446 -5.621 1.00 0.00 C ATOM 513 CG ARG A 64 -7.861 10.412 -6.326 1.00 0.00 C ATOM 514 CD ARG A 64 -8.533 11.764 -6.573 1.00 0.00 C ATOM 515 NE ARG A 64 -9.177 12.244 -5.329 1.00 0.00 N ATOM 516 CZ ARG A 64 -10.035 13.272 -5.276 1.00 0.00 C ATOM 0 H ARG A 64 -7.327 9.003 -3.675 1.00 0.00 H new ATOM 0 HA ARG A 64 -8.912 7.351 -5.163 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -9.711 9.307 -6.227 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -9.136 9.874 -4.671 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -6.966 10.552 -5.720 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -7.539 9.983 -7.275 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -7.794 12.490 -6.913 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -9.276 11.671 -7.365 1.00 0.00 H new ATOM 0 HE ARG A 64 -8.954 11.762 -4.458 1.00 0.00 H new ATOM 517 N ALA A 65 -6.173 8.248 -6.756 1.00 0.00 N ATOM 518 CA ALA A 65 -5.323 7.953 -7.897 1.00 0.00 C ATOM 519 C ALA A 65 -4.720 6.557 -7.730 1.00 0.00 C ATOM 520 O ALA A 65 -4.414 5.887 -8.716 1.00 0.00 O ATOM 521 CB ALA A 65 -4.253 9.038 -8.031 1.00 0.00 C ATOM 0 H ALA A 65 -5.775 8.907 -6.087 1.00 0.00 H new ATOM 0 HA ALA A 65 -5.904 7.953 -8.819 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -3.615 8.817 -8.887 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -4.733 10.006 -8.177 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -3.647 9.066 -7.125 1.00 0.00 H new ATOM 522 N ILE A 66 -4.567 6.160 -6.476 1.00 0.00 N ATOM 523 CA ILE A 66 -4.005 4.855 -6.167 1.00 0.00 C ATOM 524 C ILE A 66 -5.053 3.775 -6.445 1.00 0.00 C ATOM 525 O ILE A 66 -4.713 2.664 -6.846 1.00 0.00 O ATOM 526 CB ILE A 66 -3.461 4.831 -4.738 1.00 0.00 C ATOM 527 CG1 ILE A 66 -2.015 5.328 -4.694 1.00 0.00 C ATOM 528 CG2 ILE A 66 -3.608 3.439 -4.119 1.00 0.00 C ATOM 529 CD1 ILE A 66 -1.545 5.520 -3.250 1.00 0.00 C ATOM 0 H ILE A 66 -4.822 6.718 -5.661 1.00 0.00 H new ATOM 0 HA ILE A 66 -3.151 4.645 -6.812 1.00 0.00 H new ATOM 0 HB ILE A 66 -4.056 5.516 -4.134 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -1.366 4.613 -5.200 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -1.934 6.271 -5.235 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -3.214 3.449 -3.103 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -4.661 3.160 -4.097 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -3.054 2.715 -4.716 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -0.514 5.874 -3.247 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -2.182 6.253 -2.755 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -1.604 4.570 -2.719 1.00 0.00 H new ATOM 530 N ARG A 67 -6.307 4.140 -6.220 1.00 0.00 N ATOM 531 CA ARG A 67 -7.407 3.217 -6.440 1.00 0.00 C ATOM 532 C ARG A 67 -8.030 3.452 -7.817 1.00 0.00 C ATOM 533 O ARG A 67 -9.095 2.917 -8.121 1.00 0.00 O ATOM 534 CB ARG A 67 -8.484 3.376 -5.365 1.00 0.00 C ATOM 535 CG ARG A 67 -9.176 4.737 -5.481 1.00 0.00 C ATOM 536 CD ARG A 67 -10.698 4.577 -5.516 1.00 0.00 C ATOM 537 NE ARG A 67 -11.344 5.904 -5.607 1.00 0.00 N ATOM 538 CZ ARG A 67 -12.670 6.093 -5.637 1.00 0.00 C ATOM 0 H ARG A 67 -6.585 5.063 -5.887 1.00 0.00 H new ATOM 0 HA ARG A 67 -7.006 2.205 -6.388 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -9.221 2.579 -5.463 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -8.035 3.275 -4.377 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -8.892 5.366 -4.638 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -8.839 5.244 -6.385 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -10.988 3.963 -6.369 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -11.038 4.058 -4.620 1.00 0.00 H new ATOM 0 HE ARG A 67 -10.743 6.727 -5.650 1.00 0.00 H new ATOM 539 N GLU A 68 -7.340 4.256 -8.614 1.00 0.00 N ATOM 540 CA GLU A 68 -7.812 4.569 -9.952 1.00 0.00 C ATOM 541 C GLU A 68 -6.776 4.144 -10.994 1.00 0.00 C ATOM 542 O GLU A 68 -7.004 4.282 -12.195 1.00 0.00 O ATOM 543 CB GLU A 68 -8.142 6.057 -10.082 1.00 0.00 C ATOM 544 CG GLU A 68 -9.538 6.359 -9.533 1.00 0.00 C ATOM 545 CD GLU A 68 -10.517 6.674 -10.666 1.00 0.00 C ATOM 546 OE1 GLU A 68 -10.232 7.638 -11.410 1.00 0.00 O ATOM 547 OE2 GLU A 68 -11.526 5.944 -10.764 1.00 0.00 O ATOM 0 H GLU A 68 -6.458 4.700 -8.358 1.00 0.00 H new ATOM 0 HA GLU A 68 -8.730 4.009 -10.133 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -7.400 6.646 -9.543 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -8.087 6.355 -11.129 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -9.901 5.505 -8.962 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -9.487 7.204 -8.846 1.00 0.00 H new ATOM 548 N ASN A 69 -5.657 3.636 -10.497 1.00 0.00 N ATOM 549 CA ASN A 69 -4.585 3.189 -11.370 1.00 0.00 C ATOM 550 C ASN A 69 -4.700 1.679 -11.582 1.00 0.00 C ATOM 551 O ASN A 69 -4.922 1.221 -12.702 1.00 0.00 O ATOM 552 CB ASN A 69 -3.216 3.477 -10.752 1.00 0.00 C ATOM 553 CG ASN A 69 -2.091 2.910 -11.620 1.00 0.00 C ATOM 554 OD1 ASN A 69 -1.752 1.740 -11.557 1.00 0.00 O ATOM 555 ND2 ASN A 69 -1.534 3.803 -12.434 1.00 0.00 N ATOM 0 H ASN A 69 -5.470 3.524 -9.501 1.00 0.00 H new ATOM 0 HA ASN A 69 -4.675 3.725 -12.315 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -3.084 4.553 -10.637 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -3.165 3.041 -9.754 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -0.775 3.523 -13.055 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -1.866 4.767 -12.437 1.00 0.00 H new ATOM 556 N PHE A 70 -4.544 0.947 -10.488 1.00 0.00 N ATOM 557 CA PHE A 70 -4.629 -0.503 -10.541 1.00 0.00 C ATOM 558 C PHE A 70 -5.979 -0.954 -11.103 1.00 0.00 C ATOM 559 O PHE A 70 -6.102 -2.069 -11.609 1.00 0.00 O ATOM 560 CB PHE A 70 -4.493 -1.011 -9.104 1.00 0.00 C ATOM 561 CG PHE A 70 -3.121 -1.605 -8.781 1.00 0.00 C ATOM 562 CD1 PHE A 70 -2.048 -0.788 -8.607 1.00 0.00 C ATOM 563 CD2 PHE A 70 -2.973 -2.953 -8.668 1.00 0.00 C ATOM 564 CE1 PHE A 70 -0.774 -1.339 -8.307 1.00 0.00 C ATOM 565 CE2 PHE A 70 -1.699 -3.505 -8.369 1.00 0.00 C ATOM 566 CZ PHE A 70 -0.628 -2.686 -8.195 1.00 0.00 C ATOM 0 H PHE A 70 -4.359 1.330 -9.561 1.00 0.00 H new ATOM 0 HA PHE A 70 -3.846 -0.898 -11.189 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -4.691 -0.187 -8.418 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -5.257 -1.767 -8.923 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -2.165 0.282 -8.697 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -3.824 -3.603 -8.806 1.00 0.00 H new ATOM 0 HE1 PHE A 70 0.077 -0.689 -8.168 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -1.581 -4.575 -8.280 1.00 0.00 H new ATOM 0 HZ PHE A 70 0.341 -3.106 -7.967 1.00 0.00 H new ATOM 567 N LYS A 71 -6.955 -0.065 -10.995 1.00 0.00 N ATOM 568 CA LYS A 71 -8.291 -0.359 -11.486 1.00 0.00 C ATOM 569 C LYS A 71 -8.230 -0.614 -12.993 1.00 0.00 C ATOM 570 O LYS A 71 -8.714 -1.639 -13.472 1.00 0.00 O ATOM 571 CB LYS A 71 -9.263 0.753 -11.089 1.00 0.00 C ATOM 572 CG LYS A 71 -10.644 0.182 -10.757 1.00 0.00 C ATOM 573 CD LYS A 71 -10.805 -0.023 -9.250 1.00 0.00 C ATOM 574 CE LYS A 71 -12.109 0.600 -8.748 1.00 0.00 C ATOM 575 NZ LYS A 71 -11.839 1.874 -8.045 1.00 0.00 N ATOM 0 H LYS A 71 -6.848 0.858 -10.575 1.00 0.00 H new ATOM 0 HA LYS A 71 -8.677 -1.268 -11.024 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -8.872 1.292 -10.226 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -9.349 1.473 -11.903 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -11.418 0.858 -11.120 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -10.782 -0.768 -11.274 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -10.795 -1.089 -9.021 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -9.959 0.423 -8.726 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -12.781 0.777 -9.588 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -12.615 -0.093 -8.075 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -12.016 1.753 -7.027 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -10.847 2.149 -8.194 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -12.464 2.616 -8.419 1.00 0.00 H new ATOM 576 N VAL A 72 -7.633 0.336 -13.699 1.00 0.00 N ATOM 577 CA VAL A 72 -7.503 0.226 -15.142 1.00 0.00 C ATOM 578 C VAL A 72 -6.411 -0.791 -15.475 1.00 0.00 C ATOM 579 O VAL A 72 -6.577 -1.611 -16.378 1.00 0.00 O ATOM 580 CB VAL A 72 -7.242 1.606 -15.750 1.00 0.00 C ATOM 581 CG1 VAL A 72 -8.134 2.668 -15.104 1.00 0.00 C ATOM 582 CG2 VAL A 72 -5.765 1.986 -15.630 1.00 0.00 C ATOM 0 H VAL A 72 -7.234 1.185 -13.298 1.00 0.00 H new ATOM 0 HA VAL A 72 -8.431 -0.138 -15.583 1.00 0.00 H new ATOM 0 HB VAL A 72 -7.492 1.558 -16.810 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -7.928 3.639 -15.554 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -9.181 2.409 -15.262 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -7.929 2.713 -14.034 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -5.606 2.971 -16.069 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -5.479 2.007 -14.578 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -5.156 1.251 -16.157 1.00 0.00 H new ATOM 583 N HIS A 73 -5.320 -0.706 -14.730 1.00 0.00 N ATOM 584 CA HIS A 73 -4.200 -1.609 -14.936 1.00 0.00 C ATOM 585 C HIS A 73 -4.509 -2.963 -14.295 1.00 0.00 C ATOM 586 O HIS A 73 -3.648 -3.840 -14.242 1.00 0.00 O ATOM 587 CB HIS A 73 -2.900 -0.990 -14.418 1.00 0.00 C ATOM 588 CG HIS A 73 -2.461 0.240 -15.176 1.00 0.00 C ATOM 589 ND1 HIS A 73 -1.591 0.186 -16.251 1.00 0.00 N ATOM 590 CD2 HIS A 73 -2.781 1.554 -15.005 1.00 0.00 C ATOM 591 CE1 HIS A 73 -1.401 1.420 -16.698 1.00 0.00 C ATOM 592 NE2 HIS A 73 -2.140 2.265 -15.924 1.00 0.00 N ATOM 0 H HIS A 73 -5.187 -0.025 -13.982 1.00 0.00 H new ATOM 0 HA HIS A 73 -4.054 -1.776 -16.003 1.00 0.00 H new ATOM 0 HB2 HIS A 73 -3.027 -0.731 -13.367 1.00 0.00 H new ATOM 0 HB3 HIS A 73 -2.108 -1.737 -14.469 1.00 0.00 H new ATOM 0 HD1 HIS A 73 -1.168 -0.659 -16.634 1.00 0.00 H new ATOM 0 HD2 HIS A 73 -3.444 1.949 -14.250 1.00 0.00 H new ATOM 0 HE1 HIS A 73 -0.772 1.705 -17.528 1.00 0.00 H new ATOM 593 N LYS A 74 -5.739 -3.091 -13.821 1.00 0.00 N ATOM 594 CA LYS A 74 -6.172 -4.324 -13.185 1.00 0.00 C ATOM 595 C LYS A 74 -5.765 -5.513 -14.057 1.00 0.00 C ATOM 596 O LYS A 74 -5.087 -6.426 -13.589 1.00 0.00 O ATOM 597 CB LYS A 74 -7.671 -4.271 -12.879 1.00 0.00 C ATOM 598 CG LYS A 74 -8.185 -5.637 -12.420 1.00 0.00 C ATOM 599 CD LYS A 74 -9.679 -5.786 -12.714 1.00 0.00 C ATOM 600 CE LYS A 74 -9.908 -6.378 -14.106 1.00 0.00 C ATOM 601 NZ LYS A 74 -11.356 -6.517 -14.378 1.00 0.00 N ATOM 0 H LYS A 74 -6.450 -2.361 -13.864 1.00 0.00 H new ATOM 0 HA LYS A 74 -5.677 -4.450 -12.222 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -7.862 -3.528 -12.105 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -8.216 -3.953 -13.768 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -7.630 -6.427 -12.926 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -8.007 -5.756 -11.351 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -10.139 -6.427 -11.962 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -10.166 -4.813 -12.644 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -9.450 -5.738 -14.860 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -9.423 -7.352 -14.178 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -11.494 -6.920 -15.327 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -11.784 -7.146 -13.669 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -11.810 -5.582 -14.330 1.00 0.00 H new ATOM 602 N SER A 75 -6.196 -5.463 -15.309 1.00 0.00 N ATOM 603 CA SER A 75 -5.884 -6.525 -16.250 1.00 0.00 C ATOM 604 C SER A 75 -4.418 -6.432 -16.678 1.00 0.00 C ATOM 605 O SER A 75 -3.941 -7.253 -17.460 1.00 0.00 O ATOM 606 CB SER A 75 -6.799 -6.463 -17.475 1.00 0.00 C ATOM 607 OG SER A 75 -7.852 -7.421 -17.404 1.00 0.00 O ATOM 0 H SER A 75 -6.758 -4.704 -15.693 1.00 0.00 H new ATOM 0 HA SER A 75 -6.051 -7.481 -15.753 1.00 0.00 H new ATOM 0 HB2 SER A 75 -7.224 -5.463 -17.560 1.00 0.00 H new ATOM 0 HB3 SER A 75 -6.211 -6.637 -18.376 1.00 0.00 H new ATOM 0 HG SER A 75 -8.415 -7.348 -18.203 1.00 0.00 H new ATOM 608 N HIS A 76 -3.742 -5.424 -16.146 1.00 0.00 N ATOM 609 CA HIS A 76 -2.340 -5.212 -16.462 1.00 0.00 C ATOM 610 C HIS A 76 -1.472 -5.691 -15.297 1.00 0.00 C ATOM 611 O HIS A 76 -0.253 -5.786 -15.424 1.00 0.00 O ATOM 612 CB HIS A 76 -2.082 -3.750 -16.832 1.00 0.00 C ATOM 613 CG HIS A 76 -3.177 -3.123 -17.661 1.00 0.00 C ATOM 614 ND1 HIS A 76 -2.933 -2.147 -18.611 1.00 0.00 N ATOM 615 CD2 HIS A 76 -4.523 -3.343 -17.671 1.00 0.00 C ATOM 616 CE1 HIS A 76 -4.088 -1.802 -19.162 1.00 0.00 C ATOM 617 NE2 HIS A 76 -5.072 -2.544 -18.578 1.00 0.00 N ATOM 0 H HIS A 76 -4.140 -4.745 -15.498 1.00 0.00 H new ATOM 0 HA HIS A 76 -2.068 -5.802 -17.338 1.00 0.00 H new ATOM 0 HB2 HIS A 76 -1.957 -3.171 -15.917 1.00 0.00 H new ATOM 0 HB3 HIS A 76 -1.143 -3.685 -17.381 1.00 0.00 H new ATOM 0 HD2 HIS A 76 -5.052 -4.048 -17.047 1.00 0.00 H new ATOM 0 HE1 HIS A 76 -4.226 -1.063 -19.937 1.00 0.00 H new ATOM 0 HE2 HIS A 76 -6.066 -2.493 -18.801 1.00 0.00 H new ATOM 618 N ILE A 77 -2.136 -5.980 -14.188 1.00 0.00 N ATOM 619 CA ILE A 77 -1.441 -6.448 -13.000 1.00 0.00 C ATOM 620 C ILE A 77 -1.540 -7.972 -12.922 1.00 0.00 C ATOM 621 O ILE A 77 -2.494 -8.563 -13.426 1.00 0.00 O ATOM 622 CB ILE A 77 -1.969 -5.733 -11.754 1.00 0.00 C ATOM 623 CG1 ILE A 77 -1.181 -4.450 -11.484 1.00 0.00 C ATOM 624 CG2 ILE A 77 -1.972 -6.670 -10.544 1.00 0.00 C ATOM 625 CD1 ILE A 77 -1.183 -3.535 -12.710 1.00 0.00 C ATOM 0 H ILE A 77 -3.148 -5.899 -14.086 1.00 0.00 H new ATOM 0 HA ILE A 77 -0.381 -6.200 -13.057 1.00 0.00 H new ATOM 0 HB ILE A 77 -3.003 -5.443 -11.938 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -1.615 -3.925 -10.633 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -0.155 -4.700 -11.214 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -2.352 -6.137 -9.672 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -2.610 -7.529 -10.751 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -0.956 -7.012 -10.346 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -0.616 -2.631 -12.490 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -0.726 -4.054 -13.552 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -2.209 -3.267 -12.963 1.00 0.00 H new ATOM 626 N LEU A 78 -0.541 -8.567 -12.288 1.00 0.00 N ATOM 627 CA LEU A 78 -0.503 -10.012 -12.138 1.00 0.00 C ATOM 628 C LEU A 78 -0.492 -10.366 -10.649 1.00 0.00 C ATOM 629 O LEU A 78 0.042 -9.617 -9.833 1.00 0.00 O ATOM 630 CB LEU A 78 0.673 -10.602 -12.918 1.00 0.00 C ATOM 631 CG LEU A 78 1.776 -9.617 -13.314 1.00 0.00 C ATOM 632 CD1 LEU A 78 1.262 -8.598 -14.333 1.00 0.00 C ATOM 633 CD2 LEU A 78 2.376 -8.941 -12.080 1.00 0.00 C ATOM 0 H LEU A 78 0.249 -8.074 -11.872 1.00 0.00 H new ATOM 0 HA LEU A 78 -1.398 -10.462 -12.567 1.00 0.00 H new ATOM 0 HB2 LEU A 78 1.120 -11.395 -12.319 1.00 0.00 H new ATOM 0 HB3 LEU A 78 0.286 -11.067 -13.825 1.00 0.00 H new ATOM 0 HG LEU A 78 2.577 -10.177 -13.796 1.00 0.00 H new ATOM 0 HD11 LEU A 78 2.066 -7.910 -14.597 1.00 0.00 H new ATOM 0 HD12 LEU A 78 0.921 -9.119 -15.228 1.00 0.00 H new ATOM 0 HD13 LEU A 78 0.433 -8.038 -13.901 1.00 0.00 H new ATOM 0 HD21 LEU A 78 3.157 -8.246 -12.389 1.00 0.00 H new ATOM 0 HD22 LEU A 78 1.596 -8.396 -11.548 1.00 0.00 H new ATOM 0 HD23 LEU A 78 2.803 -9.698 -11.422 1.00 0.00 H new ATOM 634 N ALA A 79 -1.090 -11.508 -10.341 1.00 0.00 N ATOM 635 CA ALA A 79 -1.157 -11.970 -8.965 1.00 0.00 C ATOM 636 C ALA A 79 0.214 -11.799 -8.308 1.00 0.00 C ATOM 637 O ALA A 79 1.160 -12.511 -8.643 1.00 0.00 O ATOM 638 CB ALA A 79 -1.640 -13.421 -8.938 1.00 0.00 C ATOM 0 H ALA A 79 -1.532 -12.127 -11.021 1.00 0.00 H new ATOM 0 HA ALA A 79 -1.872 -11.378 -8.394 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -1.691 -13.768 -7.906 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -2.629 -13.484 -9.391 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -0.945 -14.046 -9.498 1.00 0.00 H new ATOM 639 N LYS A 80 0.278 -10.851 -7.384 1.00 0.00 N ATOM 640 CA LYS A 80 1.517 -10.578 -6.677 1.00 0.00 C ATOM 641 C LYS A 80 1.279 -9.471 -5.647 1.00 0.00 C ATOM 642 O LYS A 80 1.095 -8.310 -6.011 1.00 0.00 O ATOM 643 CB LYS A 80 2.642 -10.266 -7.667 1.00 0.00 C ATOM 644 CG LYS A 80 4.006 -10.293 -6.974 1.00 0.00 C ATOM 645 CD LYS A 80 4.707 -11.634 -7.197 1.00 0.00 C ATOM 646 CE LYS A 80 6.217 -11.444 -7.348 1.00 0.00 C ATOM 647 NZ LYS A 80 6.689 -12.034 -8.621 1.00 0.00 N ATOM 0 H LYS A 80 -0.509 -10.263 -7.109 1.00 0.00 H new ATOM 0 HA LYS A 80 1.844 -11.461 -6.127 1.00 0.00 H new ATOM 0 HB2 LYS A 80 2.628 -10.993 -8.479 1.00 0.00 H new ATOM 0 HB3 LYS A 80 2.477 -9.286 -8.114 1.00 0.00 H new ATOM 0 HG2 LYS A 80 4.629 -9.485 -7.357 1.00 0.00 H new ATOM 0 HG3 LYS A 80 3.879 -10.118 -5.906 1.00 0.00 H new ATOM 0 HD2 LYS A 80 4.503 -12.299 -6.358 1.00 0.00 H new ATOM 0 HD3 LYS A 80 4.306 -12.114 -8.090 1.00 0.00 H new ATOM 0 HE2 LYS A 80 6.460 -10.382 -7.320 1.00 0.00 H new ATOM 0 HE3 LYS A 80 6.734 -11.911 -6.510 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 7.716 -11.896 -8.708 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 6.474 -13.051 -8.633 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 6.209 -11.569 -9.418 1.00 0.00 H new ATOM 648 N ASP A 81 1.290 -9.869 -4.384 1.00 0.00 N ATOM 649 CA ASP A 81 1.076 -8.926 -3.300 1.00 0.00 C ATOM 650 C ASP A 81 1.780 -7.608 -3.632 1.00 0.00 C ATOM 651 O ASP A 81 2.984 -7.588 -3.879 1.00 0.00 O ATOM 652 CB ASP A 81 1.658 -9.455 -1.988 1.00 0.00 C ATOM 653 CG ASP A 81 1.555 -10.969 -1.798 1.00 0.00 C ATOM 654 OD1 ASP A 81 2.138 -11.687 -2.641 1.00 0.00 O ATOM 655 OD2 ASP A 81 0.896 -11.376 -0.817 1.00 0.00 O ATOM 0 H ASP A 81 1.444 -10.833 -4.087 1.00 0.00 H new ATOM 0 HA ASP A 81 0.002 -8.780 -3.185 1.00 0.00 H new ATOM 0 HB2 ASP A 81 2.708 -9.168 -1.932 1.00 0.00 H new ATOM 0 HB3 ASP A 81 1.149 -8.965 -1.158 1.00 0.00 H new ATOM 656 N ILE A 82 0.997 -6.539 -3.626 1.00 0.00 N ATOM 657 CA ILE A 82 1.530 -5.220 -3.923 1.00 0.00 C ATOM 658 C ILE A 82 0.881 -4.192 -2.994 1.00 0.00 C ATOM 659 O ILE A 82 -0.213 -4.419 -2.479 1.00 0.00 O ATOM 660 CB ILE A 82 1.364 -4.897 -5.410 1.00 0.00 C ATOM 661 CG1 ILE A 82 1.783 -3.456 -5.708 1.00 0.00 C ATOM 662 CG2 ILE A 82 -0.064 -5.187 -5.877 1.00 0.00 C ATOM 663 CD1 ILE A 82 0.677 -2.472 -5.318 1.00 0.00 C ATOM 0 H ILE A 82 -0.002 -6.559 -3.420 1.00 0.00 H new ATOM 0 HA ILE A 82 2.603 -5.191 -3.732 1.00 0.00 H new ATOM 0 HB ILE A 82 2.028 -5.549 -5.978 1.00 0.00 H new ATOM 0 HG12 ILE A 82 2.696 -3.218 -5.161 1.00 0.00 H new ATOM 0 HG13 ILE A 82 2.010 -3.351 -6.769 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -0.156 -4.949 -6.937 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -0.291 -6.242 -5.721 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -0.764 -4.577 -5.306 1.00 0.00 H new ATOM 0 HD11 ILE A 82 1.000 -1.455 -5.540 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -0.227 -2.697 -5.884 1.00 0.00 H new ATOM 0 HD13 ILE A 82 0.469 -2.562 -4.252 1.00 0.00 H new ATOM 664 N ILE A 83 1.582 -3.083 -2.810 1.00 0.00 N ATOM 665 CA ILE A 83 1.087 -2.019 -1.952 1.00 0.00 C ATOM 666 C ILE A 83 1.699 -0.688 -2.393 1.00 0.00 C ATOM 667 O ILE A 83 2.884 -0.440 -2.169 1.00 0.00 O ATOM 668 CB ILE A 83 1.342 -2.355 -0.481 1.00 0.00 C ATOM 669 CG1 ILE A 83 0.784 -3.735 -0.129 1.00 0.00 C ATOM 670 CG2 ILE A 83 0.787 -1.262 0.435 1.00 0.00 C ATOM 671 CD1 ILE A 83 0.943 -4.026 1.365 1.00 0.00 C ATOM 0 H ILE A 83 2.488 -2.898 -3.240 1.00 0.00 H new ATOM 0 HA ILE A 83 0.006 -1.922 -2.051 1.00 0.00 H new ATOM 0 HB ILE A 83 2.420 -2.393 -0.321 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -0.270 -3.786 -0.403 1.00 0.00 H new ATOM 0 HG13 ILE A 83 1.301 -4.499 -0.709 1.00 0.00 H new ATOM 0 HG21 ILE A 83 0.981 -1.525 1.475 1.00 0.00 H new ATOM 0 HG22 ILE A 83 1.271 -0.313 0.204 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -0.288 -1.168 0.279 1.00 0.00 H new ATOM 0 HD11 ILE A 83 0.538 -5.013 1.588 1.00 0.00 H new ATOM 0 HD12 ILE A 83 2.000 -3.998 1.631 1.00 0.00 H new ATOM 0 HD13 ILE A 83 0.404 -3.274 1.942 1.00 0.00 H new ATOM 672 N VAL A 84 0.865 0.133 -3.014 1.00 0.00 N ATOM 673 CA VAL A 84 1.309 1.432 -3.489 1.00 0.00 C ATOM 674 C VAL A 84 1.098 2.473 -2.387 1.00 0.00 C ATOM 675 O VAL A 84 -0.037 2.824 -2.069 1.00 0.00 O ATOM 676 CB VAL A 84 0.590 1.787 -4.792 1.00 0.00 C ATOM 677 CG1 VAL A 84 0.710 0.652 -5.811 1.00 0.00 C ATOM 678 CG2 VAL A 84 -0.877 2.136 -4.531 1.00 0.00 C ATOM 0 H VAL A 84 -0.116 -0.076 -3.199 1.00 0.00 H new ATOM 0 HA VAL A 84 2.375 1.411 -3.717 1.00 0.00 H new ATOM 0 HB VAL A 84 1.075 2.668 -5.213 1.00 0.00 H new ATOM 0 HG11 VAL A 84 0.190 0.930 -6.728 1.00 0.00 H new ATOM 0 HG12 VAL A 84 1.762 0.470 -6.031 1.00 0.00 H new ATOM 0 HG13 VAL A 84 0.263 -0.254 -5.401 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -1.365 2.384 -5.473 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -1.379 1.282 -4.077 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -0.933 2.991 -3.857 1.00 0.00 H new ATOM 679 N ILE A 85 2.210 2.937 -1.835 1.00 0.00 N ATOM 680 CA ILE A 85 2.161 3.930 -0.776 1.00 0.00 C ATOM 681 C ILE A 85 2.681 5.267 -1.311 1.00 0.00 C ATOM 682 O ILE A 85 3.332 5.310 -2.353 1.00 0.00 O ATOM 683 CB ILE A 85 2.909 3.431 0.462 1.00 0.00 C ATOM 684 CG1 ILE A 85 2.732 1.921 0.637 1.00 0.00 C ATOM 685 CG2 ILE A 85 2.483 4.207 1.709 1.00 0.00 C ATOM 686 CD1 ILE A 85 4.053 1.184 0.413 1.00 0.00 C ATOM 0 H ILE A 85 3.150 2.643 -2.102 1.00 0.00 H new ATOM 0 HA ILE A 85 1.132 4.093 -0.455 1.00 0.00 H new ATOM 0 HB ILE A 85 3.973 3.616 0.317 1.00 0.00 H new ATOM 0 HG12 ILE A 85 2.359 1.709 1.639 1.00 0.00 H new ATOM 0 HG13 ILE A 85 1.984 1.555 -0.066 1.00 0.00 H new ATOM 0 HG21 ILE A 85 3.029 3.833 2.575 1.00 0.00 H new ATOM 0 HG22 ILE A 85 2.702 5.266 1.571 1.00 0.00 H new ATOM 0 HG23 ILE A 85 1.413 4.076 1.871 1.00 0.00 H new ATOM 0 HD11 ILE A 85 3.899 0.113 0.543 1.00 0.00 H new ATOM 0 HD12 ILE A 85 4.411 1.379 -0.598 1.00 0.00 H new ATOM 0 HD13 ILE A 85 4.792 1.535 1.134 1.00 0.00 H new ATOM 687 N ALA A 86 2.372 6.322 -0.573 1.00 0.00 N ATOM 688 CA ALA A 86 2.800 7.656 -0.961 1.00 0.00 C ATOM 689 C ALA A 86 3.770 8.201 0.090 1.00 0.00 C ATOM 690 O ALA A 86 3.359 8.557 1.194 1.00 0.00 O ATOM 691 CB ALA A 86 1.574 8.553 -1.143 1.00 0.00 C ATOM 0 H ALA A 86 1.831 6.281 0.291 1.00 0.00 H new ATOM 0 HA ALA A 86 3.328 7.628 -1.914 1.00 0.00 H new ATOM 0 HB1 ALA A 86 1.895 9.553 -1.434 1.00 0.00 H new ATOM 0 HB2 ALA A 86 0.931 8.138 -1.920 1.00 0.00 H new ATOM 0 HB3 ALA A 86 1.021 8.608 -0.205 1.00 0.00 H new ATOM 692 N ARG A 87 5.038 8.250 -0.290 1.00 0.00 N ATOM 693 CA ARG A 87 6.070 8.746 0.605 1.00 0.00 C ATOM 694 C ARG A 87 5.700 10.138 1.121 1.00 0.00 C ATOM 695 O ARG A 87 4.549 10.558 1.014 1.00 0.00 O ATOM 696 CB ARG A 87 7.425 8.814 -0.101 1.00 0.00 C ATOM 697 CG ARG A 87 7.917 7.417 -0.482 1.00 0.00 C ATOM 698 CD ARG A 87 9.400 7.247 -0.150 1.00 0.00 C ATOM 699 NE ARG A 87 9.556 6.403 1.055 1.00 0.00 N ATOM 700 CZ ARG A 87 10.649 6.396 1.831 1.00 0.00 C ATOM 0 H ARG A 87 5.375 7.954 -1.206 1.00 0.00 H new ATOM 0 HA ARG A 87 6.145 8.052 1.443 1.00 0.00 H new ATOM 0 HB2 ARG A 87 7.342 9.430 -0.996 1.00 0.00 H new ATOM 0 HB3 ARG A 87 8.155 9.295 0.551 1.00 0.00 H new ATOM 0 HG2 ARG A 87 7.334 6.665 0.049 1.00 0.00 H new ATOM 0 HG3 ARG A 87 7.758 7.250 -1.547 1.00 0.00 H new ATOM 0 HD2 ARG A 87 9.920 6.791 -0.993 1.00 0.00 H new ATOM 0 HD3 ARG A 87 9.858 8.222 0.017 1.00 0.00 H new ATOM 0 HE ARG A 87 8.784 5.788 1.311 1.00 0.00 H new ATOM 701 N GLN A 88 6.699 10.815 1.670 1.00 0.00 N ATOM 702 CA GLN A 88 6.492 12.151 2.203 1.00 0.00 C ATOM 703 C GLN A 88 6.461 13.176 1.068 1.00 0.00 C ATOM 704 O GLN A 88 5.645 14.096 1.079 1.00 0.00 O ATOM 705 CB GLN A 88 7.570 12.504 3.230 1.00 0.00 C ATOM 706 CG GLN A 88 8.619 13.439 2.626 1.00 0.00 C ATOM 707 CD GLN A 88 9.095 14.467 3.655 1.00 0.00 C ATOM 708 OE1 GLN A 88 8.845 14.355 4.844 1.00 0.00 O ATOM 709 NE2 GLN A 88 9.792 15.472 3.133 1.00 0.00 N ATOM 0 H GLN A 88 7.653 10.464 1.757 1.00 0.00 H new ATOM 0 HA GLN A 88 5.529 12.173 2.713 1.00 0.00 H new ATOM 0 HB2 GLN A 88 7.110 12.979 4.096 1.00 0.00 H new ATOM 0 HB3 GLN A 88 8.051 11.593 3.585 1.00 0.00 H new ATOM 0 HG2 GLN A 88 9.468 12.856 2.269 1.00 0.00 H new ATOM 0 HG3 GLN A 88 8.199 13.953 1.761 1.00 0.00 H new ATOM 0 HE21 GLN A 88 9.965 15.505 2.128 1.00 0.00 H new ATOM 0 HE22 GLN A 88 10.153 16.210 3.737 1.00 0.00 H new ATOM 710 N PRO A 89 7.385 12.979 0.089 1.00 0.00 N ATOM 711 CA PRO A 89 7.470 13.875 -1.052 1.00 0.00 C ATOM 712 C PRO A 89 6.324 13.624 -2.033 1.00 0.00 C ATOM 713 O PRO A 89 6.277 14.227 -3.104 1.00 0.00 O ATOM 714 CB PRO A 89 8.839 13.613 -1.656 1.00 0.00 C ATOM 715 CG PRO A 89 9.280 12.261 -1.119 1.00 0.00 C ATOM 716 CD PRO A 89 8.367 11.900 0.042 1.00 0.00 C ATOM 0 HA PRO A 89 7.367 14.924 -0.773 1.00 0.00 H new ATOM 0 HB2 PRO A 89 8.790 13.604 -2.745 1.00 0.00 H new ATOM 0 HB3 PRO A 89 9.546 14.394 -1.375 1.00 0.00 H new ATOM 0 HG2 PRO A 89 9.222 11.503 -1.900 1.00 0.00 H new ATOM 0 HG3 PRO A 89 10.318 12.301 -0.790 1.00 0.00 H new ATOM 0 HD2 PRO A 89 7.887 10.934 -0.117 1.00 0.00 H new ATOM 0 HD3 PRO A 89 8.923 11.830 0.977 1.00 0.00 H new ATOM 717 N ALA A 90 5.429 12.732 -1.633 1.00 0.00 N ATOM 718 CA ALA A 90 4.286 12.394 -2.465 1.00 0.00 C ATOM 719 C ALA A 90 3.278 13.544 -2.430 1.00 0.00 C ATOM 720 O ALA A 90 2.338 13.574 -3.224 1.00 0.00 O ATOM 721 CB ALA A 90 3.682 11.073 -1.988 1.00 0.00 C ATOM 0 H ALA A 90 5.472 12.233 -0.744 1.00 0.00 H new ATOM 0 HA ALA A 90 4.592 12.256 -3.502 1.00 0.00 H new ATOM 0 HB1 ALA A 90 2.825 10.819 -2.611 1.00 0.00 H new ATOM 0 HB2 ALA A 90 4.430 10.284 -2.060 1.00 0.00 H new ATOM 0 HB3 ALA A 90 3.360 11.173 -0.952 1.00 0.00 H new ATOM 722 N LYS A 91 3.505 14.461 -1.502 1.00 0.00 N ATOM 723 CA LYS A 91 2.628 15.609 -1.353 1.00 0.00 C ATOM 724 C LYS A 91 2.862 16.578 -2.514 1.00 0.00 C ATOM 725 O LYS A 91 1.929 17.229 -2.983 1.00 0.00 O ATOM 726 CB LYS A 91 2.808 16.247 0.025 1.00 0.00 C ATOM 727 CG LYS A 91 4.207 16.850 0.171 1.00 0.00 C ATOM 728 CD LYS A 91 4.209 17.989 1.194 1.00 0.00 C ATOM 729 CE LYS A 91 5.083 19.151 0.719 1.00 0.00 C ATOM 730 NZ LYS A 91 6.331 19.219 1.511 1.00 0.00 N ATOM 0 H LYS A 91 4.285 14.432 -0.845 1.00 0.00 H new ATOM 0 HA LYS A 91 1.584 15.299 -1.401 1.00 0.00 H new ATOM 0 HB2 LYS A 91 2.056 17.023 0.172 1.00 0.00 H new ATOM 0 HB3 LYS A 91 2.648 15.498 0.800 1.00 0.00 H new ATOM 0 HG2 LYS A 91 4.910 16.077 0.481 1.00 0.00 H new ATOM 0 HG3 LYS A 91 4.549 17.223 -0.795 1.00 0.00 H new ATOM 0 HD2 LYS A 91 3.189 18.339 1.356 1.00 0.00 H new ATOM 0 HD3 LYS A 91 4.576 17.621 2.152 1.00 0.00 H new ATOM 0 HE2 LYS A 91 5.322 19.026 -0.337 1.00 0.00 H new ATOM 0 HE3 LYS A 91 4.534 20.088 0.813 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 6.912 20.013 1.175 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 6.098 19.360 2.515 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 6.861 18.331 1.400 1.00 0.00 H new ATOM 731 N ASP A 92 4.113 16.644 -2.945 1.00 0.00 N ATOM 732 CA ASP A 92 4.482 17.523 -4.042 1.00 0.00 C ATOM 733 C ASP A 92 4.117 16.855 -5.369 1.00 0.00 C ATOM 734 O ASP A 92 4.389 17.400 -6.438 1.00 0.00 O ATOM 735 CB ASP A 92 5.988 17.795 -4.048 1.00 0.00 C ATOM 736 CG ASP A 92 6.387 19.231 -3.703 1.00 0.00 C ATOM 737 OD1 ASP A 92 6.408 20.055 -4.642 1.00 0.00 O ATOM 738 OD2 ASP A 92 6.662 19.471 -2.507 1.00 0.00 O ATOM 0 H ASP A 92 4.884 16.103 -2.554 1.00 0.00 H new ATOM 0 HA ASP A 92 3.947 18.464 -3.915 1.00 0.00 H new ATOM 0 HB2 ASP A 92 6.467 17.120 -3.338 1.00 0.00 H new ATOM 0 HB3 ASP A 92 6.382 17.551 -5.035 1.00 0.00 H new ATOM 739 N MET A 93 3.506 15.685 -5.257 1.00 0.00 N ATOM 740 CA MET A 93 3.100 14.936 -6.436 1.00 0.00 C ATOM 741 C MET A 93 1.585 15.001 -6.631 1.00 0.00 C ATOM 742 O MET A 93 0.823 14.761 -5.694 1.00 0.00 O ATOM 743 CB MET A 93 3.535 13.477 -6.289 1.00 0.00 C ATOM 744 CG MET A 93 3.050 12.638 -7.473 1.00 0.00 C ATOM 745 SD MET A 93 2.623 10.995 -6.922 1.00 0.00 S ATOM 746 CE MET A 93 1.552 11.395 -5.551 1.00 0.00 C ATOM 0 H MET A 93 3.282 15.237 -4.369 1.00 0.00 H new ATOM 0 HA MET A 93 3.579 15.380 -7.309 1.00 0.00 H new ATOM 0 HB2 MET A 93 4.622 13.423 -6.221 1.00 0.00 H new ATOM 0 HB3 MET A 93 3.137 13.067 -5.361 1.00 0.00 H new ATOM 0 HG2 MET A 93 2.184 13.112 -7.935 1.00 0.00 H new ATOM 0 HG3 MET A 93 3.828 12.584 -8.234 1.00 0.00 H new ATOM 0 HE1 MET A 93 0.912 10.541 -5.328 1.00 0.00 H new ATOM 0 HE2 MET A 93 2.156 11.635 -4.676 1.00 0.00 H new ATOM 0 HE3 MET A 93 0.933 12.254 -5.811 1.00 0.00 H new ATOM 747 N THR A 94 1.190 15.325 -7.854 1.00 0.00 N ATOM 748 CA THR A 94 -0.221 15.423 -8.184 1.00 0.00 C ATOM 749 C THR A 94 -0.692 14.154 -8.896 1.00 0.00 C ATOM 750 O THR A 94 0.101 13.469 -9.541 1.00 0.00 O ATOM 751 CB THR A 94 -0.426 16.696 -9.009 1.00 0.00 C ATOM 752 OG1 THR A 94 0.685 16.714 -9.901 1.00 0.00 O ATOM 753 CG2 THR A 94 -0.257 17.967 -8.176 1.00 0.00 C ATOM 0 H THR A 94 1.824 15.523 -8.628 1.00 0.00 H new ATOM 0 HA THR A 94 -0.833 15.499 -7.285 1.00 0.00 H new ATOM 0 HB THR A 94 -1.421 16.684 -9.454 1.00 0.00 H new ATOM 0 HG1 THR A 94 0.631 17.506 -10.475 1.00 0.00 H new ATOM 0 HG21 THR A 94 -0.413 18.840 -8.809 1.00 0.00 H new ATOM 0 HG22 THR A 94 -0.987 17.971 -7.366 1.00 0.00 H new ATOM 0 HG23 THR A 94 0.749 17.997 -7.758 1.00 0.00 H new ATOM 754 N THR A 95 -1.981 13.879 -8.756 1.00 0.00 N ATOM 755 CA THR A 95 -2.566 12.703 -9.379 1.00 0.00 C ATOM 756 C THR A 95 -2.106 12.585 -10.833 1.00 0.00 C ATOM 757 O THR A 95 -2.107 11.493 -11.402 1.00 0.00 O ATOM 758 CB THR A 95 -4.086 12.798 -9.229 1.00 0.00 C ATOM 759 OG1 THR A 95 -4.347 12.208 -7.959 1.00 0.00 O ATOM 760 CG2 THR A 95 -4.829 11.896 -10.217 1.00 0.00 C ATOM 0 H THR A 95 -2.636 14.449 -8.221 1.00 0.00 H new ATOM 0 HA THR A 95 -2.232 11.788 -8.890 1.00 0.00 H new ATOM 0 HB THR A 95 -4.401 13.832 -9.372 1.00 0.00 H new ATOM 0 HG1 THR A 95 -5.310 12.229 -7.780 1.00 0.00 H new ATOM 0 HG21 THR A 95 -5.904 12.001 -10.068 1.00 0.00 H new ATOM 0 HG22 THR A 95 -4.574 12.185 -11.236 1.00 0.00 H new ATOM 0 HG23 THR A 95 -4.540 10.858 -10.051 1.00 0.00 H new ATOM 761 N LEU A 96 -1.721 13.722 -11.393 1.00 0.00 N ATOM 762 CA LEU A 96 -1.258 13.759 -12.770 1.00 0.00 C ATOM 763 C LEU A 96 0.078 13.021 -12.875 1.00 0.00 C ATOM 764 O LEU A 96 0.309 12.279 -13.828 1.00 0.00 O ATOM 765 CB LEU A 96 -1.205 15.201 -13.279 1.00 0.00 C ATOM 766 CG LEU A 96 -1.074 15.373 -14.794 1.00 0.00 C ATOM 767 CD1 LEU A 96 0.394 15.500 -15.206 1.00 0.00 C ATOM 768 CD2 LEU A 96 -1.783 14.239 -15.538 1.00 0.00 C ATOM 0 H LEU A 96 -1.720 14.625 -10.918 1.00 0.00 H new ATOM 0 HA LEU A 96 -1.961 13.240 -13.422 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -2.109 15.714 -12.952 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -0.363 15.703 -12.802 1.00 0.00 H new ATOM 0 HG LEU A 96 -1.569 16.302 -15.077 1.00 0.00 H new ATOM 0 HD11 LEU A 96 0.459 15.621 -16.287 1.00 0.00 H new ATOM 0 HD12 LEU A 96 0.836 16.368 -14.716 1.00 0.00 H new ATOM 0 HD13 LEU A 96 0.934 14.601 -14.908 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -1.675 14.385 -16.613 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -1.339 13.285 -15.255 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -2.841 14.238 -15.277 1.00 0.00 H new ATOM 769 N GLN A 97 0.923 13.250 -11.881 1.00 0.00 N ATOM 770 CA GLN A 97 2.230 12.615 -11.848 1.00 0.00 C ATOM 771 C GLN A 97 2.112 11.182 -11.327 1.00 0.00 C ATOM 772 O GLN A 97 3.028 10.379 -11.497 1.00 0.00 O ATOM 773 CB GLN A 97 3.214 13.427 -11.002 1.00 0.00 C ATOM 774 CG GLN A 97 3.015 14.929 -11.220 1.00 0.00 C ATOM 775 CD GLN A 97 4.137 15.732 -10.560 1.00 0.00 C ATOM 776 OE1 GLN A 97 5.185 15.213 -10.212 1.00 0.00 O ATOM 777 NE2 GLN A 97 3.861 17.024 -10.409 1.00 0.00 N ATOM 0 H GLN A 97 0.728 13.867 -11.092 1.00 0.00 H new ATOM 0 HA GLN A 97 2.620 12.580 -12.865 1.00 0.00 H new ATOM 0 HB2 GLN A 97 3.076 13.188 -9.948 1.00 0.00 H new ATOM 0 HB3 GLN A 97 4.236 13.151 -11.261 1.00 0.00 H new ATOM 0 HG2 GLN A 97 2.988 15.145 -12.288 1.00 0.00 H new ATOM 0 HG3 GLN A 97 2.053 15.236 -10.809 1.00 0.00 H new ATOM 0 HE21 GLN A 97 2.964 17.394 -10.723 1.00 0.00 H new ATOM 0 HE22 GLN A 97 4.547 17.645 -9.980 1.00 0.00 H new ATOM 778 N ILE A 98 0.977 10.905 -10.703 1.00 0.00 N ATOM 779 CA ILE A 98 0.727 9.583 -10.156 1.00 0.00 C ATOM 780 C ILE A 98 0.644 8.570 -11.300 1.00 0.00 C ATOM 781 O ILE A 98 1.386 7.589 -11.320 1.00 0.00 O ATOM 782 CB ILE A 98 -0.512 9.599 -9.258 1.00 0.00 C ATOM 783 CG1 ILE A 98 -0.166 10.104 -7.856 1.00 0.00 C ATOM 784 CG2 ILE A 98 -1.182 8.224 -9.223 1.00 0.00 C ATOM 785 CD1 ILE A 98 -1.400 10.100 -6.952 1.00 0.00 C ATOM 0 H ILE A 98 0.220 11.574 -10.564 1.00 0.00 H new ATOM 0 HA ILE A 98 1.553 9.274 -9.515 1.00 0.00 H new ATOM 0 HB ILE A 98 -1.233 10.297 -9.683 1.00 0.00 H new ATOM 0 HG12 ILE A 98 0.610 9.475 -7.420 1.00 0.00 H new ATOM 0 HG13 ILE A 98 0.240 11.114 -7.919 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -2.060 8.263 -8.578 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -1.485 7.941 -10.231 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -0.479 7.487 -8.835 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -1.127 10.463 -5.961 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -2.165 10.749 -7.378 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -1.789 9.085 -6.872 1.00 0.00 H new ATOM 786 N GLN A 99 -0.266 8.841 -12.224 1.00 0.00 N ATOM 787 CA GLN A 99 -0.456 7.966 -13.368 1.00 0.00 C ATOM 788 C GLN A 99 0.847 7.839 -14.161 1.00 0.00 C ATOM 789 O GLN A 99 1.068 6.840 -14.843 1.00 0.00 O ATOM 790 CB GLN A 99 -1.595 8.468 -14.259 1.00 0.00 C ATOM 791 CG GLN A 99 -2.948 8.301 -13.565 1.00 0.00 C ATOM 792 CD GLN A 99 -3.901 9.437 -13.942 1.00 0.00 C ATOM 793 OE1 GLN A 99 -4.536 9.429 -14.983 1.00 0.00 O ATOM 794 NE2 GLN A 99 -3.963 10.412 -13.039 1.00 0.00 N ATOM 0 H GLN A 99 -0.880 9.655 -12.203 1.00 0.00 H new ATOM 0 HA GLN A 99 -0.734 6.977 -13.003 1.00 0.00 H new ATOM 0 HB2 GLN A 99 -1.435 9.518 -14.503 1.00 0.00 H new ATOM 0 HB3 GLN A 99 -1.595 7.918 -15.200 1.00 0.00 H new ATOM 0 HG2 GLN A 99 -3.389 7.344 -13.845 1.00 0.00 H new ATOM 0 HG3 GLN A 99 -2.807 8.283 -12.484 1.00 0.00 H new ATOM 0 HE21 GLN A 99 -3.404 10.355 -12.188 1.00 0.00 H new ATOM 0 HE22 GLN A 99 -4.570 11.216 -13.198 1.00 0.00 H new ATOM 795 N ASN A 100 1.675 8.867 -14.045 1.00 0.00 N ATOM 796 CA ASN A 100 2.949 8.883 -14.743 1.00 0.00 C ATOM 797 C ASN A 100 4.023 8.263 -13.848 1.00 0.00 C ATOM 798 O ASN A 100 5.096 7.895 -14.324 1.00 0.00 O ATOM 799 CB ASN A 100 3.377 10.315 -15.074 1.00 0.00 C ATOM 800 CG ASN A 100 2.621 10.845 -16.294 1.00 0.00 C ATOM 801 OD1 ASN A 100 2.599 10.240 -17.354 1.00 0.00 O ATOM 802 ND2 ASN A 100 2.006 12.006 -16.086 1.00 0.00 N ATOM 0 H ASN A 100 1.488 9.694 -13.478 1.00 0.00 H new ATOM 0 HA ASN A 100 2.835 8.318 -15.668 1.00 0.00 H new ATOM 0 HB2 ASN A 100 3.190 10.962 -14.217 1.00 0.00 H new ATOM 0 HB3 ASN A 100 4.450 10.343 -15.266 1.00 0.00 H new ATOM 0 HD21 ASN A 100 1.475 12.444 -16.839 1.00 0.00 H new ATOM 0 HD22 ASN A 100 2.065 12.458 -15.174 1.00 0.00 H new ATOM 803 N SER A 101 3.698 8.167 -12.567 1.00 0.00 N ATOM 804 CA SER A 101 4.623 7.597 -11.601 1.00 0.00 C ATOM 805 C SER A 101 4.405 6.086 -11.495 1.00 0.00 C ATOM 806 O SER A 101 5.362 5.315 -11.518 1.00 0.00 O ATOM 807 CB SER A 101 4.459 8.254 -10.229 1.00 0.00 C ATOM 808 OG SER A 101 5.053 9.549 -10.182 1.00 0.00 O ATOM 0 H SER A 101 2.808 8.474 -12.175 1.00 0.00 H new ATOM 0 HA SER A 101 5.639 7.787 -11.947 1.00 0.00 H new ATOM 0 HB2 SER A 101 3.399 8.333 -9.989 1.00 0.00 H new ATOM 0 HB3 SER A 101 4.912 7.620 -9.467 1.00 0.00 H new ATOM 0 HG SER A 101 4.371 10.229 -10.364 1.00 0.00 H new ATOM 809 N LEU A 102 3.139 5.710 -11.383 1.00 0.00 N ATOM 810 CA LEU A 102 2.783 4.306 -11.274 1.00 0.00 C ATOM 811 C LEU A 102 3.411 3.534 -12.437 1.00 0.00 C ATOM 812 O LEU A 102 3.661 2.334 -12.326 1.00 0.00 O ATOM 813 CB LEU A 102 1.265 4.143 -11.176 1.00 0.00 C ATOM 814 CG LEU A 102 0.710 3.855 -9.779 1.00 0.00 C ATOM 815 CD1 LEU A 102 -0.576 4.646 -9.526 1.00 0.00 C ATOM 816 CD2 LEU A 102 0.512 2.353 -9.567 1.00 0.00 C ATOM 0 H LEU A 102 2.348 6.353 -11.365 1.00 0.00 H new ATOM 0 HA LEU A 102 3.185 3.881 -10.354 1.00 0.00 H new ATOM 0 HB2 LEU A 102 0.797 5.053 -11.551 1.00 0.00 H new ATOM 0 HB3 LEU A 102 0.963 3.333 -11.840 1.00 0.00 H new ATOM 0 HG LEU A 102 1.442 4.189 -9.044 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -0.950 4.423 -8.527 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -0.369 5.713 -9.606 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -1.327 4.366 -10.265 1.00 0.00 H new ATOM 0 HD21 LEU A 102 0.117 2.176 -8.567 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -0.190 1.970 -10.308 1.00 0.00 H new ATOM 0 HD23 LEU A 102 1.468 1.841 -9.675 1.00 0.00 H new ATOM 817 N GLU A 103 3.646 4.253 -13.524 1.00 0.00 N ATOM 818 CA GLU A 103 4.238 3.649 -14.706 1.00 0.00 C ATOM 819 C GLU A 103 5.727 3.382 -14.475 1.00 0.00 C ATOM 820 O GLU A 103 6.414 2.872 -15.359 1.00 0.00 O ATOM 821 CB GLU A 103 4.025 4.533 -15.937 1.00 0.00 C ATOM 822 CG GLU A 103 2.898 3.984 -16.816 1.00 0.00 C ATOM 823 CD GLU A 103 3.111 4.366 -18.282 1.00 0.00 C ATOM 824 OE1 GLU A 103 4.124 3.899 -18.848 1.00 0.00 O ATOM 825 OE2 GLU A 103 2.258 5.115 -18.803 1.00 0.00 O ATOM 0 H GLU A 103 3.438 5.248 -13.612 1.00 0.00 H new ATOM 0 HA GLU A 103 3.742 2.696 -14.892 1.00 0.00 H new ATOM 0 HB2 GLU A 103 3.785 5.549 -15.623 1.00 0.00 H new ATOM 0 HB3 GLU A 103 4.948 4.588 -16.514 1.00 0.00 H new ATOM 0 HG2 GLU A 103 2.854 2.899 -16.722 1.00 0.00 H new ATOM 0 HG3 GLU A 103 1.940 4.373 -16.471 1.00 0.00 H new ATOM 826 N HIS A 104 6.182 3.739 -13.283 1.00 0.00 N ATOM 827 CA HIS A 104 7.576 3.544 -12.925 1.00 0.00 C ATOM 828 C HIS A 104 7.665 2.779 -11.602 1.00 0.00 C ATOM 829 O HIS A 104 7.979 1.591 -11.586 1.00 0.00 O ATOM 830 CB HIS A 104 8.321 4.880 -12.889 1.00 0.00 C ATOM 831 CG HIS A 104 9.716 4.791 -12.317 1.00 0.00 C ATOM 832 ND1 HIS A 104 10.782 5.510 -12.827 1.00 0.00 N ATOM 833 CD2 HIS A 104 10.207 4.062 -11.274 1.00 0.00 C ATOM 834 CE1 HIS A 104 11.862 5.218 -12.116 1.00 0.00 C ATOM 835 NE2 HIS A 104 11.503 4.321 -11.155 1.00 0.00 N ATOM 0 H HIS A 104 5.609 4.162 -12.553 1.00 0.00 H new ATOM 0 HA HIS A 104 8.069 2.941 -13.687 1.00 0.00 H new ATOM 0 HB2 HIS A 104 8.380 5.279 -13.902 1.00 0.00 H new ATOM 0 HB3 HIS A 104 7.742 5.591 -12.299 1.00 0.00 H new ATOM 0 HD1 HIS A 104 10.744 6.155 -13.616 1.00 0.00 H new ATOM 0 HD2 HIS A 104 9.638 3.388 -10.651 1.00 0.00 H new ATOM 0 HE1 HIS A 104 12.852 5.620 -12.271 1.00 0.00 H new ATOM 836 N VAL A 105 7.382 3.495 -10.523 1.00 0.00 N ATOM 837 CA VAL A 105 7.425 2.901 -9.198 1.00 0.00 C ATOM 838 C VAL A 105 6.869 1.477 -9.265 1.00 0.00 C ATOM 839 O VAL A 105 7.518 0.532 -8.819 1.00 0.00 O ATOM 840 CB VAL A 105 6.678 3.788 -8.201 1.00 0.00 C ATOM 841 CG1 VAL A 105 5.163 3.625 -8.350 1.00 0.00 C ATOM 842 CG2 VAL A 105 7.122 3.495 -6.766 1.00 0.00 C ATOM 0 H VAL A 105 7.122 4.481 -10.540 1.00 0.00 H new ATOM 0 HA VAL A 105 8.453 2.833 -8.843 1.00 0.00 H new ATOM 0 HB VAL A 105 6.927 4.825 -8.424 1.00 0.00 H new ATOM 0 HG11 VAL A 105 4.655 4.266 -7.630 1.00 0.00 H new ATOM 0 HG12 VAL A 105 4.864 3.906 -9.360 1.00 0.00 H new ATOM 0 HG13 VAL A 105 4.889 2.586 -8.167 1.00 0.00 H new ATOM 0 HG21 VAL A 105 6.575 4.139 -6.077 1.00 0.00 H new ATOM 0 HG22 VAL A 105 6.916 2.452 -6.527 1.00 0.00 H new ATOM 0 HG23 VAL A 105 8.191 3.685 -6.670 1.00 0.00 H new ATOM 843 N LEU A 106 5.673 1.368 -9.825 1.00 0.00 N ATOM 844 CA LEU A 106 5.022 0.075 -9.956 1.00 0.00 C ATOM 845 C LEU A 106 5.799 -0.782 -10.957 1.00 0.00 C ATOM 846 O LEU A 106 6.026 -1.968 -10.718 1.00 0.00 O ATOM 847 CB LEU A 106 3.546 0.252 -10.314 1.00 0.00 C ATOM 848 CG LEU A 106 3.107 -0.329 -11.659 1.00 0.00 C ATOM 849 CD1 LEU A 106 3.443 -1.819 -11.748 1.00 0.00 C ATOM 850 CD2 LEU A 106 1.623 -0.060 -11.916 1.00 0.00 C ATOM 0 H LEU A 106 5.138 2.154 -10.193 1.00 0.00 H new ATOM 0 HA LEU A 106 5.033 -0.456 -9.004 1.00 0.00 H new ATOM 0 HB2 LEU A 106 2.945 -0.207 -9.529 1.00 0.00 H new ATOM 0 HB3 LEU A 106 3.317 1.318 -10.309 1.00 0.00 H new ATOM 0 HG LEU A 106 3.666 0.175 -12.447 1.00 0.00 H new ATOM 0 HD11 LEU A 106 3.120 -2.208 -12.714 1.00 0.00 H new ATOM 0 HD12 LEU A 106 4.519 -1.956 -11.643 1.00 0.00 H new ATOM 0 HD13 LEU A 106 2.929 -2.356 -10.951 1.00 0.00 H new ATOM 0 HD21 LEU A 106 1.338 -0.484 -12.879 1.00 0.00 H new ATOM 0 HD22 LEU A 106 1.028 -0.519 -11.127 1.00 0.00 H new ATOM 0 HD23 LEU A 106 1.444 1.015 -11.926 1.00 0.00 H new ATOM 851 N LYS A 107 6.186 -0.151 -12.055 1.00 0.00 N ATOM 852 CA LYS A 107 6.931 -0.842 -13.092 1.00 0.00 C ATOM 853 C LYS A 107 8.165 -1.502 -12.475 1.00 0.00 C ATOM 854 O LYS A 107 8.715 -2.448 -13.036 1.00 0.00 O ATOM 855 CB LYS A 107 7.256 0.111 -14.244 1.00 0.00 C ATOM 856 CG LYS A 107 8.023 -0.610 -15.354 1.00 0.00 C ATOM 857 CD LYS A 107 9.504 -0.224 -15.337 1.00 0.00 C ATOM 858 CE LYS A 107 10.374 -1.363 -15.871 1.00 0.00 C ATOM 859 NZ LYS A 107 11.764 -1.228 -15.379 1.00 0.00 N ATOM 0 H LYS A 107 5.997 0.832 -12.249 1.00 0.00 H new ATOM 0 HA LYS A 107 6.327 -1.638 -13.527 1.00 0.00 H new ATOM 0 HB2 LYS A 107 6.333 0.528 -14.647 1.00 0.00 H new ATOM 0 HB3 LYS A 107 7.848 0.947 -13.872 1.00 0.00 H new ATOM 0 HG2 LYS A 107 7.923 -1.688 -15.229 1.00 0.00 H new ATOM 0 HG3 LYS A 107 7.589 -0.360 -16.322 1.00 0.00 H new ATOM 0 HD2 LYS A 107 9.657 0.670 -15.942 1.00 0.00 H new ATOM 0 HD3 LYS A 107 9.807 0.024 -14.320 1.00 0.00 H new ATOM 0 HE2 LYS A 107 9.962 -2.322 -15.556 1.00 0.00 H new ATOM 0 HE3 LYS A 107 10.365 -1.355 -16.961 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 12.341 -2.009 -15.751 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 12.160 -0.322 -15.701 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 11.769 -1.258 -14.339 1.00 0.00 H new ATOM 860 N ILE A 108 8.565 -0.976 -11.325 1.00 0.00 N ATOM 861 CA ILE A 108 9.723 -1.502 -10.624 1.00 0.00 C ATOM 862 C ILE A 108 9.281 -2.633 -9.694 1.00 0.00 C ATOM 863 O ILE A 108 10.020 -3.595 -9.485 1.00 0.00 O ATOM 864 CB ILE A 108 10.474 -0.376 -9.911 1.00 0.00 C ATOM 865 CG1 ILE A 108 10.890 0.717 -10.897 1.00 0.00 C ATOM 866 CG2 ILE A 108 11.668 -0.925 -9.126 1.00 0.00 C ATOM 867 CD1 ILE A 108 12.139 1.452 -10.406 1.00 0.00 C ATOM 0 H ILE A 108 8.107 -0.191 -10.862 1.00 0.00 H new ATOM 0 HA ILE A 108 10.434 -1.930 -11.330 1.00 0.00 H new ATOM 0 HB ILE A 108 9.797 0.083 -9.190 1.00 0.00 H new ATOM 0 HG12 ILE A 108 11.084 0.275 -11.874 1.00 0.00 H new ATOM 0 HG13 ILE A 108 10.073 1.427 -11.025 1.00 0.00 H new ATOM 0 HG21 ILE A 108 12.185 -0.104 -8.629 1.00 0.00 H new ATOM 0 HG22 ILE A 108 11.316 -1.638 -8.380 1.00 0.00 H new ATOM 0 HG23 ILE A 108 12.354 -1.425 -9.810 1.00 0.00 H new ATOM 0 HD11 ILE A 108 12.413 2.224 -11.125 1.00 0.00 H new ATOM 0 HD12 ILE A 108 11.934 1.913 -9.440 1.00 0.00 H new ATOM 0 HD13 ILE A 108 12.961 0.744 -10.303 1.00 0.00 H new ATOM 868 N ALA A 109 8.078 -2.480 -9.159 1.00 0.00 N ATOM 869 CA ALA A 109 7.529 -3.476 -8.255 1.00 0.00 C ATOM 870 C ALA A 109 7.542 -4.844 -8.942 1.00 0.00 C ATOM 871 O ALA A 109 7.799 -5.862 -8.301 1.00 0.00 O ATOM 872 CB ALA A 109 6.123 -3.055 -7.824 1.00 0.00 C ATOM 0 H ALA A 109 7.469 -1.681 -9.335 1.00 0.00 H new ATOM 0 HA ALA A 109 8.137 -3.553 -7.354 1.00 0.00 H new ATOM 0 HB1 ALA A 109 5.711 -3.802 -7.146 1.00 0.00 H new ATOM 0 HB2 ALA A 109 6.171 -2.092 -7.316 1.00 0.00 H new ATOM 0 HB3 ALA A 109 5.483 -2.971 -8.702 1.00 0.00 H new ATOM 873 N LYS A 110 7.263 -4.823 -10.237 1.00 0.00 N ATOM 874 CA LYS A 110 7.240 -6.048 -11.018 1.00 0.00 C ATOM 875 C LYS A 110 5.808 -6.584 -11.075 1.00 0.00 C ATOM 876 O LYS A 110 5.593 -7.760 -11.364 1.00 0.00 O ATOM 877 CB LYS A 110 8.251 -7.055 -10.465 1.00 0.00 C ATOM 878 CG LYS A 110 8.676 -8.054 -11.543 1.00 0.00 C ATOM 879 CD LYS A 110 8.633 -9.488 -11.009 1.00 0.00 C ATOM 880 CE LYS A 110 10.002 -10.160 -11.133 1.00 0.00 C ATOM 881 NZ LYS A 110 10.756 -10.036 -9.867 1.00 0.00 N ATOM 0 H LYS A 110 7.051 -3.977 -10.765 1.00 0.00 H new ATOM 0 HA LYS A 110 7.549 -5.851 -12.045 1.00 0.00 H new ATOM 0 HB2 LYS A 110 9.127 -6.527 -10.088 1.00 0.00 H new ATOM 0 HB3 LYS A 110 7.813 -7.589 -9.621 1.00 0.00 H new ATOM 0 HG2 LYS A 110 8.018 -7.964 -12.407 1.00 0.00 H new ATOM 0 HG3 LYS A 110 9.684 -7.819 -11.884 1.00 0.00 H new ATOM 0 HD2 LYS A 110 8.320 -9.482 -9.965 1.00 0.00 H new ATOM 0 HD3 LYS A 110 7.890 -10.063 -11.561 1.00 0.00 H new ATOM 0 HE2 LYS A 110 9.875 -11.213 -11.386 1.00 0.00 H new ATOM 0 HE3 LYS A 110 10.566 -9.702 -11.946 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 11.683 -10.497 -9.968 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 10.893 -9.030 -9.642 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 10.224 -10.493 -9.100 1.00 0.00 H new ATOM 882 N VAL A 111 4.867 -5.696 -10.795 1.00 0.00 N ATOM 883 CA VAL A 111 3.461 -6.065 -10.811 1.00 0.00 C ATOM 884 C VAL A 111 2.850 -5.667 -12.157 1.00 0.00 C ATOM 885 O VAL A 111 1.660 -5.364 -12.237 1.00 0.00 O ATOM 886 CB VAL A 111 2.741 -5.434 -9.618 1.00 0.00 C ATOM 887 CG1 VAL A 111 3.574 -5.567 -8.342 1.00 0.00 C ATOM 888 CG2 VAL A 111 2.394 -3.971 -9.898 1.00 0.00 C ATOM 0 H VAL A 111 5.050 -4.721 -10.556 1.00 0.00 H new ATOM 0 HA VAL A 111 3.348 -7.144 -10.708 1.00 0.00 H new ATOM 0 HB VAL A 111 1.807 -5.975 -9.465 1.00 0.00 H new ATOM 0 HG11 VAL A 111 3.039 -5.110 -7.509 1.00 0.00 H new ATOM 0 HG12 VAL A 111 3.746 -6.622 -8.128 1.00 0.00 H new ATOM 0 HG13 VAL A 111 4.531 -5.064 -8.478 1.00 0.00 H new ATOM 0 HG21 VAL A 111 1.883 -3.546 -9.034 1.00 0.00 H new ATOM 0 HG22 VAL A 111 3.309 -3.410 -10.090 1.00 0.00 H new ATOM 0 HG23 VAL A 111 1.743 -3.912 -10.770 1.00 0.00 H new ATOM 889 N PHE A 112 3.691 -5.683 -13.180 1.00 0.00 N ATOM 890 CA PHE A 112 3.248 -5.328 -14.518 1.00 0.00 C ATOM 891 C PHE A 112 3.717 -6.363 -15.543 1.00 0.00 C ATOM 892 O PHE A 112 4.914 -6.498 -15.791 1.00 0.00 O ATOM 893 CB PHE A 112 3.877 -3.974 -14.854 1.00 0.00 C ATOM 894 CG PHE A 112 2.884 -2.811 -14.860 1.00 0.00 C ATOM 895 CD1 PHE A 112 1.588 -3.024 -15.213 1.00 0.00 C ATOM 896 CD2 PHE A 112 3.296 -1.562 -14.513 1.00 0.00 C ATOM 897 CE1 PHE A 112 0.666 -1.946 -15.219 1.00 0.00 C ATOM 898 CE2 PHE A 112 2.374 -0.482 -14.518 1.00 0.00 C ATOM 899 CZ PHE A 112 1.079 -0.696 -14.872 1.00 0.00 C ATOM 0 H PHE A 112 4.677 -5.936 -13.110 1.00 0.00 H new ATOM 0 HA PHE A 112 2.159 -5.290 -14.551 1.00 0.00 H new ATOM 0 HB2 PHE A 112 4.665 -3.762 -14.131 1.00 0.00 H new ATOM 0 HB3 PHE A 112 4.351 -4.038 -15.833 1.00 0.00 H new ATOM 0 HD1 PHE A 112 1.260 -4.015 -15.489 1.00 0.00 H new ATOM 0 HD2 PHE A 112 4.325 -1.392 -14.233 1.00 0.00 H new ATOM 0 HE1 PHE A 112 -0.363 -2.117 -15.499 1.00 0.00 H new ATOM 0 HE2 PHE A 112 2.701 0.509 -14.241 1.00 0.00 H new ATOM 0 HZ PHE A 112 0.378 0.125 -14.878 1.00 0.00 H new ATOM 900 N ASN A 113 2.748 -7.067 -16.111 1.00 0.00 N ATOM 901 CA ASN A 113 3.046 -8.086 -17.104 1.00 0.00 C ATOM 902 C ASN A 113 3.926 -7.481 -18.200 1.00 0.00 C ATOM 903 O ASN A 113 4.994 -8.010 -18.505 1.00 0.00 O ATOM 904 CB ASN A 113 1.766 -8.607 -17.760 1.00 0.00 C ATOM 905 CG ASN A 113 0.570 -7.721 -17.408 1.00 0.00 C ATOM 906 OD1 ASN A 113 -0.105 -7.911 -16.410 1.00 0.00 O ATOM 907 ND2 ASN A 113 0.345 -6.743 -18.282 1.00 0.00 N ATOM 0 H ASN A 113 1.756 -6.952 -15.903 1.00 0.00 H new ATOM 0 HA ASN A 113 3.554 -8.909 -16.601 1.00 0.00 H new ATOM 0 HB2 ASN A 113 1.894 -8.638 -18.842 1.00 0.00 H new ATOM 0 HB3 ASN A 113 1.575 -9.629 -17.432 1.00 0.00 H new ATOM 0 HD21 ASN A 113 -0.431 -6.097 -18.136 1.00 0.00 H new ATOM 0 HD22 ASN A 113 0.949 -6.639 -19.098 1.00 0.00 H new ATOM 908 N LYS A 114 3.446 -6.381 -18.761 1.00 0.00 N ATOM 909 CA LYS A 114 4.176 -5.699 -19.816 1.00 0.00 C ATOM 910 C LYS A 114 4.256 -4.206 -19.492 1.00 0.00 C ATOM 911 O LYS A 114 5.269 -3.562 -19.759 1.00 0.00 O ATOM 912 CB LYS A 114 3.552 -6.001 -21.180 1.00 0.00 C ATOM 913 CG LYS A 114 4.630 -6.165 -22.253 1.00 0.00 C ATOM 914 CD LYS A 114 4.037 -6.015 -23.654 1.00 0.00 C ATOM 915 CE LYS A 114 5.140 -5.841 -24.701 1.00 0.00 C ATOM 916 NZ LYS A 114 4.900 -6.729 -25.860 1.00 0.00 N ATOM 0 H LYS A 114 2.560 -5.945 -18.505 1.00 0.00 H new ATOM 0 HA LYS A 114 5.200 -6.068 -19.871 1.00 0.00 H new ATOM 0 HB2 LYS A 114 2.955 -6.911 -21.117 1.00 0.00 H new ATOM 0 HB3 LYS A 114 2.875 -5.194 -21.460 1.00 0.00 H new ATOM 0 HG2 LYS A 114 5.412 -5.421 -22.104 1.00 0.00 H new ATOM 0 HG3 LYS A 114 5.099 -7.144 -22.156 1.00 0.00 H new ATOM 0 HD2 LYS A 114 3.437 -6.893 -23.895 1.00 0.00 H new ATOM 0 HD3 LYS A 114 3.368 -5.155 -23.679 1.00 0.00 H new ATOM 0 HE2 LYS A 114 5.175 -4.803 -25.032 1.00 0.00 H new ATOM 0 HE3 LYS A 114 6.110 -6.067 -24.257 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 5.658 -6.598 -26.560 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 4.890 -7.719 -25.542 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 3.984 -6.495 -26.293 1.00 0.00 H new ATOM 917 N LYS A 115 3.172 -3.698 -18.922 1.00 0.00 N ATOM 918 CA LYS A 115 3.107 -2.292 -18.559 1.00 0.00 C ATOM 919 C LYS A 115 2.961 -1.450 -19.828 1.00 0.00 C ATOM 920 O LYS A 115 3.957 -1.042 -20.425 1.00 0.00 O ATOM 921 CB LYS A 115 4.312 -1.904 -17.698 1.00 0.00 C ATOM 922 CG LYS A 115 4.509 -0.388 -17.684 1.00 0.00 C ATOM 923 CD LYS A 115 5.678 0.021 -18.582 1.00 0.00 C ATOM 924 CE LYS A 115 5.348 1.293 -19.366 1.00 0.00 C ATOM 925 NZ LYS A 115 6.392 2.320 -19.153 1.00 0.00 N ATOM 0 H LYS A 115 2.333 -4.235 -18.703 1.00 0.00 H new ATOM 0 HA LYS A 115 2.229 -2.097 -17.943 1.00 0.00 H new ATOM 0 HB2 LYS A 115 4.167 -2.265 -16.680 1.00 0.00 H new ATOM 0 HB3 LYS A 115 5.210 -2.388 -18.083 1.00 0.00 H new ATOM 0 HG2 LYS A 115 3.597 0.104 -18.022 1.00 0.00 H new ATOM 0 HG3 LYS A 115 4.694 -0.051 -16.664 1.00 0.00 H new ATOM 0 HD2 LYS A 115 6.568 0.185 -17.974 1.00 0.00 H new ATOM 0 HD3 LYS A 115 5.909 -0.788 -19.275 1.00 0.00 H new ATOM 0 HE2 LYS A 115 5.269 1.062 -20.428 1.00 0.00 H new ATOM 0 HE3 LYS A 115 4.379 1.680 -19.051 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 5.948 3.259 -19.093 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 6.900 2.120 -18.268 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 7.062 2.304 -19.948 1.00 0.00 H new ATOM 926 N ILE A 116 1.712 -1.211 -20.202 1.00 0.00 N ATOM 927 CA ILE A 116 1.423 -0.424 -21.388 1.00 0.00 C ATOM 928 C ILE A 116 2.090 0.947 -21.260 1.00 0.00 C ATOM 929 O ILE A 116 2.164 1.505 -20.166 1.00 0.00 O ATOM 930 CB ILE A 116 -0.086 -0.354 -21.630 1.00 0.00 C ATOM 931 CG1 ILE A 116 -0.555 -1.509 -22.516 1.00 0.00 C ATOM 932 CG2 ILE A 116 -0.487 1.007 -22.203 1.00 0.00 C ATOM 933 CD1 ILE A 116 -1.876 -1.171 -23.207 1.00 0.00 C ATOM 0 H ILE A 116 0.889 -1.549 -19.704 1.00 0.00 H new ATOM 0 HA ILE A 116 1.842 -0.901 -22.274 1.00 0.00 H new ATOM 0 HB ILE A 116 -0.590 -0.461 -20.670 1.00 0.00 H new ATOM 0 HG12 ILE A 116 0.205 -1.728 -23.266 1.00 0.00 H new ATOM 0 HG13 ILE A 116 -0.676 -2.408 -21.912 1.00 0.00 H new ATOM 0 HG21 ILE A 116 -1.565 1.030 -22.366 1.00 0.00 H new ATOM 0 HG22 ILE A 116 -0.209 1.793 -21.501 1.00 0.00 H new ATOM 0 HG23 ILE A 116 0.027 1.168 -23.151 1.00 0.00 H new ATOM 0 HD11 ILE A 116 -2.186 -2.010 -23.830 1.00 0.00 H new ATOM 0 HD12 ILE A 116 -2.641 -0.976 -22.455 1.00 0.00 H new ATOM 0 HD13 ILE A 116 -1.745 -0.286 -23.829 1.00 0.00 H new ATOM 934 N LYS A 117 2.559 1.449 -22.392 1.00 0.00 N ATOM 935 CA LYS A 117 3.218 2.744 -22.421 1.00 0.00 C ATOM 936 C LYS A 117 2.328 3.748 -23.157 1.00 0.00 C ATOM 937 O LYS A 117 1.653 4.563 -22.529 1.00 0.00 O ATOM 938 CB LYS A 117 4.623 2.619 -23.012 1.00 0.00 C ATOM 939 CG LYS A 117 5.610 3.528 -22.278 1.00 0.00 C ATOM 940 CD LYS A 117 6.013 4.718 -23.152 1.00 0.00 C ATOM 941 CE LYS A 117 7.108 4.324 -24.145 1.00 0.00 C ATOM 942 NZ LYS A 117 6.512 3.926 -25.441 1.00 0.00 N ATOM 0 H LYS A 117 2.496 0.982 -23.297 1.00 0.00 H new ATOM 0 HA LYS A 117 3.357 3.122 -21.408 1.00 0.00 H new ATOM 0 HB2 LYS A 117 4.958 1.584 -22.946 1.00 0.00 H new ATOM 0 HB3 LYS A 117 4.601 2.880 -24.070 1.00 0.00 H new ATOM 0 HG2 LYS A 117 5.160 3.888 -21.353 1.00 0.00 H new ATOM 0 HG3 LYS A 117 6.497 2.959 -22.001 1.00 0.00 H new ATOM 0 HD2 LYS A 117 5.142 5.087 -23.693 1.00 0.00 H new ATOM 0 HD3 LYS A 117 6.366 5.534 -22.521 1.00 0.00 H new ATOM 0 HE2 LYS A 117 7.791 5.160 -24.293 1.00 0.00 H new ATOM 0 HE3 LYS A 117 7.696 3.500 -23.740 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 7.188 4.117 -26.208 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 6.288 2.911 -25.423 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 5.641 4.470 -25.604 1.00 0.00 H new TER 943 LYS A 117