USER MOD reduce.3.24.130724 H: found=0, std=0, add=899, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 899 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 49 LYS NZ :NH3+ -168:sc=-0.000859 (180deg=-0.156) USER MOD Set 1.2: A 50 ASN : amide:sc= 0 X(o=-0.00086,f=-0.00086) USER MOD Set 2.1: A 18 THR OG1 : rot -89:sc= 1.18 USER MOD Set 2.2: A 21 SER OG : rot 103:sc= 0.932 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -169:sc= -0.263 (180deg=-0.602) USER MOD Single : A 6 LYS NZ :NH3+ 166:sc= -0.0502 (180deg=-0.287) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0.0572 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 TYR OH : rot 155:sc= 1.22 USER MOD Single : A 17 ASN : amide:sc= -0.14 K(o=-0.14,f=-1.2) USER MOD Single : A 20 ASN : amide:sc= -2.63! C(o=-2.6!,f=-7.9!) USER MOD Single : A 26 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0284) USER MOD Single : A 27 THR OG1 : rot 89:sc= 1.26 USER MOD Single : A 30 ASN : amide:sc= -0.079 X(o=-0.079,f=0) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 TYR OH : rot -165:sc= -0.797 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 GLN : amide:sc= 0.57 K(o=0.57,f=-6.5!) USER MOD Single : A 58 LYS NZ :NH3+ -135:sc= 0.852 (180deg=-0.0901) USER MOD Single : A 62 THR OG1 : rot 110:sc= 0 USER MOD Single : A 64 THR OG1 : rot -84:sc= -0.406! USER MOD Single : A 67 LYS NZ :NH3+ -108:sc= -0.28 (180deg=-1.83) USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 82 ASN : amide:sc= 0.101 K(o=0.1,f=-6.7!) USER MOD Single : A 85 LYS NZ :NH3+ 171:sc=-0.00404 (180deg=-0.0965) USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 LYS NZ :NH3+ -168:sc= -0.0244 (180deg=-0.173) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -16.607 -15.340 -19.463 1.00 0.00 N ATOM 2 CA MET A 1 -15.789 -15.778 -20.627 1.00 0.00 C ATOM 3 C MET A 1 -14.419 -15.113 -20.604 1.00 0.00 C ATOM 4 O MET A 1 -13.512 -15.504 -21.338 1.00 0.00 O ATOM 5 CB MET A 1 -16.508 -15.436 -21.935 1.00 0.00 C ATOM 6 CG MET A 1 -17.872 -16.095 -22.072 1.00 0.00 C ATOM 7 SD MET A 1 -18.721 -15.617 -23.590 1.00 0.00 S ATOM 8 CE MET A 1 -20.312 -16.405 -23.351 1.00 0.00 C ATOM 0 H1 MET A 1 -17.456 -15.937 -19.391 1.00 0.00 H new ATOM 0 H2 MET A 1 -16.046 -15.429 -18.592 1.00 0.00 H new ATOM 0 H3 MET A 1 -16.891 -14.348 -19.592 1.00 0.00 H new ATOM 0 HA MET A 1 -15.654 -16.858 -20.562 1.00 0.00 H new ATOM 0 HB2 MET A 1 -16.628 -14.355 -22.001 1.00 0.00 H new ATOM 0 HB3 MET A 1 -15.882 -15.739 -22.774 1.00 0.00 H new ATOM 0 HG2 MET A 1 -17.752 -17.178 -22.052 1.00 0.00 H new ATOM 0 HG3 MET A 1 -18.489 -15.827 -21.215 1.00 0.00 H new ATOM 0 HE1 MET A 1 -20.952 -16.201 -24.209 1.00 0.00 H new ATOM 0 HE2 MET A 1 -20.173 -17.481 -23.250 1.00 0.00 H new ATOM 0 HE3 MET A 1 -20.780 -16.013 -22.448 1.00 0.00 H new ATOM 20 N ALA A 2 -14.279 -14.103 -19.754 1.00 0.00 N ATOM 21 CA ALA A 2 -13.023 -13.375 -19.631 1.00 0.00 C ATOM 22 C ALA A 2 -12.318 -13.713 -18.320 1.00 0.00 C ATOM 23 O ALA A 2 -12.799 -13.353 -17.244 1.00 0.00 O ATOM 24 CB ALA A 2 -13.270 -11.876 -19.728 1.00 0.00 C ATOM 0 H ALA A 2 -15.021 -13.769 -19.139 1.00 0.00 H new ATOM 0 HA ALA A 2 -12.373 -13.679 -20.452 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -12.323 -11.344 -19.634 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -13.723 -11.644 -20.692 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -13.941 -11.565 -18.927 1.00 0.00 H new ATOM 30 N PRO A 3 -11.178 -14.429 -18.394 1.00 0.00 N ATOM 31 CA PRO A 3 -10.394 -14.811 -17.208 1.00 0.00 C ATOM 32 C PRO A 3 -9.908 -13.603 -16.414 1.00 0.00 C ATOM 33 O PRO A 3 -9.576 -12.563 -16.986 1.00 0.00 O ATOM 34 CB PRO A 3 -9.203 -15.576 -17.796 1.00 0.00 C ATOM 35 CG PRO A 3 -9.675 -16.038 -19.131 1.00 0.00 C ATOM 36 CD PRO A 3 -10.568 -14.942 -19.635 1.00 0.00 C ATOM 0 HA PRO A 3 -10.988 -15.393 -16.503 1.00 0.00 H new ATOM 0 HB2 PRO A 3 -8.326 -14.935 -17.886 1.00 0.00 H new ATOM 0 HB3 PRO A 3 -8.920 -16.417 -17.163 1.00 0.00 H new ATOM 0 HG2 PRO A 3 -8.837 -16.206 -19.808 1.00 0.00 H new ATOM 0 HG3 PRO A 3 -10.216 -16.981 -19.053 1.00 0.00 H new ATOM 0 HD2 PRO A 3 -10.006 -14.170 -20.160 1.00 0.00 H new ATOM 0 HD3 PRO A 3 -11.318 -15.318 -20.330 1.00 0.00 H new ATOM 44 N LEU A 4 -9.855 -13.751 -15.096 1.00 0.00 N ATOM 45 CA LEU A 4 -9.421 -12.666 -14.228 1.00 0.00 C ATOM 46 C LEU A 4 -8.021 -12.935 -13.688 1.00 0.00 C ATOM 47 O LEU A 4 -7.672 -14.075 -13.381 1.00 0.00 O ATOM 48 CB LEU A 4 -10.405 -12.487 -13.068 1.00 0.00 C ATOM 49 CG LEU A 4 -11.862 -12.263 -13.484 1.00 0.00 C ATOM 50 CD1 LEU A 4 -12.747 -12.092 -12.260 1.00 0.00 C ATOM 51 CD2 LEU A 4 -11.981 -11.062 -14.409 1.00 0.00 C ATOM 0 H LEU A 4 -10.107 -14.610 -14.607 1.00 0.00 H new ATOM 0 HA LEU A 4 -9.396 -11.748 -14.816 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -10.356 -13.370 -12.431 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -10.081 -11.640 -12.464 1.00 0.00 H new ATOM 0 HG LEU A 4 -12.201 -13.144 -14.030 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -13.778 -11.934 -12.576 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -12.690 -12.988 -11.642 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -12.408 -11.231 -11.683 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -13.024 -10.922 -14.691 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -11.621 -10.170 -13.896 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -11.382 -11.231 -15.304 1.00 0.00 H new ATOM 63 N ARG A 5 -7.225 -11.880 -13.577 1.00 0.00 N ATOM 64 CA ARG A 5 -5.859 -12.000 -13.082 1.00 0.00 C ATOM 65 C ARG A 5 -5.756 -11.478 -11.653 1.00 0.00 C ATOM 66 O ARG A 5 -6.589 -10.685 -11.213 1.00 0.00 O ATOM 67 CB ARG A 5 -4.891 -11.229 -13.988 1.00 0.00 C ATOM 68 CG ARG A 5 -4.462 -11.997 -15.229 1.00 0.00 C ATOM 69 CD ARG A 5 -5.477 -11.854 -16.353 1.00 0.00 C ATOM 70 NE ARG A 5 -5.450 -10.519 -16.947 1.00 0.00 N ATOM 71 CZ ARG A 5 -6.377 -10.062 -17.784 1.00 0.00 C ATOM 72 NH1 ARG A 5 -7.421 -10.820 -18.100 1.00 0.00 N ATOM 73 NH2 ARG A 5 -6.267 -8.845 -18.297 1.00 0.00 N ATOM 0 H ARG A 5 -7.502 -10.930 -13.823 1.00 0.00 H new ATOM 0 HA ARG A 5 -5.588 -13.056 -13.090 1.00 0.00 H new ATOM 0 HB2 ARG A 5 -5.363 -10.296 -14.296 1.00 0.00 H new ATOM 0 HB3 ARG A 5 -4.004 -10.964 -13.413 1.00 0.00 H new ATOM 0 HG2 ARG A 5 -3.491 -11.633 -15.566 1.00 0.00 H new ATOM 0 HG3 ARG A 5 -4.339 -13.051 -14.981 1.00 0.00 H new ATOM 0 HD2 ARG A 5 -5.273 -12.598 -17.123 1.00 0.00 H new ATOM 0 HD3 ARG A 5 -6.476 -12.060 -15.968 1.00 0.00 H new ATOM 0 HE ARG A 5 -4.675 -9.902 -16.706 1.00 0.00 H new ATOM 0 HH11 ARG A 5 -7.513 -11.754 -17.701 1.00 0.00 H new ATOM 0 HH12 ARG A 5 -8.131 -10.468 -18.742 1.00 0.00 H new ATOM 0 HH21 ARG A 5 -5.471 -8.258 -18.050 1.00 0.00 H new ATOM 0 HH22 ARG A 5 -6.979 -8.496 -18.939 1.00 0.00 H new ATOM 87 N LYS A 6 -4.738 -11.943 -10.931 1.00 0.00 N ATOM 88 CA LYS A 6 -4.513 -11.523 -9.547 1.00 0.00 C ATOM 89 C LYS A 6 -4.222 -10.031 -9.468 1.00 0.00 C ATOM 90 O LYS A 6 -4.659 -9.348 -8.543 1.00 0.00 O ATOM 91 CB LYS A 6 -3.358 -12.312 -8.925 1.00 0.00 C ATOM 92 CG LYS A 6 -3.665 -13.788 -8.709 1.00 0.00 C ATOM 93 CD LYS A 6 -4.686 -13.996 -7.601 1.00 0.00 C ATOM 94 CE LYS A 6 -4.949 -15.473 -7.357 1.00 0.00 C ATOM 95 NZ LYS A 6 -3.721 -16.191 -6.915 1.00 0.00 N ATOM 0 H LYS A 6 -4.053 -12.613 -11.282 1.00 0.00 H new ATOM 0 HA LYS A 6 -5.425 -11.728 -8.986 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -2.482 -12.223 -9.568 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -3.097 -11.861 -7.967 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -4.041 -14.220 -9.636 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -2.746 -14.318 -8.460 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -4.327 -13.532 -6.682 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -5.619 -13.498 -7.866 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -5.726 -15.583 -6.600 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -5.327 -15.930 -8.271 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -3.982 -17.123 -6.535 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -3.080 -16.314 -7.725 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -3.242 -15.637 -6.176 1.00 0.00 H new ATOM 109 N THR A 7 -3.469 -9.541 -10.438 1.00 0.00 N ATOM 110 CA THR A 7 -3.114 -8.133 -10.489 1.00 0.00 C ATOM 111 C THR A 7 -4.270 -7.291 -11.009 1.00 0.00 C ATOM 112 O THR A 7 -4.780 -7.517 -12.108 1.00 0.00 O ATOM 113 CB THR A 7 -1.886 -7.895 -11.388 1.00 0.00 C ATOM 114 OG1 THR A 7 -1.912 -8.803 -12.497 1.00 0.00 O ATOM 115 CG2 THR A 7 -0.588 -8.064 -10.615 1.00 0.00 C ATOM 0 H THR A 7 -3.091 -10.099 -11.203 1.00 0.00 H new ATOM 0 HA THR A 7 -2.877 -7.833 -9.468 1.00 0.00 H new ATOM 0 HB THR A 7 -1.930 -6.868 -11.752 1.00 0.00 H new ATOM 0 HG1 THR A 7 -1.130 -8.646 -13.066 1.00 0.00 H new ATOM 0 HG21 THR A 7 0.257 -7.889 -11.281 1.00 0.00 H new ATOM 0 HG22 THR A 7 -0.558 -7.348 -9.794 1.00 0.00 H new ATOM 0 HG23 THR A 7 -0.532 -9.077 -10.216 1.00 0.00 H new ATOM 123 N ALA A 8 -4.672 -6.317 -10.209 1.00 0.00 N ATOM 124 CA ALA A 8 -5.758 -5.422 -10.571 1.00 0.00 C ATOM 125 C ALA A 8 -5.246 -4.253 -11.395 1.00 0.00 C ATOM 126 O ALA A 8 -4.090 -3.847 -11.264 1.00 0.00 O ATOM 127 CB ALA A 8 -6.464 -4.922 -9.325 1.00 0.00 C ATOM 0 H ALA A 8 -4.258 -6.125 -9.297 1.00 0.00 H new ATOM 0 HA ALA A 8 -6.471 -5.979 -11.179 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -7.275 -4.252 -9.610 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -6.870 -5.769 -8.772 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -5.755 -4.385 -8.696 1.00 0.00 H new ATOM 133 N VAL A 9 -6.111 -3.708 -12.235 1.00 0.00 N ATOM 134 CA VAL A 9 -5.740 -2.589 -13.080 1.00 0.00 C ATOM 135 C VAL A 9 -6.486 -1.332 -12.651 1.00 0.00 C ATOM 136 O VAL A 9 -7.719 -1.311 -12.593 1.00 0.00 O ATOM 137 CB VAL A 9 -6.036 -2.876 -14.569 1.00 0.00 C ATOM 138 CG1 VAL A 9 -5.640 -1.686 -15.444 1.00 0.00 C ATOM 139 CG2 VAL A 9 -5.312 -4.135 -15.024 1.00 0.00 C ATOM 0 H VAL A 9 -7.074 -4.024 -12.349 1.00 0.00 H new ATOM 0 HA VAL A 9 -4.667 -2.438 -12.966 1.00 0.00 H new ATOM 0 HB VAL A 9 -7.109 -3.034 -14.676 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -5.858 -1.913 -16.487 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -6.205 -0.806 -15.138 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -4.574 -1.490 -15.331 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -5.532 -4.322 -16.075 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -4.238 -4.003 -14.896 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -5.647 -4.983 -14.427 1.00 0.00 H new ATOM 149 N LEU A 10 -5.729 -0.292 -12.363 1.00 0.00 N ATOM 150 CA LEU A 10 -6.298 0.979 -11.945 1.00 0.00 C ATOM 151 C LEU A 10 -6.024 2.010 -13.023 1.00 0.00 C ATOM 152 O LEU A 10 -4.895 2.124 -13.497 1.00 0.00 O ATOM 153 CB LEU A 10 -5.683 1.432 -10.614 1.00 0.00 C ATOM 154 CG LEU A 10 -6.599 1.364 -9.379 1.00 0.00 C ATOM 155 CD1 LEU A 10 -7.677 2.437 -9.436 1.00 0.00 C ATOM 156 CD2 LEU A 10 -7.225 -0.014 -9.248 1.00 0.00 C ATOM 0 H LEU A 10 -4.710 -0.301 -12.411 1.00 0.00 H new ATOM 0 HA LEU A 10 -7.373 0.868 -11.800 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -4.801 0.821 -10.420 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -5.340 2.460 -10.729 1.00 0.00 H new ATOM 0 HG LEU A 10 -5.985 1.549 -8.498 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -8.309 2.365 -8.551 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -7.209 3.421 -9.469 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -8.285 2.294 -10.329 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -7.868 -0.039 -8.368 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -7.817 -0.231 -10.137 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -6.439 -0.762 -9.144 1.00 0.00 H new ATOM 168 N LYS A 11 -7.038 2.771 -13.410 1.00 0.00 N ATOM 169 CA LYS A 11 -6.851 3.778 -14.441 1.00 0.00 C ATOM 170 C LYS A 11 -7.072 5.165 -13.869 1.00 0.00 C ATOM 171 O LYS A 11 -8.081 5.430 -13.211 1.00 0.00 O ATOM 172 CB LYS A 11 -7.792 3.562 -15.634 1.00 0.00 C ATOM 173 CG LYS A 11 -7.455 2.349 -16.484 1.00 0.00 C ATOM 174 CD LYS A 11 -8.405 2.225 -17.665 1.00 0.00 C ATOM 175 CE LYS A 11 -8.040 1.048 -18.553 1.00 0.00 C ATOM 176 NZ LYS A 11 -8.971 0.912 -19.708 1.00 0.00 N ATOM 0 H LYS A 11 -7.984 2.712 -13.032 1.00 0.00 H new ATOM 0 HA LYS A 11 -5.825 3.684 -14.798 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -8.812 3.459 -15.263 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -7.770 4.451 -16.265 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -6.430 2.428 -16.845 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -7.509 1.447 -15.874 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -9.425 2.105 -17.301 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -8.382 3.144 -18.250 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -7.022 1.173 -18.921 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -8.056 0.131 -17.964 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -8.687 0.097 -20.289 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -9.940 0.767 -19.358 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -8.937 1.777 -20.285 1.00 0.00 H new ATOM 190 N LEU A 12 -6.114 6.042 -14.111 1.00 0.00 N ATOM 191 CA LEU A 12 -6.205 7.408 -13.643 1.00 0.00 C ATOM 192 C LEU A 12 -6.455 8.325 -14.824 1.00 0.00 C ATOM 193 O LEU A 12 -5.682 8.325 -15.784 1.00 0.00 O ATOM 194 CB LEU A 12 -4.917 7.824 -12.929 1.00 0.00 C ATOM 195 CG LEU A 12 -5.102 8.412 -11.527 1.00 0.00 C ATOM 196 CD1 LEU A 12 -3.752 8.730 -10.905 1.00 0.00 C ATOM 197 CD2 LEU A 12 -5.970 9.661 -11.573 1.00 0.00 C ATOM 0 H LEU A 12 -5.263 5.829 -14.631 1.00 0.00 H new ATOM 0 HA LEU A 12 -7.030 7.483 -12.934 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -4.265 6.954 -12.856 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -4.400 8.558 -13.547 1.00 0.00 H new ATOM 0 HG LEU A 12 -5.607 7.669 -10.910 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -3.900 9.147 -9.909 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -3.161 7.817 -10.832 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -3.226 9.454 -11.527 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -6.087 10.060 -10.565 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -5.496 10.410 -12.207 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -6.950 9.409 -11.979 1.00 0.00 H new ATOM 209 N TYR A 13 -7.519 9.100 -14.773 1.00 0.00 N ATOM 210 CA TYR A 13 -7.834 10.013 -15.850 1.00 0.00 C ATOM 211 C TYR A 13 -7.389 11.406 -15.439 1.00 0.00 C ATOM 212 O TYR A 13 -7.861 11.942 -14.440 1.00 0.00 O ATOM 213 CB TYR A 13 -9.340 9.990 -16.116 1.00 0.00 C ATOM 214 CG TYR A 13 -9.855 8.631 -16.547 1.00 0.00 C ATOM 215 CD1 TYR A 13 -10.264 7.691 -15.608 1.00 0.00 C ATOM 216 CD2 TYR A 13 -9.935 8.289 -17.891 1.00 0.00 C ATOM 217 CE1 TYR A 13 -10.733 6.451 -15.994 1.00 0.00 C ATOM 218 CE2 TYR A 13 -10.406 7.049 -18.285 1.00 0.00 C ATOM 219 CZ TYR A 13 -10.804 6.135 -17.332 1.00 0.00 C ATOM 220 OH TYR A 13 -11.270 4.899 -17.718 1.00 0.00 O ATOM 0 H TYR A 13 -8.180 9.115 -13.996 1.00 0.00 H new ATOM 0 HA TYR A 13 -7.319 9.719 -16.764 1.00 0.00 H new ATOM 0 HB2 TYR A 13 -9.866 10.300 -15.213 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -9.576 10.722 -16.889 1.00 0.00 H new ATOM 0 HD1 TYR A 13 -10.214 7.935 -14.557 1.00 0.00 H new ATOM 0 HD2 TYR A 13 -9.625 9.002 -18.640 1.00 0.00 H new ATOM 0 HE1 TYR A 13 -11.043 5.732 -15.250 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -10.462 6.798 -19.334 1.00 0.00 H new ATOM 0 HH TYR A 13 -11.633 4.955 -18.626 1.00 0.00 H new ATOM 230 N VAL A 14 -6.482 11.989 -16.201 1.00 0.00 N ATOM 231 CA VAL A 14 -5.958 13.306 -15.875 1.00 0.00 C ATOM 232 C VAL A 14 -6.088 14.265 -17.044 1.00 0.00 C ATOM 233 O VAL A 14 -6.251 13.847 -18.191 1.00 0.00 O ATOM 234 CB VAL A 14 -4.474 13.230 -15.446 1.00 0.00 C ATOM 235 CG1 VAL A 14 -4.337 12.487 -14.120 1.00 0.00 C ATOM 236 CG2 VAL A 14 -3.628 12.565 -16.523 1.00 0.00 C ATOM 0 H VAL A 14 -6.093 11.574 -17.048 1.00 0.00 H new ATOM 0 HA VAL A 14 -6.554 13.681 -15.043 1.00 0.00 H new ATOM 0 HB VAL A 14 -4.108 14.248 -15.311 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -3.286 12.443 -13.834 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -4.901 13.012 -13.349 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -4.726 11.474 -14.228 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -2.589 12.524 -16.196 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -3.993 11.553 -16.699 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -3.696 13.141 -17.446 1.00 0.00 H new ATOM 246 N ALA A 15 -6.010 15.553 -16.750 1.00 0.00 N ATOM 247 CA ALA A 15 -6.117 16.566 -17.781 1.00 0.00 C ATOM 248 C ALA A 15 -4.815 17.350 -17.874 1.00 0.00 C ATOM 249 O ALA A 15 -4.536 18.212 -17.036 1.00 0.00 O ATOM 250 CB ALA A 15 -7.289 17.499 -17.511 1.00 0.00 C ATOM 0 H ALA A 15 -5.873 15.918 -15.808 1.00 0.00 H new ATOM 0 HA ALA A 15 -6.300 16.072 -18.735 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -7.346 18.249 -18.300 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -8.215 16.924 -17.490 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -7.147 17.993 -16.550 1.00 0.00 H new ATOM 256 N GLY A 16 -4.025 17.046 -18.904 1.00 0.00 N ATOM 257 CA GLY A 16 -2.753 17.718 -19.103 1.00 0.00 C ATOM 258 C GLY A 16 -1.794 17.507 -17.951 1.00 0.00 C ATOM 259 O GLY A 16 -1.592 16.379 -17.500 1.00 0.00 O ATOM 0 H GLY A 16 -4.247 16.341 -19.607 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -2.295 17.355 -20.023 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -2.928 18.786 -19.234 1.00 0.00 H new ATOM 263 N ASN A 17 -1.204 18.593 -17.469 1.00 0.00 N ATOM 264 CA ASN A 17 -0.262 18.519 -16.362 1.00 0.00 C ATOM 265 C ASN A 17 -0.622 19.543 -15.298 1.00 0.00 C ATOM 266 O ASN A 17 0.215 20.330 -14.856 1.00 0.00 O ATOM 267 CB ASN A 17 1.168 18.748 -16.860 1.00 0.00 C ATOM 268 CG ASN A 17 2.201 18.009 -16.033 1.00 0.00 C ATOM 269 OD1 ASN A 17 2.000 16.856 -15.658 1.00 0.00 O ATOM 270 ND2 ASN A 17 3.315 18.669 -15.745 1.00 0.00 N ATOM 0 H ASN A 17 -1.362 19.535 -17.828 1.00 0.00 H new ATOM 0 HA ASN A 17 -0.319 17.523 -15.922 1.00 0.00 H new ATOM 0 HB2 ASN A 17 1.242 18.426 -17.899 1.00 0.00 H new ATOM 0 HB3 ASN A 17 1.389 19.815 -16.840 1.00 0.00 H new ATOM 0 HD21 ASN A 17 4.045 18.220 -15.192 1.00 0.00 H new ATOM 0 HD22 ASN A 17 3.441 19.625 -16.076 1.00 0.00 H new ATOM 277 N THR A 18 -1.889 19.533 -14.912 1.00 0.00 N ATOM 278 CA THR A 18 -2.391 20.434 -13.888 1.00 0.00 C ATOM 279 C THR A 18 -1.885 19.992 -12.521 1.00 0.00 C ATOM 280 O THR A 18 -1.592 18.814 -12.321 1.00 0.00 O ATOM 281 CB THR A 18 -3.932 20.470 -13.903 1.00 0.00 C ATOM 282 OG1 THR A 18 -4.452 19.154 -14.142 1.00 0.00 O ATOM 283 CG2 THR A 18 -4.442 21.423 -14.974 1.00 0.00 C ATOM 0 H THR A 18 -2.593 18.904 -15.297 1.00 0.00 H new ATOM 0 HA THR A 18 -2.026 21.440 -14.096 1.00 0.00 H new ATOM 0 HB THR A 18 -4.273 20.825 -12.931 1.00 0.00 H new ATOM 0 HG1 THR A 18 -4.550 19.011 -15.107 1.00 0.00 H new ATOM 0 HG21 THR A 18 -5.532 21.431 -14.965 1.00 0.00 H new ATOM 0 HG22 THR A 18 -4.070 22.428 -14.774 1.00 0.00 H new ATOM 0 HG23 THR A 18 -4.090 21.094 -15.952 1.00 0.00 H new ATOM 291 N PRO A 19 -1.775 20.925 -11.561 1.00 0.00 N ATOM 292 CA PRO A 19 -1.279 20.614 -10.212 1.00 0.00 C ATOM 293 C PRO A 19 -2.100 19.537 -9.518 1.00 0.00 C ATOM 294 O PRO A 19 -1.566 18.750 -8.746 1.00 0.00 O ATOM 295 CB PRO A 19 -1.402 21.948 -9.465 1.00 0.00 C ATOM 296 CG PRO A 19 -2.320 22.783 -10.301 1.00 0.00 C ATOM 297 CD PRO A 19 -2.088 22.352 -11.714 1.00 0.00 C ATOM 0 HA PRO A 19 -0.264 20.218 -10.239 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -1.805 21.802 -8.463 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -0.429 22.426 -9.351 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -3.360 22.631 -10.011 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -2.106 23.844 -10.176 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -2.968 22.510 -12.337 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -1.268 22.901 -12.177 1.00 0.00 H new ATOM 305 N ASN A 20 -3.392 19.503 -9.806 1.00 0.00 N ATOM 306 CA ASN A 20 -4.267 18.492 -9.233 1.00 0.00 C ATOM 307 C ASN A 20 -3.940 17.128 -9.833 1.00 0.00 C ATOM 308 O ASN A 20 -3.871 16.129 -9.120 1.00 0.00 O ATOM 309 CB ASN A 20 -5.746 18.855 -9.463 1.00 0.00 C ATOM 310 CG ASN A 20 -6.034 19.355 -10.868 1.00 0.00 C ATOM 311 OD1 ASN A 20 -5.470 20.356 -11.310 1.00 0.00 O ATOM 312 ND2 ASN A 20 -6.924 18.671 -11.576 1.00 0.00 N ATOM 0 H ASN A 20 -3.857 20.162 -10.431 1.00 0.00 H new ATOM 0 HA ASN A 20 -4.101 18.450 -8.157 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -6.363 17.978 -9.264 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -6.040 19.621 -8.746 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -7.162 18.970 -12.522 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -7.370 17.846 -11.174 1.00 0.00 H new ATOM 319 N SER A 21 -3.736 17.099 -11.155 1.00 0.00 N ATOM 320 CA SER A 21 -3.383 15.870 -11.858 1.00 0.00 C ATOM 321 C SER A 21 -1.989 15.404 -11.461 1.00 0.00 C ATOM 322 O SER A 21 -1.776 14.217 -11.235 1.00 0.00 O ATOM 323 CB SER A 21 -3.445 16.086 -13.370 1.00 0.00 C ATOM 324 OG SER A 21 -4.769 16.374 -13.795 1.00 0.00 O ATOM 0 H SER A 21 -3.811 17.919 -11.758 1.00 0.00 H new ATOM 0 HA SER A 21 -4.102 15.100 -11.578 1.00 0.00 H new ATOM 0 HB2 SER A 21 -2.784 16.906 -13.650 1.00 0.00 H new ATOM 0 HB3 SER A 21 -3.082 15.195 -13.882 1.00 0.00 H new ATOM 0 HG SER A 21 -4.855 17.335 -13.969 1.00 0.00 H new ATOM 330 N VAL A 22 -1.048 16.338 -11.370 1.00 0.00 N ATOM 331 CA VAL A 22 0.320 16.002 -10.986 1.00 0.00 C ATOM 332 C VAL A 22 0.367 15.486 -9.550 1.00 0.00 C ATOM 333 O VAL A 22 1.003 14.469 -9.264 1.00 0.00 O ATOM 334 CB VAL A 22 1.265 17.216 -11.135 1.00 0.00 C ATOM 335 CG1 VAL A 22 2.623 16.938 -10.511 1.00 0.00 C ATOM 336 CG2 VAL A 22 1.414 17.604 -12.596 1.00 0.00 C ATOM 0 H VAL A 22 -1.205 17.329 -11.556 1.00 0.00 H new ATOM 0 HA VAL A 22 0.662 15.216 -11.660 1.00 0.00 H new ATOM 0 HB VAL A 22 0.818 18.054 -10.600 1.00 0.00 H new ATOM 0 HG11 VAL A 22 3.265 17.811 -10.632 1.00 0.00 H new ATOM 0 HG12 VAL A 22 2.499 16.724 -9.450 1.00 0.00 H new ATOM 0 HG13 VAL A 22 3.081 16.080 -11.003 1.00 0.00 H new ATOM 0 HG21 VAL A 22 2.083 18.460 -12.679 1.00 0.00 H new ATOM 0 HG22 VAL A 22 1.828 16.765 -13.155 1.00 0.00 H new ATOM 0 HG23 VAL A 22 0.438 17.866 -13.004 1.00 0.00 H new ATOM 346 N ARG A 23 -0.325 16.188 -8.659 1.00 0.00 N ATOM 347 CA ARG A 23 -0.371 15.819 -7.251 1.00 0.00 C ATOM 348 C ARG A 23 -1.009 14.450 -7.084 1.00 0.00 C ATOM 349 O ARG A 23 -0.494 13.593 -6.363 1.00 0.00 O ATOM 350 CB ARG A 23 -1.185 16.863 -6.493 1.00 0.00 C ATOM 351 CG ARG A 23 -1.078 16.779 -4.986 1.00 0.00 C ATOM 352 CD ARG A 23 -1.589 18.053 -4.331 1.00 0.00 C ATOM 353 NE ARG A 23 -1.518 17.991 -2.873 1.00 0.00 N ATOM 354 CZ ARG A 23 -1.765 19.029 -2.078 1.00 0.00 C ATOM 355 NH1 ARG A 23 -2.099 20.202 -2.601 1.00 0.00 N ATOM 356 NH2 ARG A 23 -1.678 18.893 -0.762 1.00 0.00 N ATOM 0 H ARG A 23 -0.865 17.022 -8.891 1.00 0.00 H new ATOM 0 HA ARG A 23 0.644 15.778 -6.855 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -0.864 17.855 -6.811 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -2.233 16.761 -6.775 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -1.651 15.925 -4.624 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -0.040 16.610 -4.700 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -1.004 18.902 -4.686 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -2.621 18.227 -4.636 1.00 0.00 H new ATOM 0 HE ARG A 23 -1.265 17.103 -2.440 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -2.167 20.308 -3.613 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -2.288 20.997 -1.991 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -1.422 17.992 -0.358 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -1.868 19.689 -0.153 1.00 0.00 H new ATOM 370 N ALA A 24 -2.136 14.257 -7.763 1.00 0.00 N ATOM 371 CA ALA A 24 -2.856 12.993 -7.697 1.00 0.00 C ATOM 372 C ALA A 24 -2.033 11.846 -8.289 1.00 0.00 C ATOM 373 O ALA A 24 -1.977 10.751 -7.728 1.00 0.00 O ATOM 374 CB ALA A 24 -4.190 13.101 -8.413 1.00 0.00 C ATOM 0 H ALA A 24 -2.568 14.959 -8.363 1.00 0.00 H new ATOM 0 HA ALA A 24 -3.034 12.772 -6.645 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -4.713 12.147 -8.353 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -4.794 13.877 -7.942 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -4.022 13.357 -9.459 1.00 0.00 H new ATOM 380 N LEU A 25 -1.399 12.120 -9.431 1.00 0.00 N ATOM 381 CA LEU A 25 -0.574 11.132 -10.128 1.00 0.00 C ATOM 382 C LEU A 25 0.607 10.686 -9.271 1.00 0.00 C ATOM 383 O LEU A 25 0.882 9.489 -9.166 1.00 0.00 O ATOM 384 CB LEU A 25 -0.078 11.707 -11.462 1.00 0.00 C ATOM 385 CG LEU A 25 0.822 10.787 -12.288 1.00 0.00 C ATOM 386 CD1 LEU A 25 0.087 9.508 -12.665 1.00 0.00 C ATOM 387 CD2 LEU A 25 1.311 11.507 -13.536 1.00 0.00 C ATOM 0 H LEU A 25 -1.442 13.027 -9.896 1.00 0.00 H new ATOM 0 HA LEU A 25 -1.192 10.255 -10.323 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -0.945 11.974 -12.066 1.00 0.00 H new ATOM 0 HB3 LEU A 25 0.466 12.630 -11.259 1.00 0.00 H new ATOM 0 HG LEU A 25 1.686 10.517 -11.680 1.00 0.00 H new ATOM 0 HD11 LEU A 25 0.747 8.869 -13.252 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -0.216 8.982 -11.760 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -0.796 9.756 -13.254 1.00 0.00 H new ATOM 0 HD21 LEU A 25 1.950 10.840 -14.114 1.00 0.00 H new ATOM 0 HD22 LEU A 25 0.456 11.806 -14.142 1.00 0.00 H new ATOM 0 HD23 LEU A 25 1.878 12.392 -13.247 1.00 0.00 H new ATOM 399 N LYS A 26 1.299 11.644 -8.659 1.00 0.00 N ATOM 400 CA LYS A 26 2.441 11.328 -7.805 1.00 0.00 C ATOM 401 C LYS A 26 1.997 10.502 -6.601 1.00 0.00 C ATOM 402 O LYS A 26 2.671 9.549 -6.209 1.00 0.00 O ATOM 403 CB LYS A 26 3.139 12.609 -7.336 1.00 0.00 C ATOM 404 CG LYS A 26 4.402 12.943 -8.120 1.00 0.00 C ATOM 405 CD LYS A 26 4.110 13.189 -9.592 1.00 0.00 C ATOM 406 CE LYS A 26 5.130 14.131 -10.213 1.00 0.00 C ATOM 407 NZ LYS A 26 6.514 13.588 -10.125 1.00 0.00 N ATOM 0 H LYS A 26 1.091 12.639 -8.738 1.00 0.00 H new ATOM 0 HA LYS A 26 3.149 10.742 -8.390 1.00 0.00 H new ATOM 0 HB2 LYS A 26 2.441 13.442 -7.417 1.00 0.00 H new ATOM 0 HB3 LYS A 26 3.394 12.508 -6.281 1.00 0.00 H new ATOM 0 HG2 LYS A 26 4.872 13.828 -7.691 1.00 0.00 H new ATOM 0 HG3 LYS A 26 5.116 12.125 -8.024 1.00 0.00 H new ATOM 0 HD2 LYS A 26 4.116 12.240 -10.129 1.00 0.00 H new ATOM 0 HD3 LYS A 26 3.111 13.611 -9.700 1.00 0.00 H new ATOM 0 HE2 LYS A 26 4.874 14.305 -11.258 1.00 0.00 H new ATOM 0 HE3 LYS A 26 5.086 15.097 -9.709 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 7.162 14.200 -10.661 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 6.812 13.557 -9.129 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 6.536 12.627 -10.523 1.00 0.00 H new ATOM 421 N THR A 27 0.857 10.876 -6.028 1.00 0.00 N ATOM 422 CA THR A 27 0.298 10.180 -4.876 1.00 0.00 C ATOM 423 C THR A 27 -0.079 8.740 -5.231 1.00 0.00 C ATOM 424 O THR A 27 0.249 7.807 -4.500 1.00 0.00 O ATOM 425 CB THR A 27 -0.944 10.932 -4.355 1.00 0.00 C ATOM 426 OG1 THR A 27 -0.579 12.266 -3.983 1.00 0.00 O ATOM 427 CG2 THR A 27 -1.553 10.234 -3.154 1.00 0.00 C ATOM 0 H THR A 27 0.298 11.667 -6.348 1.00 0.00 H new ATOM 0 HA THR A 27 1.059 10.153 -4.096 1.00 0.00 H new ATOM 0 HB THR A 27 -1.683 10.950 -5.156 1.00 0.00 H new ATOM 0 HG1 THR A 27 -0.661 12.856 -4.761 1.00 0.00 H new ATOM 0 HG21 THR A 27 -2.426 10.791 -2.813 1.00 0.00 H new ATOM 0 HG22 THR A 27 -1.854 9.224 -3.434 1.00 0.00 H new ATOM 0 HG23 THR A 27 -0.818 10.184 -2.351 1.00 0.00 H new ATOM 435 N LEU A 28 -0.744 8.563 -6.371 1.00 0.00 N ATOM 436 CA LEU A 28 -1.172 7.235 -6.812 1.00 0.00 C ATOM 437 C LEU A 28 0.011 6.351 -7.202 1.00 0.00 C ATOM 438 O LEU A 28 0.121 5.215 -6.738 1.00 0.00 O ATOM 439 CB LEU A 28 -2.121 7.351 -8.013 1.00 0.00 C ATOM 440 CG LEU A 28 -3.576 6.925 -7.767 1.00 0.00 C ATOM 441 CD1 LEU A 28 -3.638 5.569 -7.080 1.00 0.00 C ATOM 442 CD2 LEU A 28 -4.313 7.978 -6.954 1.00 0.00 C ATOM 0 H LEU A 28 -0.998 9.320 -7.006 1.00 0.00 H new ATOM 0 HA LEU A 28 -1.686 6.772 -5.969 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -2.119 8.387 -8.353 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -1.720 6.748 -8.827 1.00 0.00 H new ATOM 0 HG LEU A 28 -4.070 6.833 -8.734 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -4.679 5.291 -6.917 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -3.156 4.820 -7.709 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -3.123 5.623 -6.121 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -5.342 7.657 -6.791 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -3.817 8.109 -5.992 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -4.310 8.924 -7.495 1.00 0.00 H new ATOM 454 N ALA A 29 0.895 6.879 -8.049 1.00 0.00 N ATOM 455 CA ALA A 29 2.045 6.121 -8.536 1.00 0.00 C ATOM 456 C ALA A 29 3.001 5.692 -7.429 1.00 0.00 C ATOM 457 O ALA A 29 3.435 4.547 -7.407 1.00 0.00 O ATOM 458 CB ALA A 29 2.797 6.929 -9.584 1.00 0.00 C ATOM 0 H ALA A 29 0.835 7.830 -8.412 1.00 0.00 H new ATOM 0 HA ALA A 29 1.648 5.207 -8.977 1.00 0.00 H new ATOM 0 HB1 ALA A 29 3.652 6.355 -9.941 1.00 0.00 H new ATOM 0 HB2 ALA A 29 2.133 7.148 -10.420 1.00 0.00 H new ATOM 0 HB3 ALA A 29 3.145 7.863 -9.143 1.00 0.00 H new ATOM 464 N ASN A 30 3.313 6.587 -6.497 1.00 0.00 N ATOM 465 CA ASN A 30 4.245 6.251 -5.418 1.00 0.00 C ATOM 466 C ASN A 30 3.652 5.201 -4.483 1.00 0.00 C ATOM 467 O ASN A 30 4.356 4.289 -4.050 1.00 0.00 O ATOM 468 CB ASN A 30 4.646 7.500 -4.629 1.00 0.00 C ATOM 469 CG ASN A 30 6.073 7.440 -4.111 1.00 0.00 C ATOM 470 OD1 ASN A 30 6.802 8.427 -4.162 1.00 0.00 O ATOM 471 ND2 ASN A 30 6.481 6.280 -3.607 1.00 0.00 N ATOM 0 H ASN A 30 2.943 7.537 -6.463 1.00 0.00 H new ATOM 0 HA ASN A 30 5.140 5.832 -5.877 1.00 0.00 H new ATOM 0 HB2 ASN A 30 4.533 8.378 -5.266 1.00 0.00 H new ATOM 0 HB3 ASN A 30 3.965 7.626 -3.788 1.00 0.00 H new ATOM 0 HD21 ASN A 30 7.430 6.187 -3.245 1.00 0.00 H new ATOM 0 HD22 ASN A 30 5.845 5.483 -3.582 1.00 0.00 H new ATOM 478 N ILE A 31 2.375 5.336 -4.162 1.00 0.00 N ATOM 479 CA ILE A 31 1.714 4.371 -3.302 1.00 0.00 C ATOM 480 C ILE A 31 1.664 2.995 -3.968 1.00 0.00 C ATOM 481 O ILE A 31 1.940 1.979 -3.339 1.00 0.00 O ATOM 482 CB ILE A 31 0.317 4.859 -2.879 1.00 0.00 C ATOM 483 CG1 ILE A 31 0.489 6.006 -1.887 1.00 0.00 C ATOM 484 CG2 ILE A 31 -0.523 3.739 -2.282 1.00 0.00 C ATOM 485 CD1 ILE A 31 -0.790 6.728 -1.565 1.00 0.00 C ATOM 0 H ILE A 31 1.780 6.100 -4.482 1.00 0.00 H new ATOM 0 HA ILE A 31 2.302 4.271 -2.390 1.00 0.00 H new ATOM 0 HB ILE A 31 -0.222 5.205 -3.761 1.00 0.00 H new ATOM 0 HG12 ILE A 31 0.916 5.614 -0.964 1.00 0.00 H new ATOM 0 HG13 ILE A 31 1.206 6.720 -2.292 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -1.500 4.129 -1.998 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -0.649 2.946 -3.019 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -0.022 3.339 -1.401 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -0.587 7.529 -0.854 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -1.209 7.151 -2.478 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -1.503 6.028 -1.129 1.00 0.00 H new ATOM 497 N LEU A 32 1.326 2.972 -5.249 1.00 0.00 N ATOM 498 CA LEU A 32 1.255 1.722 -5.999 1.00 0.00 C ATOM 499 C LEU A 32 2.639 1.115 -6.274 1.00 0.00 C ATOM 500 O LEU A 32 2.756 -0.093 -6.454 1.00 0.00 O ATOM 501 CB LEU A 32 0.479 1.927 -7.300 1.00 0.00 C ATOM 502 CG LEU A 32 -1.029 2.133 -7.116 1.00 0.00 C ATOM 503 CD1 LEU A 32 -1.672 2.590 -8.416 1.00 0.00 C ATOM 504 CD2 LEU A 32 -1.675 0.848 -6.629 1.00 0.00 C ATOM 0 H LEU A 32 1.096 3.804 -5.793 1.00 0.00 H new ATOM 0 HA LEU A 32 0.722 1.004 -5.376 1.00 0.00 H new ATOM 0 HB2 LEU A 32 0.890 2.792 -7.821 1.00 0.00 H new ATOM 0 HB3 LEU A 32 0.639 1.062 -7.944 1.00 0.00 H new ATOM 0 HG LEU A 32 -1.184 2.911 -6.368 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -2.742 2.730 -8.263 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -1.224 3.532 -8.732 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -1.511 1.836 -9.186 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -2.746 1.005 -6.501 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -1.509 0.057 -7.360 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -1.235 0.558 -5.675 1.00 0.00 H new ATOM 516 N GLU A 33 3.682 1.947 -6.330 1.00 0.00 N ATOM 517 CA GLU A 33 5.041 1.452 -6.589 1.00 0.00 C ATOM 518 C GLU A 33 5.774 1.075 -5.302 1.00 0.00 C ATOM 519 O GLU A 33 6.907 0.603 -5.350 1.00 0.00 O ATOM 520 CB GLU A 33 5.875 2.488 -7.349 1.00 0.00 C ATOM 521 CG GLU A 33 5.347 2.809 -8.737 1.00 0.00 C ATOM 522 CD GLU A 33 6.219 3.801 -9.483 1.00 0.00 C ATOM 523 OE1 GLU A 33 7.190 4.311 -8.884 1.00 0.00 O ATOM 524 OE2 GLU A 33 5.931 4.068 -10.669 1.00 0.00 O ATOM 0 H GLU A 33 3.616 2.957 -6.201 1.00 0.00 H new ATOM 0 HA GLU A 33 4.925 0.556 -7.199 1.00 0.00 H new ATOM 0 HB2 GLU A 33 5.914 3.407 -6.765 1.00 0.00 H new ATOM 0 HB3 GLU A 33 6.898 2.122 -7.436 1.00 0.00 H new ATOM 0 HG2 GLU A 33 5.276 1.888 -9.316 1.00 0.00 H new ATOM 0 HG3 GLU A 33 4.337 3.211 -8.653 1.00 0.00 H new ATOM 531 N LYS A 34 5.148 1.301 -4.156 1.00 0.00 N ATOM 532 CA LYS A 34 5.776 0.966 -2.884 1.00 0.00 C ATOM 533 C LYS A 34 4.830 0.155 -2.001 1.00 0.00 C ATOM 534 O LYS A 34 5.114 -0.990 -1.655 1.00 0.00 O ATOM 535 CB LYS A 34 6.217 2.244 -2.160 1.00 0.00 C ATOM 536 CG LYS A 34 6.897 1.996 -0.821 1.00 0.00 C ATOM 537 CD LYS A 34 8.218 1.261 -0.990 1.00 0.00 C ATOM 538 CE LYS A 34 8.931 1.094 0.340 1.00 0.00 C ATOM 539 NZ LYS A 34 10.226 0.375 0.192 1.00 0.00 N ATOM 0 H LYS A 34 4.217 1.710 -4.079 1.00 0.00 H new ATOM 0 HA LYS A 34 6.654 0.353 -3.088 1.00 0.00 H new ATOM 0 HB2 LYS A 34 6.900 2.797 -2.805 1.00 0.00 H new ATOM 0 HB3 LYS A 34 5.345 2.878 -2.001 1.00 0.00 H new ATOM 0 HG2 LYS A 34 7.071 2.948 -0.319 1.00 0.00 H new ATOM 0 HG3 LYS A 34 6.236 1.414 -0.179 1.00 0.00 H new ATOM 0 HD2 LYS A 34 8.038 0.282 -1.434 1.00 0.00 H new ATOM 0 HD3 LYS A 34 8.857 1.811 -1.681 1.00 0.00 H new ATOM 0 HE2 LYS A 34 9.109 2.075 0.781 1.00 0.00 H new ATOM 0 HE3 LYS A 34 8.289 0.546 1.029 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 10.680 0.282 1.123 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 10.055 -0.571 -0.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 10.849 0.910 -0.445 1.00 0.00 H new ATOM 553 N GLU A 35 3.704 0.766 -1.650 1.00 0.00 N ATOM 554 CA GLU A 35 2.703 0.136 -0.796 1.00 0.00 C ATOM 555 C GLU A 35 2.056 -1.087 -1.454 1.00 0.00 C ATOM 556 O GLU A 35 1.830 -2.102 -0.796 1.00 0.00 O ATOM 557 CB GLU A 35 1.628 1.167 -0.427 1.00 0.00 C ATOM 558 CG GLU A 35 2.116 2.244 0.533 1.00 0.00 C ATOM 559 CD GLU A 35 2.594 1.681 1.858 1.00 0.00 C ATOM 560 OE1 GLU A 35 1.846 0.889 2.472 1.00 0.00 O ATOM 561 OE2 GLU A 35 3.715 2.032 2.282 1.00 0.00 O ATOM 0 H GLU A 35 3.459 1.710 -1.949 1.00 0.00 H new ATOM 0 HA GLU A 35 3.209 -0.218 0.102 1.00 0.00 H new ATOM 0 HB2 GLU A 35 1.265 1.642 -1.338 1.00 0.00 H new ATOM 0 HB3 GLU A 35 0.780 0.650 0.022 1.00 0.00 H new ATOM 0 HG2 GLU A 35 2.929 2.799 0.065 1.00 0.00 H new ATOM 0 HG3 GLU A 35 1.309 2.954 0.715 1.00 0.00 H new ATOM 568 N PHE A 36 1.755 -0.991 -2.748 1.00 0.00 N ATOM 569 CA PHE A 36 1.113 -2.097 -3.462 1.00 0.00 C ATOM 570 C PHE A 36 1.914 -2.549 -4.680 1.00 0.00 C ATOM 571 O PHE A 36 1.336 -3.021 -5.666 1.00 0.00 O ATOM 572 CB PHE A 36 -0.302 -1.700 -3.890 1.00 0.00 C ATOM 573 CG PHE A 36 -1.198 -1.364 -2.734 1.00 0.00 C ATOM 574 CD1 PHE A 36 -1.388 -0.047 -2.349 1.00 0.00 C ATOM 575 CD2 PHE A 36 -1.840 -2.366 -2.026 1.00 0.00 C ATOM 576 CE1 PHE A 36 -2.200 0.264 -1.279 1.00 0.00 C ATOM 577 CE2 PHE A 36 -2.657 -2.059 -0.954 1.00 0.00 C ATOM 578 CZ PHE A 36 -2.835 -0.742 -0.581 1.00 0.00 C ATOM 0 H PHE A 36 1.943 -0.168 -3.320 1.00 0.00 H new ATOM 0 HA PHE A 36 1.068 -2.938 -2.771 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -0.245 -0.841 -4.558 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -0.745 -2.517 -4.459 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -0.895 0.745 -2.893 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -1.701 -3.398 -2.314 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -2.339 1.295 -0.988 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -3.155 -2.848 -0.410 1.00 0.00 H new ATOM 0 HZ PHE A 36 -3.471 -0.499 0.257 1.00 0.00 H new ATOM 588 N LYS A 37 3.237 -2.404 -4.621 1.00 0.00 N ATOM 589 CA LYS A 37 4.090 -2.795 -5.742 1.00 0.00 C ATOM 590 C LYS A 37 3.976 -4.289 -6.031 1.00 0.00 C ATOM 591 O LYS A 37 4.126 -5.122 -5.136 1.00 0.00 O ATOM 592 CB LYS A 37 5.551 -2.430 -5.466 1.00 0.00 C ATOM 593 CG LYS A 37 6.488 -2.741 -6.628 1.00 0.00 C ATOM 594 CD LYS A 37 7.870 -2.145 -6.414 1.00 0.00 C ATOM 595 CE LYS A 37 8.572 -2.776 -5.225 1.00 0.00 C ATOM 596 NZ LYS A 37 9.955 -2.252 -5.052 1.00 0.00 N ATOM 0 H LYS A 37 3.737 -2.023 -3.818 1.00 0.00 H new ATOM 0 HA LYS A 37 3.747 -2.247 -6.620 1.00 0.00 H new ATOM 0 HB2 LYS A 37 5.614 -1.367 -5.234 1.00 0.00 H new ATOM 0 HB3 LYS A 37 5.891 -2.969 -4.582 1.00 0.00 H new ATOM 0 HG2 LYS A 37 6.573 -3.821 -6.748 1.00 0.00 H new ATOM 0 HG3 LYS A 37 6.063 -2.350 -7.552 1.00 0.00 H new ATOM 0 HD2 LYS A 37 8.472 -2.289 -7.311 1.00 0.00 H new ATOM 0 HD3 LYS A 37 7.783 -1.070 -6.258 1.00 0.00 H new ATOM 0 HE2 LYS A 37 7.996 -2.584 -4.320 1.00 0.00 H new ATOM 0 HE3 LYS A 37 8.608 -3.857 -5.357 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 10.399 -2.708 -4.230 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 10.513 -2.457 -5.905 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 9.920 -1.224 -4.900 1.00 0.00 H new ATOM 610 N GLY A 38 3.706 -4.617 -7.291 1.00 0.00 N ATOM 611 CA GLY A 38 3.580 -6.005 -7.690 1.00 0.00 C ATOM 612 C GLY A 38 2.159 -6.525 -7.578 1.00 0.00 C ATOM 613 O GLY A 38 1.867 -7.634 -8.023 1.00 0.00 O ATOM 0 H GLY A 38 3.572 -3.943 -8.044 1.00 0.00 H new ATOM 0 HA2 GLY A 38 3.921 -6.114 -8.719 1.00 0.00 H new ATOM 0 HA3 GLY A 38 4.235 -6.617 -7.070 1.00 0.00 H new ATOM 617 N VAL A 39 1.270 -5.729 -6.988 1.00 0.00 N ATOM 618 CA VAL A 39 -0.118 -6.145 -6.829 1.00 0.00 C ATOM 619 C VAL A 39 -1.042 -5.379 -7.776 1.00 0.00 C ATOM 620 O VAL A 39 -1.961 -5.961 -8.358 1.00 0.00 O ATOM 621 CB VAL A 39 -0.610 -5.980 -5.373 1.00 0.00 C ATOM 622 CG1 VAL A 39 -2.032 -6.506 -5.215 1.00 0.00 C ATOM 623 CG2 VAL A 39 0.332 -6.681 -4.404 1.00 0.00 C ATOM 0 H VAL A 39 1.484 -4.803 -6.617 1.00 0.00 H new ATOM 0 HA VAL A 39 -0.153 -7.205 -7.082 1.00 0.00 H new ATOM 0 HB VAL A 39 -0.615 -4.916 -5.138 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -2.354 -6.378 -4.182 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -2.700 -5.952 -5.875 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -2.060 -7.564 -5.476 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -0.033 -6.553 -3.385 1.00 0.00 H new ATOM 0 HG22 VAL A 39 0.375 -7.744 -4.643 1.00 0.00 H new ATOM 0 HG23 VAL A 39 1.329 -6.249 -4.490 1.00 0.00 H new ATOM 633 N TYR A 40 -0.808 -4.080 -7.943 1.00 0.00 N ATOM 634 CA TYR A 40 -1.662 -3.290 -8.825 1.00 0.00 C ATOM 635 C TYR A 40 -0.904 -2.739 -10.026 1.00 0.00 C ATOM 636 O TYR A 40 0.271 -2.384 -9.931 1.00 0.00 O ATOM 637 CB TYR A 40 -2.299 -2.119 -8.083 1.00 0.00 C ATOM 638 CG TYR A 40 -3.505 -2.444 -7.245 1.00 0.00 C ATOM 639 CD1 TYR A 40 -3.376 -2.980 -5.972 1.00 0.00 C ATOM 640 CD2 TYR A 40 -4.776 -2.167 -7.718 1.00 0.00 C ATOM 641 CE1 TYR A 40 -4.488 -3.232 -5.196 1.00 0.00 C ATOM 642 CE2 TYR A 40 -5.890 -2.422 -6.953 1.00 0.00 C ATOM 643 CZ TYR A 40 -5.742 -2.951 -5.695 1.00 0.00 C ATOM 644 OH TYR A 40 -6.850 -3.190 -4.931 1.00 0.00 O ATOM 0 H TYR A 40 -0.054 -3.562 -7.492 1.00 0.00 H new ATOM 0 HA TYR A 40 -2.435 -3.974 -9.176 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -1.544 -1.670 -7.438 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -2.583 -1.363 -8.815 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -2.393 -3.203 -5.584 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -4.895 -1.744 -8.704 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -4.377 -3.646 -4.205 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -6.875 -2.207 -7.340 1.00 0.00 H new ATOM 0 HH TYR A 40 -7.649 -3.168 -5.498 1.00 0.00 H new ATOM 654 N ALA A 41 -1.599 -2.674 -11.156 1.00 0.00 N ATOM 655 CA ALA A 41 -1.040 -2.115 -12.375 1.00 0.00 C ATOM 656 C ALA A 41 -1.670 -0.743 -12.616 1.00 0.00 C ATOM 657 O ALA A 41 -2.897 -0.622 -12.662 1.00 0.00 O ATOM 658 CB ALA A 41 -1.292 -3.045 -13.554 1.00 0.00 C ATOM 0 H ALA A 41 -2.559 -3.006 -11.250 1.00 0.00 H new ATOM 0 HA ALA A 41 0.039 -2.005 -12.271 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -0.866 -2.610 -14.458 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -0.825 -4.011 -13.362 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -2.365 -3.181 -13.687 1.00 0.00 H new ATOM 664 N LEU A 42 -0.845 0.286 -12.763 1.00 0.00 N ATOM 665 CA LEU A 42 -1.358 1.642 -12.954 1.00 0.00 C ATOM 666 C LEU A 42 -1.394 2.059 -14.421 1.00 0.00 C ATOM 667 O LEU A 42 -0.398 1.960 -15.141 1.00 0.00 O ATOM 668 CB LEU A 42 -0.523 2.651 -12.154 1.00 0.00 C ATOM 669 CG LEU A 42 -0.932 4.120 -12.326 1.00 0.00 C ATOM 670 CD1 LEU A 42 -2.350 4.354 -11.825 1.00 0.00 C ATOM 671 CD2 LEU A 42 0.046 5.036 -11.609 1.00 0.00 C ATOM 0 H LEU A 42 0.172 0.212 -12.754 1.00 0.00 H new ATOM 0 HA LEU A 42 -2.385 1.638 -12.589 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -0.587 2.394 -11.097 1.00 0.00 H new ATOM 0 HB3 LEU A 42 0.522 2.545 -12.445 1.00 0.00 H new ATOM 0 HG LEU A 42 -0.907 4.354 -13.390 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -2.615 5.403 -11.959 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -3.043 3.730 -12.390 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -2.409 4.097 -10.767 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -0.262 6.073 -11.743 1.00 0.00 H new ATOM 0 HD22 LEU A 42 0.057 4.795 -10.546 1.00 0.00 H new ATOM 0 HD23 LEU A 42 1.045 4.897 -12.023 1.00 0.00 H new ATOM 683 N LYS A 43 -2.562 2.526 -14.843 1.00 0.00 N ATOM 684 CA LYS A 43 -2.776 3.013 -16.198 1.00 0.00 C ATOM 685 C LYS A 43 -3.270 4.456 -16.134 1.00 0.00 C ATOM 686 O LYS A 43 -4.110 4.791 -15.305 1.00 0.00 O ATOM 687 CB LYS A 43 -3.797 2.147 -16.940 1.00 0.00 C ATOM 688 CG LYS A 43 -3.207 1.307 -18.061 1.00 0.00 C ATOM 689 CD LYS A 43 -2.340 0.179 -17.528 1.00 0.00 C ATOM 690 CE LYS A 43 -1.911 -0.755 -18.646 1.00 0.00 C ATOM 691 NZ LYS A 43 -1.050 -1.862 -18.150 1.00 0.00 N ATOM 0 H LYS A 43 -3.391 2.577 -14.251 1.00 0.00 H new ATOM 0 HA LYS A 43 -1.833 2.963 -16.743 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -4.284 1.485 -16.224 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -4.571 2.793 -17.354 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -4.013 0.891 -18.665 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -2.612 1.943 -18.717 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -1.459 0.594 -17.038 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -2.891 -0.382 -16.773 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -2.795 -1.172 -19.129 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -1.371 -0.188 -19.404 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -0.780 -2.475 -18.946 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -0.194 -1.466 -17.712 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -1.573 -2.420 -17.445 1.00 0.00 H new ATOM 705 N VAL A 44 -2.738 5.304 -16.998 1.00 0.00 N ATOM 706 CA VAL A 44 -3.123 6.713 -17.033 1.00 0.00 C ATOM 707 C VAL A 44 -3.681 7.092 -18.387 1.00 0.00 C ATOM 708 O VAL A 44 -3.117 6.769 -19.434 1.00 0.00 O ATOM 709 CB VAL A 44 -1.936 7.639 -16.667 1.00 0.00 C ATOM 710 CG1 VAL A 44 -0.692 7.284 -17.469 1.00 0.00 C ATOM 711 CG2 VAL A 44 -2.300 9.106 -16.860 1.00 0.00 C ATOM 0 H VAL A 44 -2.035 5.044 -17.689 1.00 0.00 H new ATOM 0 HA VAL A 44 -3.903 6.850 -16.284 1.00 0.00 H new ATOM 0 HB VAL A 44 -1.713 7.483 -15.612 1.00 0.00 H new ATOM 0 HG11 VAL A 44 0.124 7.951 -17.190 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -0.406 6.253 -17.259 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -0.902 7.393 -18.533 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -1.447 9.730 -16.595 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -2.568 9.280 -17.902 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -3.146 9.358 -16.221 1.00 0.00 H new ATOM 721 N ILE A 45 -4.814 7.773 -18.344 1.00 0.00 N ATOM 722 CA ILE A 45 -5.492 8.217 -19.536 1.00 0.00 C ATOM 723 C ILE A 45 -5.464 9.741 -19.590 1.00 0.00 C ATOM 724 O ILE A 45 -6.171 10.409 -18.830 1.00 0.00 O ATOM 725 CB ILE A 45 -6.958 7.733 -19.511 1.00 0.00 C ATOM 726 CG1 ILE A 45 -7.030 6.231 -19.195 1.00 0.00 C ATOM 727 CG2 ILE A 45 -7.670 8.042 -20.827 1.00 0.00 C ATOM 728 CD1 ILE A 45 -6.313 5.341 -20.189 1.00 0.00 C ATOM 0 H ILE A 45 -5.285 8.031 -17.477 1.00 0.00 H new ATOM 0 HA ILE A 45 -4.992 7.807 -20.413 1.00 0.00 H new ATOM 0 HB ILE A 45 -7.473 8.277 -18.719 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -6.607 6.061 -18.205 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -8.077 5.933 -19.150 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -8.700 7.688 -20.775 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -7.664 9.118 -21.000 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -7.155 7.540 -21.646 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -6.417 4.299 -19.886 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -6.749 5.476 -21.179 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -5.256 5.606 -20.219 1.00 0.00 H new ATOM 740 N ASP A 46 -4.630 10.288 -20.463 1.00 0.00 N ATOM 741 CA ASP A 46 -4.535 11.736 -20.613 1.00 0.00 C ATOM 742 C ASP A 46 -5.728 12.239 -21.422 1.00 0.00 C ATOM 743 O ASP A 46 -5.766 12.109 -22.648 1.00 0.00 O ATOM 744 CB ASP A 46 -3.219 12.117 -21.302 1.00 0.00 C ATOM 745 CG ASP A 46 -2.941 13.611 -21.270 1.00 0.00 C ATOM 746 OD1 ASP A 46 -3.864 14.395 -20.950 1.00 0.00 O ATOM 747 OD2 ASP A 46 -1.793 14.001 -21.565 1.00 0.00 O ATOM 0 H ASP A 46 -4.012 9.756 -21.076 1.00 0.00 H new ATOM 0 HA ASP A 46 -4.548 12.202 -19.628 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -2.397 11.590 -20.818 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -3.248 11.781 -22.338 1.00 0.00 H new ATOM 752 N VAL A 47 -6.684 12.822 -20.715 1.00 0.00 N ATOM 753 CA VAL A 47 -7.915 13.336 -21.307 1.00 0.00 C ATOM 754 C VAL A 47 -7.670 14.447 -22.337 1.00 0.00 C ATOM 755 O VAL A 47 -8.272 14.440 -23.410 1.00 0.00 O ATOM 756 CB VAL A 47 -8.855 13.837 -20.190 1.00 0.00 C ATOM 757 CG1 VAL A 47 -10.045 14.611 -20.742 1.00 0.00 C ATOM 758 CG2 VAL A 47 -9.316 12.665 -19.330 1.00 0.00 C ATOM 0 H VAL A 47 -6.629 12.954 -19.705 1.00 0.00 H new ATOM 0 HA VAL A 47 -8.381 12.513 -21.849 1.00 0.00 H new ATOM 0 HB VAL A 47 -8.291 14.533 -19.569 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -10.677 14.943 -19.918 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -9.689 15.478 -21.298 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -10.622 13.967 -21.405 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -9.979 13.029 -18.545 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -9.850 11.946 -19.951 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -8.449 12.182 -18.879 1.00 0.00 H new ATOM 768 N LEU A 48 -6.794 15.396 -22.017 1.00 0.00 N ATOM 769 CA LEU A 48 -6.512 16.503 -22.939 1.00 0.00 C ATOM 770 C LEU A 48 -5.771 16.044 -24.194 1.00 0.00 C ATOM 771 O LEU A 48 -6.020 16.556 -25.285 1.00 0.00 O ATOM 772 CB LEU A 48 -5.741 17.635 -22.252 1.00 0.00 C ATOM 773 CG LEU A 48 -6.550 18.440 -21.229 1.00 0.00 C ATOM 774 CD1 LEU A 48 -5.663 19.455 -20.525 1.00 0.00 C ATOM 775 CD2 LEU A 48 -7.723 19.136 -21.903 1.00 0.00 C ATOM 0 H LEU A 48 -6.272 15.426 -21.141 1.00 0.00 H new ATOM 0 HA LEU A 48 -7.483 16.888 -23.250 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -4.871 17.210 -21.752 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -5.368 18.317 -23.016 1.00 0.00 H new ATOM 0 HG LEU A 48 -6.942 17.749 -20.483 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -6.255 20.017 -19.803 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -4.856 18.936 -20.007 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -5.241 20.141 -21.260 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -8.285 19.702 -21.161 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -7.351 19.814 -22.671 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -8.374 18.391 -22.361 1.00 0.00 H new ATOM 787 N LYS A 49 -4.856 15.091 -24.037 1.00 0.00 N ATOM 788 CA LYS A 49 -4.086 14.582 -25.167 1.00 0.00 C ATOM 789 C LYS A 49 -4.969 13.763 -26.105 1.00 0.00 C ATOM 790 O LYS A 49 -4.862 13.869 -27.328 1.00 0.00 O ATOM 791 CB LYS A 49 -2.927 13.729 -24.666 1.00 0.00 C ATOM 792 CG LYS A 49 -2.030 13.205 -25.769 1.00 0.00 C ATOM 793 CD LYS A 49 -0.868 12.423 -25.196 1.00 0.00 C ATOM 794 CE LYS A 49 0.048 11.911 -26.291 1.00 0.00 C ATOM 795 NZ LYS A 49 -0.640 10.937 -27.181 1.00 0.00 N ATOM 0 H LYS A 49 -4.631 14.657 -23.142 1.00 0.00 H new ATOM 0 HA LYS A 49 -3.693 15.433 -25.723 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -2.327 14.319 -23.973 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -3.326 12.885 -24.104 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -2.606 12.568 -26.440 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -1.655 14.038 -26.364 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -0.302 13.057 -24.513 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -1.245 11.583 -24.613 1.00 0.00 H new ATOM 0 HE2 LYS A 49 0.410 12.751 -26.884 1.00 0.00 H new ATOM 0 HE3 LYS A 49 0.921 11.438 -25.842 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 0.062 10.461 -27.783 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -1.137 10.230 -26.603 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -1.326 11.439 -27.780 1.00 0.00 H new ATOM 809 N ASN A 50 -5.847 12.950 -25.527 1.00 0.00 N ATOM 810 CA ASN A 50 -6.750 12.122 -26.318 1.00 0.00 C ATOM 811 C ASN A 50 -8.190 12.333 -25.891 1.00 0.00 C ATOM 812 O ASN A 50 -8.743 11.556 -25.108 1.00 0.00 O ATOM 813 CB ASN A 50 -6.389 10.644 -26.197 1.00 0.00 C ATOM 814 CG ASN A 50 -4.996 10.329 -26.710 1.00 0.00 C ATOM 815 OD1 ASN A 50 -4.120 9.915 -25.951 1.00 0.00 O ATOM 816 ND2 ASN A 50 -4.783 10.521 -28.006 1.00 0.00 N ATOM 0 H ASN A 50 -5.952 12.847 -24.518 1.00 0.00 H new ATOM 0 HA ASN A 50 -6.642 12.424 -27.360 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -6.462 10.342 -25.152 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -7.117 10.052 -26.751 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -3.866 10.324 -28.407 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -5.536 10.866 -28.601 1.00 0.00 H new ATOM 823 N PRO A 51 -8.814 13.393 -26.417 1.00 0.00 N ATOM 824 CA PRO A 51 -10.202 13.748 -26.101 1.00 0.00 C ATOM 825 C PRO A 51 -11.188 12.645 -26.469 1.00 0.00 C ATOM 826 O PRO A 51 -12.207 12.461 -25.804 1.00 0.00 O ATOM 827 CB PRO A 51 -10.447 15.003 -26.948 1.00 0.00 C ATOM 828 CG PRO A 51 -9.081 15.537 -27.217 1.00 0.00 C ATOM 829 CD PRO A 51 -8.221 14.330 -27.384 1.00 0.00 C ATOM 0 HA PRO A 51 -10.350 13.904 -25.032 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -10.970 14.763 -27.874 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -11.060 15.729 -26.415 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -9.069 16.157 -28.113 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -8.731 16.160 -26.394 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -8.256 13.942 -28.402 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -7.175 14.540 -27.159 1.00 0.00 H new ATOM 837 N GLN A 52 -10.873 11.915 -27.537 1.00 0.00 N ATOM 838 CA GLN A 52 -11.719 10.825 -28.008 1.00 0.00 C ATOM 839 C GLN A 52 -11.810 9.731 -26.965 1.00 0.00 C ATOM 840 O GLN A 52 -12.888 9.206 -26.706 1.00 0.00 O ATOM 841 CB GLN A 52 -11.158 10.238 -29.308 1.00 0.00 C ATOM 842 CG GLN A 52 -11.235 11.183 -30.497 1.00 0.00 C ATOM 843 CD GLN A 52 -9.964 11.994 -30.688 1.00 0.00 C ATOM 844 OE1 GLN A 52 -9.189 12.186 -29.750 1.00 0.00 O ATOM 845 NE2 GLN A 52 -9.744 12.474 -31.904 1.00 0.00 N ATOM 0 H GLN A 52 -10.032 12.062 -28.095 1.00 0.00 H new ATOM 0 HA GLN A 52 -12.715 11.227 -28.192 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -10.117 9.956 -29.148 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -11.703 9.325 -29.547 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -11.432 10.607 -31.401 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -12.077 11.862 -30.362 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -10.412 12.291 -32.653 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -8.907 13.026 -32.091 1.00 0.00 H new ATOM 854 N LEU A 53 -10.680 9.412 -26.347 1.00 0.00 N ATOM 855 CA LEU A 53 -10.649 8.369 -25.335 1.00 0.00 C ATOM 856 C LEU A 53 -11.367 8.838 -24.080 1.00 0.00 C ATOM 857 O LEU A 53 -12.053 8.058 -23.415 1.00 0.00 O ATOM 858 CB LEU A 53 -9.215 7.942 -25.038 1.00 0.00 C ATOM 859 CG LEU A 53 -8.531 7.209 -26.194 1.00 0.00 C ATOM 860 CD1 LEU A 53 -7.051 7.016 -25.909 1.00 0.00 C ATOM 861 CD2 LEU A 53 -9.206 5.870 -26.450 1.00 0.00 C ATOM 0 H LEU A 53 -9.781 9.858 -26.528 1.00 0.00 H new ATOM 0 HA LEU A 53 -11.173 7.493 -25.716 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -8.629 8.825 -24.784 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -9.214 7.296 -24.160 1.00 0.00 H new ATOM 0 HG LEU A 53 -8.627 7.821 -27.091 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -6.585 6.493 -26.744 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -6.576 7.988 -25.779 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -6.929 6.428 -24.999 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -8.706 5.363 -27.275 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -9.143 5.253 -25.553 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -10.253 6.033 -26.705 1.00 0.00 H new ATOM 873 N ALA A 54 -11.200 10.122 -23.758 1.00 0.00 N ATOM 874 CA ALA A 54 -11.857 10.709 -22.600 1.00 0.00 C ATOM 875 C ALA A 54 -13.368 10.683 -22.790 1.00 0.00 C ATOM 876 O ALA A 54 -14.118 10.398 -21.861 1.00 0.00 O ATOM 877 CB ALA A 54 -11.377 12.134 -22.381 1.00 0.00 C ATOM 0 H ALA A 54 -10.615 10.770 -24.285 1.00 0.00 H new ATOM 0 HA ALA A 54 -11.602 10.121 -21.718 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -11.879 12.557 -21.511 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -10.300 12.134 -22.214 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -11.608 12.735 -23.261 1.00 0.00 H new ATOM 883 N GLU A 55 -13.797 11.001 -24.013 1.00 0.00 N ATOM 884 CA GLU A 55 -15.212 10.998 -24.377 1.00 0.00 C ATOM 885 C GLU A 55 -15.766 9.580 -24.368 1.00 0.00 C ATOM 886 O GLU A 55 -16.921 9.362 -24.005 1.00 0.00 O ATOM 887 CB GLU A 55 -15.436 11.634 -25.750 1.00 0.00 C ATOM 888 CG GLU A 55 -16.908 11.731 -26.132 1.00 0.00 C ATOM 889 CD GLU A 55 -17.125 12.374 -27.489 1.00 0.00 C ATOM 890 OE1 GLU A 55 -16.124 12.743 -28.141 1.00 0.00 O ATOM 891 OE2 GLU A 55 -18.296 12.509 -27.899 1.00 0.00 O ATOM 0 H GLU A 55 -13.174 11.267 -24.776 1.00 0.00 H new ATOM 0 HA GLU A 55 -15.742 11.593 -23.633 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -14.999 12.632 -25.757 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -14.909 11.050 -26.504 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -17.344 10.732 -26.135 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -17.438 12.307 -25.374 1.00 0.00 H new ATOM 898 N GLU A 56 -14.944 8.619 -24.788 1.00 0.00 N ATOM 899 CA GLU A 56 -15.364 7.222 -24.822 1.00 0.00 C ATOM 900 C GLU A 56 -15.752 6.767 -23.417 1.00 0.00 C ATOM 901 O GLU A 56 -16.719 6.026 -23.244 1.00 0.00 O ATOM 902 CB GLU A 56 -14.253 6.323 -25.380 1.00 0.00 C ATOM 903 CG GLU A 56 -13.956 6.546 -26.860 1.00 0.00 C ATOM 904 CD GLU A 56 -12.928 5.574 -27.404 1.00 0.00 C ATOM 905 OE1 GLU A 56 -12.413 4.750 -26.619 1.00 0.00 O ATOM 906 OE2 GLU A 56 -12.638 5.638 -28.616 1.00 0.00 O ATOM 0 H GLU A 56 -13.989 8.782 -25.107 1.00 0.00 H new ATOM 0 HA GLU A 56 -16.227 7.138 -25.482 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -13.341 6.493 -24.808 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -14.534 5.281 -25.230 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -14.880 6.448 -27.430 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -13.598 7.565 -27.005 1.00 0.00 H new ATOM 913 N ASP A 57 -14.996 7.210 -22.413 1.00 0.00 N ATOM 914 CA ASP A 57 -15.308 6.864 -21.030 1.00 0.00 C ATOM 915 C ASP A 57 -16.076 8.001 -20.351 1.00 0.00 C ATOM 916 O ASP A 57 -16.312 7.961 -19.144 1.00 0.00 O ATOM 917 CB ASP A 57 -14.042 6.505 -20.239 1.00 0.00 C ATOM 918 CG ASP A 57 -13.450 5.170 -20.649 1.00 0.00 C ATOM 919 OD1 ASP A 57 -14.148 4.390 -21.330 1.00 0.00 O ATOM 920 OD2 ASP A 57 -12.283 4.905 -20.288 1.00 0.00 O ATOM 0 H ASP A 57 -14.174 7.802 -22.530 1.00 0.00 H new ATOM 0 HA ASP A 57 -15.945 5.979 -21.043 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -13.296 7.287 -20.382 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -14.279 6.481 -19.175 1.00 0.00 H new ATOM 925 N LYS A 58 -16.463 9.004 -21.153 1.00 0.00 N ATOM 926 CA LYS A 58 -17.233 10.166 -20.684 1.00 0.00 C ATOM 927 C LYS A 58 -16.631 10.817 -19.441 1.00 0.00 C ATOM 928 O LYS A 58 -17.312 11.016 -18.432 1.00 0.00 O ATOM 929 CB LYS A 58 -18.696 9.781 -20.451 1.00 0.00 C ATOM 930 CG LYS A 58 -19.429 9.417 -21.736 1.00 0.00 C ATOM 931 CD LYS A 58 -19.703 10.645 -22.591 1.00 0.00 C ATOM 932 CE LYS A 58 -20.506 10.289 -23.830 1.00 0.00 C ATOM 933 NZ LYS A 58 -19.756 9.372 -24.732 1.00 0.00 N ATOM 0 H LYS A 58 -16.250 9.032 -22.150 1.00 0.00 H new ATOM 0 HA LYS A 58 -17.187 10.916 -21.473 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -18.738 8.936 -19.764 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -19.212 10.611 -19.968 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -18.834 8.702 -22.305 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -20.371 8.925 -21.492 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -20.246 11.385 -22.004 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -18.759 11.103 -22.886 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -21.444 9.819 -23.533 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -20.763 11.200 -24.370 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -19.847 9.701 -25.715 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -18.752 9.363 -24.461 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -20.145 8.411 -24.651 1.00 0.00 H new ATOM 947 N ILE A 59 -15.353 11.154 -19.528 1.00 0.00 N ATOM 948 CA ILE A 59 -14.654 11.788 -18.422 1.00 0.00 C ATOM 949 C ILE A 59 -14.876 13.300 -18.442 1.00 0.00 C ATOM 950 O ILE A 59 -14.345 14.006 -19.300 1.00 0.00 O ATOM 951 CB ILE A 59 -13.142 11.486 -18.493 1.00 0.00 C ATOM 952 CG1 ILE A 59 -12.904 9.973 -18.525 1.00 0.00 C ATOM 953 CG2 ILE A 59 -12.404 12.121 -17.321 1.00 0.00 C ATOM 954 CD1 ILE A 59 -13.445 9.245 -17.314 1.00 0.00 C ATOM 0 H ILE A 59 -14.778 10.998 -20.356 1.00 0.00 H new ATOM 0 HA ILE A 59 -15.055 11.383 -17.493 1.00 0.00 H new ATOM 0 HB ILE A 59 -12.749 11.920 -19.412 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -13.366 9.561 -19.422 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -11.833 9.784 -18.603 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -11.341 11.893 -17.394 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -12.546 13.201 -17.344 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -12.797 11.723 -16.385 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -13.239 8.179 -17.408 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -12.965 9.629 -16.414 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -14.522 9.402 -17.246 1.00 0.00 H new ATOM 966 N LEU A 60 -15.675 13.789 -17.494 1.00 0.00 N ATOM 967 CA LEU A 60 -15.973 15.217 -17.407 1.00 0.00 C ATOM 968 C LEU A 60 -15.219 15.888 -16.259 1.00 0.00 C ATOM 969 O LEU A 60 -15.195 17.114 -16.160 1.00 0.00 O ATOM 970 CB LEU A 60 -17.479 15.432 -17.234 1.00 0.00 C ATOM 971 CG LEU A 60 -18.353 14.874 -18.362 1.00 0.00 C ATOM 972 CD1 LEU A 60 -19.827 15.076 -18.044 1.00 0.00 C ATOM 973 CD2 LEU A 60 -18.000 15.529 -19.690 1.00 0.00 C ATOM 0 H LEU A 60 -16.126 13.219 -16.778 1.00 0.00 H new ATOM 0 HA LEU A 60 -15.642 15.677 -18.338 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -17.789 14.973 -16.295 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -17.669 16.502 -17.144 1.00 0.00 H new ATOM 0 HG LEU A 60 -18.161 13.804 -18.446 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -20.433 14.674 -18.856 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -20.073 14.559 -17.117 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -20.032 16.141 -17.931 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -18.632 15.119 -20.477 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -18.161 16.605 -19.619 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -16.954 15.333 -19.926 1.00 0.00 H new ATOM 985 N ALA A 61 -14.606 15.087 -15.393 1.00 0.00 N ATOM 986 CA ALA A 61 -13.864 15.624 -14.256 1.00 0.00 C ATOM 987 C ALA A 61 -12.543 14.890 -14.070 1.00 0.00 C ATOM 988 O ALA A 61 -12.491 13.667 -14.159 1.00 0.00 O ATOM 989 CB ALA A 61 -14.701 15.532 -12.986 1.00 0.00 C ATOM 0 H ALA A 61 -14.608 14.069 -15.455 1.00 0.00 H new ATOM 0 HA ALA A 61 -13.645 16.672 -14.460 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -14.135 15.936 -12.147 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -15.620 16.105 -13.113 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -14.948 14.489 -12.788 1.00 0.00 H new ATOM 995 N THR A 62 -11.483 15.644 -13.795 1.00 0.00 N ATOM 996 CA THR A 62 -10.158 15.082 -13.593 1.00 0.00 C ATOM 997 C THR A 62 -9.495 15.699 -12.362 1.00 0.00 C ATOM 998 O THR A 62 -9.729 16.865 -12.042 1.00 0.00 O ATOM 999 CB THR A 62 -9.245 15.346 -14.811 1.00 0.00 C ATOM 1000 OG1 THR A 62 -9.160 16.755 -15.053 1.00 0.00 O ATOM 1001 CG2 THR A 62 -9.751 14.645 -16.063 1.00 0.00 C ATOM 0 H THR A 62 -11.521 16.659 -13.707 1.00 0.00 H new ATOM 0 HA THR A 62 -10.284 14.008 -13.457 1.00 0.00 H new ATOM 0 HB THR A 62 -8.259 14.944 -14.579 1.00 0.00 H new ATOM 0 HG1 THR A 62 -8.261 17.072 -14.825 1.00 0.00 H new ATOM 0 HG21 THR A 62 -9.080 14.857 -16.895 1.00 0.00 H new ATOM 0 HG22 THR A 62 -9.785 13.569 -15.889 1.00 0.00 H new ATOM 0 HG23 THR A 62 -10.751 15.005 -16.303 1.00 0.00 H new ATOM 1009 N PRO A 63 -8.648 14.927 -11.664 1.00 0.00 N ATOM 1010 CA PRO A 63 -8.374 13.535 -12.015 1.00 0.00 C ATOM 1011 C PRO A 63 -9.506 12.591 -11.612 1.00 0.00 C ATOM 1012 O PRO A 63 -10.248 12.847 -10.663 1.00 0.00 O ATOM 1013 CB PRO A 63 -7.102 13.219 -11.233 1.00 0.00 C ATOM 1014 CG PRO A 63 -7.154 14.114 -10.047 1.00 0.00 C ATOM 1015 CD PRO A 63 -7.871 15.363 -10.487 1.00 0.00 C ATOM 0 HA PRO A 63 -8.273 13.400 -13.092 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -7.070 12.171 -10.936 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -6.212 13.408 -11.833 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -7.680 13.635 -9.222 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -6.150 14.347 -9.692 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -8.519 15.750 -9.701 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -7.170 16.158 -10.742 1.00 0.00 H new ATOM 1023 N THR A 64 -9.622 11.500 -12.347 1.00 0.00 N ATOM 1024 CA THR A 64 -10.628 10.481 -12.074 1.00 0.00 C ATOM 1025 C THR A 64 -9.936 9.158 -11.780 1.00 0.00 C ATOM 1026 O THR A 64 -9.146 8.672 -12.590 1.00 0.00 O ATOM 1027 CB THR A 64 -11.590 10.275 -13.262 1.00 0.00 C ATOM 1028 OG1 THR A 64 -11.418 11.316 -14.226 1.00 0.00 O ATOM 1029 CG2 THR A 64 -13.040 10.235 -12.796 1.00 0.00 C ATOM 0 H THR A 64 -9.025 11.293 -13.148 1.00 0.00 H new ATOM 0 HA THR A 64 -11.211 10.821 -11.218 1.00 0.00 H new ATOM 0 HB THR A 64 -11.352 9.316 -13.723 1.00 0.00 H new ATOM 0 HG1 THR A 64 -11.952 12.095 -13.965 1.00 0.00 H new ATOM 0 HG21 THR A 64 -13.694 10.089 -13.655 1.00 0.00 H new ATOM 0 HG22 THR A 64 -13.174 9.412 -12.094 1.00 0.00 H new ATOM 0 HG23 THR A 64 -13.290 11.175 -12.305 1.00 0.00 H new ATOM 1037 N LEU A 65 -10.224 8.580 -10.626 1.00 0.00 N ATOM 1038 CA LEU A 65 -9.621 7.314 -10.240 1.00 0.00 C ATOM 1039 C LEU A 65 -10.639 6.192 -10.385 1.00 0.00 C ATOM 1040 O LEU A 65 -11.671 6.199 -9.722 1.00 0.00 O ATOM 1041 CB LEU A 65 -9.132 7.388 -8.789 1.00 0.00 C ATOM 1042 CG LEU A 65 -8.398 6.145 -8.278 1.00 0.00 C ATOM 1043 CD1 LEU A 65 -7.120 5.922 -9.071 1.00 0.00 C ATOM 1044 CD2 LEU A 65 -8.090 6.275 -6.795 1.00 0.00 C ATOM 0 H LEU A 65 -10.872 8.967 -9.939 1.00 0.00 H new ATOM 0 HA LEU A 65 -8.771 7.112 -10.892 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -8.468 8.247 -8.691 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -9.990 7.573 -8.143 1.00 0.00 H new ATOM 0 HG LEU A 65 -9.047 5.281 -8.417 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -6.609 5.035 -8.696 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -7.365 5.782 -10.124 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -6.468 6.789 -8.962 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -7.568 5.381 -6.452 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -7.460 7.149 -6.629 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -9.021 6.388 -6.239 1.00 0.00 H new ATOM 1056 N ALA A 66 -10.357 5.232 -11.255 1.00 0.00 N ATOM 1057 CA ALA A 66 -11.274 4.120 -11.459 1.00 0.00 C ATOM 1058 C ALA A 66 -10.536 2.803 -11.625 1.00 0.00 C ATOM 1059 O ALA A 66 -9.521 2.716 -12.315 1.00 0.00 O ATOM 1060 CB ALA A 66 -12.163 4.358 -12.672 1.00 0.00 C ATOM 0 H ALA A 66 -9.511 5.200 -11.824 1.00 0.00 H new ATOM 0 HA ALA A 66 -11.895 4.058 -10.565 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -12.838 3.512 -12.800 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -12.746 5.267 -12.523 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -11.543 4.466 -13.562 1.00 0.00 H new ATOM 1066 N LYS A 67 -11.068 1.779 -10.973 1.00 0.00 N ATOM 1067 CA LYS A 67 -10.521 0.446 -11.058 1.00 0.00 C ATOM 1068 C LYS A 67 -11.266 -0.264 -12.166 1.00 0.00 C ATOM 1069 O LYS A 67 -12.414 -0.672 -11.992 1.00 0.00 O ATOM 1070 CB LYS A 67 -10.696 -0.286 -9.719 1.00 0.00 C ATOM 1071 CG LYS A 67 -10.407 -1.785 -9.778 1.00 0.00 C ATOM 1072 CD LYS A 67 -10.217 -2.392 -8.390 1.00 0.00 C ATOM 1073 CE LYS A 67 -11.511 -2.972 -7.829 1.00 0.00 C ATOM 1074 NZ LYS A 67 -12.110 -3.986 -8.740 1.00 0.00 N ATOM 0 H LYS A 67 -11.889 1.856 -10.373 1.00 0.00 H new ATOM 0 HA LYS A 67 -9.453 0.470 -11.273 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -10.037 0.170 -8.980 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -11.718 -0.139 -9.369 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -11.228 -2.292 -10.285 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -9.510 -1.957 -10.374 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -9.462 -3.176 -8.439 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -9.839 -1.628 -7.710 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -11.313 -3.428 -6.859 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -12.227 -2.167 -7.662 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -12.964 -3.592 -9.185 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -11.422 -4.240 -9.477 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -12.364 -4.835 -8.196 1.00 0.00 H new ATOM 1088 N VAL A 68 -10.623 -0.393 -13.310 1.00 0.00 N ATOM 1089 CA VAL A 68 -11.253 -1.017 -14.451 1.00 0.00 C ATOM 1090 C VAL A 68 -11.230 -2.538 -14.332 1.00 0.00 C ATOM 1091 O VAL A 68 -12.134 -3.219 -14.818 1.00 0.00 O ATOM 1092 CB VAL A 68 -10.604 -0.537 -15.769 1.00 0.00 C ATOM 1093 CG1 VAL A 68 -9.336 -1.310 -16.095 1.00 0.00 C ATOM 1094 CG2 VAL A 68 -11.604 -0.596 -16.910 1.00 0.00 C ATOM 0 H VAL A 68 -9.668 -0.074 -13.471 1.00 0.00 H new ATOM 0 HA VAL A 68 -12.299 -0.711 -14.469 1.00 0.00 H new ATOM 0 HB VAL A 68 -10.308 0.503 -15.632 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -8.914 -0.939 -17.029 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -8.612 -1.177 -15.291 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -9.572 -2.369 -16.199 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -11.128 -0.254 -17.829 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -11.948 -1.622 -17.040 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -12.455 0.046 -16.682 1.00 0.00 H new ATOM 1104 N LEU A 69 -10.204 -3.067 -13.669 1.00 0.00 N ATOM 1105 CA LEU A 69 -10.093 -4.515 -13.493 1.00 0.00 C ATOM 1106 C LEU A 69 -9.643 -4.861 -12.078 1.00 0.00 C ATOM 1107 O LEU A 69 -8.814 -4.161 -11.500 1.00 0.00 O ATOM 1108 CB LEU A 69 -9.104 -5.115 -14.504 1.00 0.00 C ATOM 1109 CG LEU A 69 -9.508 -5.002 -15.979 1.00 0.00 C ATOM 1110 CD1 LEU A 69 -8.361 -5.435 -16.879 1.00 0.00 C ATOM 1111 CD2 LEU A 69 -10.744 -5.842 -16.264 1.00 0.00 C ATOM 0 H LEU A 69 -9.448 -2.526 -13.250 1.00 0.00 H new ATOM 0 HA LEU A 69 -11.081 -4.941 -13.664 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -8.138 -4.627 -14.373 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -8.964 -6.169 -14.265 1.00 0.00 H new ATOM 0 HG LEU A 69 -9.743 -3.958 -16.188 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -8.665 -5.349 -17.922 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -7.496 -4.797 -16.699 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -8.099 -6.471 -16.662 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -11.013 -5.748 -17.316 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -10.534 -6.887 -16.036 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -11.571 -5.494 -15.645 1.00 0.00 H new ATOM 1123 N PRO A 70 -10.173 -5.957 -11.500 1.00 0.00 N ATOM 1124 CA PRO A 70 -11.180 -6.811 -12.150 1.00 0.00 C ATOM 1125 C PRO A 70 -12.584 -6.195 -12.105 1.00 0.00 C ATOM 1126 O PRO A 70 -12.866 -5.356 -11.250 1.00 0.00 O ATOM 1127 CB PRO A 70 -11.126 -8.091 -11.313 1.00 0.00 C ATOM 1128 CG PRO A 70 -10.747 -7.622 -9.951 1.00 0.00 C ATOM 1129 CD PRO A 70 -9.810 -6.463 -10.160 1.00 0.00 C ATOM 0 HA PRO A 70 -10.976 -6.962 -13.210 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -12.089 -8.602 -11.305 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -10.395 -8.795 -11.709 1.00 0.00 H new ATOM 0 HG2 PRO A 70 -11.626 -7.316 -9.384 1.00 0.00 H new ATOM 0 HG3 PRO A 70 -10.264 -8.418 -9.384 1.00 0.00 H new ATOM 0 HD2 PRO A 70 -9.941 -5.699 -9.394 1.00 0.00 H new ATOM 0 HD3 PRO A 70 -8.767 -6.779 -10.120 1.00 0.00 H new ATOM 1137 N PRO A 71 -13.476 -6.589 -13.038 1.00 0.00 N ATOM 1138 CA PRO A 71 -14.860 -6.087 -13.084 1.00 0.00 C ATOM 1139 C PRO A 71 -15.636 -6.416 -11.806 1.00 0.00 C ATOM 1140 O PRO A 71 -15.369 -7.432 -11.162 1.00 0.00 O ATOM 1141 CB PRO A 71 -15.471 -6.826 -14.280 1.00 0.00 C ATOM 1142 CG PRO A 71 -14.305 -7.221 -15.113 1.00 0.00 C ATOM 1143 CD PRO A 71 -13.209 -7.531 -14.136 1.00 0.00 C ATOM 0 HA PRO A 71 -14.896 -5.001 -13.174 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -16.041 -7.697 -13.958 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -16.155 -6.184 -14.835 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -14.538 -8.088 -15.731 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -14.014 -6.417 -15.789 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -13.248 -8.567 -13.799 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -12.222 -7.375 -14.572 1.00 0.00 H new ATOM 1151 N PRO A 72 -16.621 -5.578 -11.419 1.00 0.00 N ATOM 1152 CA PRO A 72 -17.009 -4.361 -12.152 1.00 0.00 C ATOM 1153 C PRO A 72 -16.056 -3.184 -11.929 1.00 0.00 C ATOM 1154 O PRO A 72 -15.219 -3.206 -11.028 1.00 0.00 O ATOM 1155 CB PRO A 72 -18.387 -4.045 -11.572 1.00 0.00 C ATOM 1156 CG PRO A 72 -18.315 -4.540 -10.171 1.00 0.00 C ATOM 1157 CD PRO A 72 -17.455 -5.775 -10.213 1.00 0.00 C ATOM 0 HA PRO A 72 -16.992 -4.518 -13.230 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -18.598 -2.976 -11.606 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -19.178 -4.544 -12.131 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -17.884 -3.786 -9.512 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -19.309 -4.769 -9.786 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -16.845 -5.869 -9.315 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -18.057 -6.681 -10.286 1.00 0.00 H new ATOM 1165 N VAL A 73 -16.198 -2.158 -12.767 1.00 0.00 N ATOM 1166 CA VAL A 73 -15.362 -0.965 -12.675 1.00 0.00 C ATOM 1167 C VAL A 73 -15.762 -0.118 -11.464 1.00 0.00 C ATOM 1168 O VAL A 73 -16.929 0.249 -11.308 1.00 0.00 O ATOM 1169 CB VAL A 73 -15.474 -0.111 -13.959 1.00 0.00 C ATOM 1170 CG1 VAL A 73 -14.624 1.149 -13.858 1.00 0.00 C ATOM 1171 CG2 VAL A 73 -15.081 -0.930 -15.182 1.00 0.00 C ATOM 0 H VAL A 73 -16.887 -2.131 -13.519 1.00 0.00 H new ATOM 0 HA VAL A 73 -14.329 -1.293 -12.558 1.00 0.00 H new ATOM 0 HB VAL A 73 -16.514 0.197 -14.069 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -14.723 1.729 -14.775 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -14.960 1.748 -13.012 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -13.579 0.873 -13.714 1.00 0.00 H new ATOM 0 HG21 VAL A 73 -15.166 -0.312 -16.076 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -14.052 -1.273 -15.075 1.00 0.00 H new ATOM 0 HG23 VAL A 73 -15.743 -1.791 -15.271 1.00 0.00 H new ATOM 1181 N ARG A 74 -14.788 0.187 -10.614 1.00 0.00 N ATOM 1182 CA ARG A 74 -15.031 0.986 -9.416 1.00 0.00 C ATOM 1183 C ARG A 74 -14.428 2.375 -9.557 1.00 0.00 C ATOM 1184 O ARG A 74 -13.216 2.526 -9.677 1.00 0.00 O ATOM 1185 CB ARG A 74 -14.449 0.272 -8.187 1.00 0.00 C ATOM 1186 CG ARG A 74 -14.407 1.123 -6.923 1.00 0.00 C ATOM 1187 CD ARG A 74 -15.801 1.526 -6.462 1.00 0.00 C ATOM 1188 NE ARG A 74 -16.604 0.371 -6.064 1.00 0.00 N ATOM 1189 CZ ARG A 74 -17.893 0.444 -5.742 1.00 0.00 C ATOM 1190 NH1 ARG A 74 -18.520 1.613 -5.769 1.00 0.00 N ATOM 1191 NH2 ARG A 74 -18.552 -0.653 -5.393 1.00 0.00 N ATOM 0 H ARG A 74 -13.819 -0.108 -10.732 1.00 0.00 H new ATOM 0 HA ARG A 74 -16.107 1.099 -9.287 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -15.040 -0.622 -7.988 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -13.437 -0.060 -8.420 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -13.908 0.568 -6.128 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -13.813 2.018 -7.108 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -15.719 2.217 -5.623 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -16.308 2.060 -7.266 1.00 0.00 H new ATOM 0 HE ARG A 74 -16.151 -0.542 -6.031 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -18.014 2.457 -6.037 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -19.508 1.668 -5.522 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -18.071 -1.552 -5.372 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -19.540 -0.598 -5.146 1.00 0.00 H new ATOM 1205 N ARG A 75 -15.280 3.390 -9.528 1.00 0.00 N ATOM 1206 CA ARG A 75 -14.818 4.762 -9.640 1.00 0.00 C ATOM 1207 C ARG A 75 -14.747 5.418 -8.271 1.00 0.00 C ATOM 1208 O ARG A 75 -15.743 5.504 -7.552 1.00 0.00 O ATOM 1209 CB ARG A 75 -15.726 5.577 -10.554 1.00 0.00 C ATOM 1210 CG ARG A 75 -15.577 5.241 -12.027 1.00 0.00 C ATOM 1211 CD ARG A 75 -16.448 6.133 -12.893 1.00 0.00 C ATOM 1212 NE ARG A 75 -17.871 5.827 -12.749 1.00 0.00 N ATOM 1213 CZ ARG A 75 -18.752 6.633 -12.157 1.00 0.00 C ATOM 1214 NH1 ARG A 75 -18.363 7.800 -11.656 1.00 0.00 N ATOM 1215 NH2 ARG A 75 -20.025 6.271 -12.069 1.00 0.00 N ATOM 0 H ARG A 75 -16.290 3.288 -9.428 1.00 0.00 H new ATOM 0 HA ARG A 75 -13.819 4.737 -10.076 1.00 0.00 H new ATOM 0 HB2 ARG A 75 -16.763 5.416 -10.258 1.00 0.00 H new ATOM 0 HB3 ARG A 75 -15.514 6.636 -10.410 1.00 0.00 H new ATOM 0 HG2 ARG A 75 -14.534 5.352 -12.323 1.00 0.00 H new ATOM 0 HG3 ARG A 75 -15.846 4.198 -12.192 1.00 0.00 H new ATOM 0 HD2 ARG A 75 -16.274 7.176 -12.627 1.00 0.00 H new ATOM 0 HD3 ARG A 75 -16.158 6.018 -13.937 1.00 0.00 H new ATOM 0 HE ARG A 75 -18.210 4.942 -13.125 1.00 0.00 H new ATOM 0 HH11 ARG A 75 -17.385 8.083 -11.723 1.00 0.00 H new ATOM 0 HH12 ARG A 75 -19.042 8.413 -11.204 1.00 0.00 H new ATOM 0 HH21 ARG A 75 -20.329 5.377 -12.454 1.00 0.00 H new ATOM 0 HH22 ARG A 75 -20.700 6.887 -11.616 1.00 0.00 H new ATOM 1229 N ILE A 76 -13.560 5.877 -7.925 1.00 0.00 N ATOM 1230 CA ILE A 76 -13.332 6.542 -6.655 1.00 0.00 C ATOM 1231 C ILE A 76 -13.213 8.050 -6.879 1.00 0.00 C ATOM 1232 O ILE A 76 -12.292 8.516 -7.553 1.00 0.00 O ATOM 1233 CB ILE A 76 -12.054 6.014 -5.975 1.00 0.00 C ATOM 1234 CG1 ILE A 76 -12.157 4.499 -5.796 1.00 0.00 C ATOM 1235 CG2 ILE A 76 -11.833 6.700 -4.631 1.00 0.00 C ATOM 1236 CD1 ILE A 76 -10.907 3.875 -5.237 1.00 0.00 C ATOM 0 H ILE A 76 -12.730 5.801 -8.512 1.00 0.00 H new ATOM 0 HA ILE A 76 -14.178 6.333 -6.001 1.00 0.00 H new ATOM 0 HB ILE A 76 -11.197 6.240 -6.610 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -12.993 4.275 -5.133 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -12.383 4.042 -6.759 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -10.925 6.312 -4.169 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -11.731 7.775 -4.783 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -12.684 6.505 -3.979 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -11.051 2.799 -5.136 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -10.072 4.068 -5.910 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -10.692 4.305 -4.259 1.00 0.00 H new ATOM 1248 N ILE A 77 -14.149 8.810 -6.319 1.00 0.00 N ATOM 1249 CA ILE A 77 -14.147 10.260 -6.479 1.00 0.00 C ATOM 1250 C ILE A 77 -13.964 10.955 -5.133 1.00 0.00 C ATOM 1251 O ILE A 77 -14.707 10.700 -4.185 1.00 0.00 O ATOM 1252 CB ILE A 77 -15.449 10.763 -7.143 1.00 0.00 C ATOM 1253 CG1 ILE A 77 -15.753 9.958 -8.410 1.00 0.00 C ATOM 1254 CG2 ILE A 77 -15.346 12.247 -7.478 1.00 0.00 C ATOM 1255 CD1 ILE A 77 -16.922 9.010 -8.258 1.00 0.00 C ATOM 0 H ILE A 77 -14.916 8.448 -5.752 1.00 0.00 H new ATOM 0 HA ILE A 77 -13.309 10.507 -7.130 1.00 0.00 H new ATOM 0 HB ILE A 77 -16.265 10.623 -6.435 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -15.959 10.648 -9.228 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -14.867 9.388 -8.690 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -16.273 12.580 -7.944 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -15.175 12.815 -6.564 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -14.516 12.408 -8.166 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -17.079 8.474 -9.194 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -16.711 8.296 -7.462 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -17.820 9.576 -8.009 1.00 0.00 H new ATOM 1267 N GLY A 78 -12.964 11.826 -5.056 1.00 0.00 N ATOM 1268 CA GLY A 78 -12.691 12.543 -3.827 1.00 0.00 C ATOM 1269 C GLY A 78 -11.355 13.251 -3.880 1.00 0.00 C ATOM 1270 O GLY A 78 -10.799 13.448 -4.960 1.00 0.00 O ATOM 0 H GLY A 78 -12.335 12.048 -5.828 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -13.482 13.271 -3.646 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -12.701 11.846 -2.989 1.00 0.00 H new ATOM 1274 N ASP A 79 -10.834 13.633 -2.719 1.00 0.00 N ATOM 1275 CA ASP A 79 -9.544 14.312 -2.660 1.00 0.00 C ATOM 1276 C ASP A 79 -8.418 13.288 -2.709 1.00 0.00 C ATOM 1277 O ASP A 79 -8.071 12.683 -1.696 1.00 0.00 O ATOM 1278 CB ASP A 79 -9.436 15.153 -1.384 1.00 0.00 C ATOM 1279 CG ASP A 79 -8.124 15.905 -1.297 1.00 0.00 C ATOM 1280 OD1 ASP A 79 -7.892 16.791 -2.145 1.00 0.00 O ATOM 1281 OD2 ASP A 79 -7.327 15.608 -0.382 1.00 0.00 O ATOM 0 H ASP A 79 -11.280 13.486 -1.814 1.00 0.00 H new ATOM 0 HA ASP A 79 -9.460 14.978 -3.519 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -10.262 15.864 -1.350 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -9.538 14.504 -0.514 1.00 0.00 H new ATOM 1286 N LEU A 80 -7.843 13.107 -3.892 1.00 0.00 N ATOM 1287 CA LEU A 80 -6.768 12.138 -4.079 1.00 0.00 C ATOM 1288 C LEU A 80 -5.405 12.739 -3.767 1.00 0.00 C ATOM 1289 O LEU A 80 -4.394 12.041 -3.791 1.00 0.00 O ATOM 1290 CB LEU A 80 -6.762 11.615 -5.516 1.00 0.00 C ATOM 1291 CG LEU A 80 -8.035 10.905 -5.973 1.00 0.00 C ATOM 1292 CD1 LEU A 80 -7.920 10.528 -7.440 1.00 0.00 C ATOM 1293 CD2 LEU A 80 -8.297 9.670 -5.122 1.00 0.00 C ATOM 0 H LEU A 80 -8.102 13.618 -4.736 1.00 0.00 H new ATOM 0 HA LEU A 80 -6.954 11.318 -3.385 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -6.576 12.454 -6.187 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -5.925 10.926 -5.628 1.00 0.00 H new ATOM 0 HG LEU A 80 -8.878 11.585 -5.850 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -8.832 10.022 -7.758 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -7.777 11.429 -8.037 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -7.068 9.862 -7.579 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -9.208 9.179 -5.464 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -7.457 8.981 -5.213 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -8.413 9.965 -4.079 1.00 0.00 H new ATOM 1305 N SER A 81 -5.374 14.037 -3.500 1.00 0.00 N ATOM 1306 CA SER A 81 -4.125 14.719 -3.183 1.00 0.00 C ATOM 1307 C SER A 81 -3.591 14.256 -1.825 1.00 0.00 C ATOM 1308 O SER A 81 -2.414 14.430 -1.512 1.00 0.00 O ATOM 1309 CB SER A 81 -4.332 16.232 -3.197 1.00 0.00 C ATOM 1310 OG SER A 81 -4.811 16.664 -4.461 1.00 0.00 O ATOM 0 H SER A 81 -6.197 14.639 -3.496 1.00 0.00 H new ATOM 0 HA SER A 81 -3.385 14.465 -3.942 1.00 0.00 H new ATOM 0 HB2 SER A 81 -5.041 16.514 -2.419 1.00 0.00 H new ATOM 0 HB3 SER A 81 -3.392 16.734 -2.968 1.00 0.00 H new ATOM 0 HG SER A 81 -4.938 17.636 -4.448 1.00 0.00 H new ATOM 1316 N ASN A 82 -4.482 13.689 -1.017 1.00 0.00 N ATOM 1317 CA ASN A 82 -4.114 13.164 0.292 1.00 0.00 C ATOM 1318 C ASN A 82 -3.694 11.704 0.142 1.00 0.00 C ATOM 1319 O ASN A 82 -4.481 10.866 -0.306 1.00 0.00 O ATOM 1320 CB ASN A 82 -5.285 13.295 1.269 1.00 0.00 C ATOM 1321 CG ASN A 82 -4.918 12.939 2.703 1.00 0.00 C ATOM 1322 OD1 ASN A 82 -3.916 12.274 2.965 1.00 0.00 O ATOM 1323 ND2 ASN A 82 -5.736 13.386 3.648 1.00 0.00 N ATOM 0 H ASN A 82 -5.470 13.582 -1.249 1.00 0.00 H new ATOM 0 HA ASN A 82 -3.279 13.738 0.695 1.00 0.00 H new ATOM 0 HB2 ASN A 82 -5.659 14.318 1.241 1.00 0.00 H new ATOM 0 HB3 ASN A 82 -6.098 12.649 0.939 1.00 0.00 H new ATOM 0 HD21 ASN A 82 -5.543 13.181 4.628 1.00 0.00 H new ATOM 0 HD22 ASN A 82 -6.558 13.935 3.394 1.00 0.00 H new ATOM 1330 N ARG A 83 -2.451 11.411 0.518 1.00 0.00 N ATOM 1331 CA ARG A 83 -1.910 10.058 0.396 1.00 0.00 C ATOM 1332 C ARG A 83 -2.716 9.046 1.208 1.00 0.00 C ATOM 1333 O ARG A 83 -2.872 7.903 0.780 1.00 0.00 O ATOM 1334 CB ARG A 83 -0.433 10.015 0.799 1.00 0.00 C ATOM 1335 CG ARG A 83 0.501 10.674 -0.205 1.00 0.00 C ATOM 1336 CD ARG A 83 1.114 11.947 0.355 1.00 0.00 C ATOM 1337 NE ARG A 83 0.256 13.107 0.126 1.00 0.00 N ATOM 1338 CZ ARG A 83 0.347 14.243 0.809 1.00 0.00 C ATOM 1339 NH1 ARG A 83 1.256 14.374 1.767 1.00 0.00 N ATOM 1340 NH2 ARG A 83 -0.473 15.246 0.529 1.00 0.00 N ATOM 0 H ARG A 83 -1.800 12.091 0.909 1.00 0.00 H new ATOM 0 HA ARG A 83 -1.990 9.777 -0.654 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -0.316 10.506 1.765 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -0.133 8.975 0.931 1.00 0.00 H new ATOM 0 HG2 ARG A 83 1.293 9.977 -0.478 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -0.049 10.905 -1.118 1.00 0.00 H new ATOM 0 HD2 ARG A 83 1.286 11.828 1.425 1.00 0.00 H new ATOM 0 HD3 ARG A 83 2.086 12.117 -0.108 1.00 0.00 H new ATOM 0 HE ARG A 83 -0.456 13.041 -0.602 1.00 0.00 H new ATOM 0 HH11 ARG A 83 1.887 13.601 1.980 1.00 0.00 H new ATOM 0 HH12 ARG A 83 1.324 15.247 2.290 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -1.170 15.144 -0.208 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -0.407 16.120 1.051 1.00 0.00 H new ATOM 1354 N GLU A 84 -3.225 9.451 2.369 1.00 0.00 N ATOM 1355 CA GLU A 84 -4.014 8.544 3.200 1.00 0.00 C ATOM 1356 C GLU A 84 -5.262 8.043 2.480 1.00 0.00 C ATOM 1357 O GLU A 84 -5.550 6.852 2.524 1.00 0.00 O ATOM 1358 CB GLU A 84 -4.416 9.220 4.510 1.00 0.00 C ATOM 1359 CG GLU A 84 -3.265 9.366 5.489 1.00 0.00 C ATOM 1360 CD GLU A 84 -3.611 10.241 6.678 1.00 0.00 C ATOM 1361 OE1 GLU A 84 -4.621 10.974 6.605 1.00 0.00 O ATOM 1362 OE2 GLU A 84 -2.873 10.193 7.683 1.00 0.00 O ATOM 0 H GLU A 84 -3.108 10.389 2.753 1.00 0.00 H new ATOM 0 HA GLU A 84 -3.380 7.684 3.415 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -4.825 10.206 4.291 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -5.212 8.642 4.980 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -2.969 8.379 5.844 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -2.405 9.789 4.971 1.00 0.00 H new ATOM 1369 N LYS A 85 -5.993 8.927 1.801 1.00 0.00 N ATOM 1370 CA LYS A 85 -7.193 8.491 1.085 1.00 0.00 C ATOM 1371 C LYS A 85 -6.838 7.531 -0.042 1.00 0.00 C ATOM 1372 O LYS A 85 -7.534 6.538 -0.252 1.00 0.00 O ATOM 1373 CB LYS A 85 -8.002 9.668 0.539 1.00 0.00 C ATOM 1374 CG LYS A 85 -8.737 10.477 1.592 1.00 0.00 C ATOM 1375 CD LYS A 85 -9.510 11.616 0.942 1.00 0.00 C ATOM 1376 CE LYS A 85 -10.292 12.423 1.967 1.00 0.00 C ATOM 1377 NZ LYS A 85 -9.399 13.088 2.955 1.00 0.00 N ATOM 0 H LYS A 85 -5.784 9.923 1.731 1.00 0.00 H new ATOM 0 HA LYS A 85 -7.818 7.970 1.810 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -7.330 10.331 -0.005 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -8.728 9.289 -0.181 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -9.422 9.832 2.143 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -8.026 10.877 2.314 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -8.817 12.272 0.415 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -10.196 11.212 0.197 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -10.890 13.177 1.455 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -10.987 11.767 2.491 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -9.955 13.745 3.538 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -8.961 12.369 3.566 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -8.656 13.615 2.452 1.00 0.00 H new ATOM 1391 N VAL A 86 -5.764 7.821 -0.765 1.00 0.00 N ATOM 1392 CA VAL A 86 -5.328 6.948 -1.845 1.00 0.00 C ATOM 1393 C VAL A 86 -4.910 5.581 -1.296 1.00 0.00 C ATOM 1394 O VAL A 86 -5.314 4.544 -1.820 1.00 0.00 O ATOM 1395 CB VAL A 86 -4.171 7.583 -2.653 1.00 0.00 C ATOM 1396 CG1 VAL A 86 -3.590 6.589 -3.647 1.00 0.00 C ATOM 1397 CG2 VAL A 86 -4.670 8.827 -3.372 1.00 0.00 C ATOM 0 H VAL A 86 -5.183 8.648 -0.624 1.00 0.00 H new ATOM 0 HA VAL A 86 -6.172 6.811 -2.522 1.00 0.00 H new ATOM 0 HB VAL A 86 -3.377 7.865 -1.962 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -2.779 7.061 -4.202 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -3.206 5.721 -3.111 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -4.368 6.272 -4.342 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -3.853 9.271 -3.940 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -5.478 8.555 -4.051 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -5.037 9.547 -2.641 1.00 0.00 H new ATOM 1407 N LEU A 87 -4.122 5.591 -0.222 1.00 0.00 N ATOM 1408 CA LEU A 87 -3.659 4.362 0.415 1.00 0.00 C ATOM 1409 C LEU A 87 -4.818 3.565 1.017 1.00 0.00 C ATOM 1410 O LEU A 87 -4.918 2.357 0.805 1.00 0.00 O ATOM 1411 CB LEU A 87 -2.621 4.700 1.488 1.00 0.00 C ATOM 1412 CG LEU A 87 -2.162 3.533 2.359 1.00 0.00 C ATOM 1413 CD1 LEU A 87 -1.471 2.464 1.526 1.00 0.00 C ATOM 1414 CD2 LEU A 87 -1.248 4.033 3.469 1.00 0.00 C ATOM 0 H LEU A 87 -3.789 6.444 0.227 1.00 0.00 H new ATOM 0 HA LEU A 87 -3.199 3.734 -0.348 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -1.747 5.129 0.999 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -3.035 5.472 2.137 1.00 0.00 H new ATOM 0 HG LEU A 87 -3.042 3.078 2.813 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -1.155 1.646 2.173 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -2.163 2.085 0.774 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -0.599 2.894 1.033 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -0.927 3.191 4.083 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -0.375 4.516 3.031 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -1.787 4.750 4.089 1.00 0.00 H new ATOM 1426 N ILE A 88 -5.688 4.241 1.760 1.00 0.00 N ATOM 1427 CA ILE A 88 -6.830 3.585 2.391 1.00 0.00 C ATOM 1428 C ILE A 88 -7.780 2.981 1.352 1.00 0.00 C ATOM 1429 O ILE A 88 -8.197 1.827 1.482 1.00 0.00 O ATOM 1430 CB ILE A 88 -7.581 4.563 3.320 1.00 0.00 C ATOM 1431 CG1 ILE A 88 -6.707 4.868 4.541 1.00 0.00 C ATOM 1432 CG2 ILE A 88 -8.931 3.993 3.746 1.00 0.00 C ATOM 1433 CD1 ILE A 88 -7.173 6.055 5.353 1.00 0.00 C ATOM 0 H ILE A 88 -5.625 5.243 1.941 1.00 0.00 H new ATOM 0 HA ILE A 88 -6.444 2.765 2.997 1.00 0.00 H new ATOM 0 HB ILE A 88 -7.778 5.488 2.777 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -6.681 3.989 5.185 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -5.685 5.049 4.207 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -9.436 4.704 4.399 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -9.544 3.812 2.863 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -8.778 3.055 4.280 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -6.501 6.204 6.198 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -7.171 6.947 4.727 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -8.183 5.871 5.720 1.00 0.00 H new ATOM 1445 N ALA A 89 -8.112 3.756 0.319 1.00 0.00 N ATOM 1446 CA ALA A 89 -9.005 3.280 -0.737 1.00 0.00 C ATOM 1447 C ALA A 89 -8.396 2.099 -1.492 1.00 0.00 C ATOM 1448 O ALA A 89 -9.091 1.135 -1.810 1.00 0.00 O ATOM 1449 CB ALA A 89 -9.356 4.408 -1.693 1.00 0.00 C ATOM 0 H ALA A 89 -7.778 4.711 0.191 1.00 0.00 H new ATOM 0 HA ALA A 89 -9.923 2.932 -0.264 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -10.021 4.032 -2.471 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -9.854 5.208 -1.145 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -8.445 4.794 -2.150 1.00 0.00 H new ATOM 1455 N LEU A 90 -7.094 2.178 -1.768 1.00 0.00 N ATOM 1456 CA LEU A 90 -6.390 1.109 -2.478 1.00 0.00 C ATOM 1457 C LEU A 90 -6.330 -0.156 -1.622 1.00 0.00 C ATOM 1458 O LEU A 90 -6.473 -1.269 -2.136 1.00 0.00 O ATOM 1459 CB LEU A 90 -4.972 1.557 -2.867 1.00 0.00 C ATOM 1460 CG LEU A 90 -4.808 2.125 -4.283 1.00 0.00 C ATOM 1461 CD1 LEU A 90 -5.940 3.082 -4.634 1.00 0.00 C ATOM 1462 CD2 LEU A 90 -3.466 2.828 -4.401 1.00 0.00 C ATOM 0 H LEU A 90 -6.505 2.970 -1.511 1.00 0.00 H new ATOM 0 HA LEU A 90 -6.944 0.885 -3.390 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -4.643 2.313 -2.154 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -4.301 0.705 -2.759 1.00 0.00 H new ATOM 0 HG LEU A 90 -4.846 1.296 -4.990 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -5.792 3.466 -5.644 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -6.892 2.554 -4.582 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -5.947 3.912 -3.928 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -3.353 3.230 -5.408 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -3.417 3.642 -3.678 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -2.664 2.117 -4.202 1.00 0.00 H new ATOM 1474 N ARG A 91 -6.119 0.021 -0.316 1.00 0.00 N ATOM 1475 CA ARG A 91 -6.049 -1.098 0.623 1.00 0.00 C ATOM 1476 C ARG A 91 -7.387 -1.833 0.698 1.00 0.00 C ATOM 1477 O ARG A 91 -7.429 -3.065 0.671 1.00 0.00 O ATOM 1478 CB ARG A 91 -5.647 -0.594 2.014 1.00 0.00 C ATOM 1479 CG ARG A 91 -5.495 -1.697 3.049 1.00 0.00 C ATOM 1480 CD ARG A 91 -4.916 -1.164 4.351 1.00 0.00 C ATOM 1481 NE ARG A 91 -3.530 -0.729 4.195 1.00 0.00 N ATOM 1482 CZ ARG A 91 -2.816 -0.172 5.170 1.00 0.00 C ATOM 1483 NH1 ARG A 91 -3.357 0.017 6.367 1.00 0.00 N ATOM 1484 NH2 ARG A 91 -1.560 0.195 4.947 1.00 0.00 N ATOM 0 H ARG A 91 -5.993 0.936 0.117 1.00 0.00 H new ATOM 0 HA ARG A 91 -5.294 -1.798 0.264 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -4.705 -0.051 1.935 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -6.396 0.117 2.363 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -6.466 -2.153 3.241 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -4.847 -2.480 2.655 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -5.521 -0.328 4.702 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -4.969 -1.939 5.116 1.00 0.00 H new ATOM 0 HE ARG A 91 -3.084 -0.860 3.287 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -4.322 -0.265 6.541 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -2.808 0.444 7.113 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -1.142 0.050 4.028 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -1.013 0.622 5.695 1.00 0.00 H new ATOM 1498 N LEU A 92 -8.477 -1.072 0.794 1.00 0.00 N ATOM 1499 CA LEU A 92 -9.815 -1.655 0.865 1.00 0.00 C ATOM 1500 C LEU A 92 -10.145 -2.424 -0.412 1.00 0.00 C ATOM 1501 O LEU A 92 -10.759 -3.492 -0.358 1.00 0.00 O ATOM 1502 CB LEU A 92 -10.866 -0.571 1.118 1.00 0.00 C ATOM 1503 CG LEU A 92 -10.823 0.064 2.511 1.00 0.00 C ATOM 1504 CD1 LEU A 92 -11.751 1.268 2.576 1.00 0.00 C ATOM 1505 CD2 LEU A 92 -11.197 -0.956 3.577 1.00 0.00 C ATOM 0 H LEU A 92 -8.459 -0.053 0.824 1.00 0.00 H new ATOM 0 HA LEU A 92 -9.830 -2.355 1.700 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -10.741 0.215 0.373 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -11.855 -1.002 0.963 1.00 0.00 H new ATOM 0 HG LEU A 92 -9.805 0.402 2.703 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -11.708 1.707 3.573 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -11.439 2.008 1.840 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -12.772 0.952 2.362 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -11.161 -0.485 4.560 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -12.205 -1.326 3.389 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -10.494 -1.788 3.547 1.00 0.00 H new ATOM 1517 N LEU A 93 -9.742 -1.877 -1.557 1.00 0.00 N ATOM 1518 CA LEU A 93 -9.985 -2.532 -2.838 1.00 0.00 C ATOM 1519 C LEU A 93 -9.208 -3.845 -2.925 1.00 0.00 C ATOM 1520 O LEU A 93 -9.719 -4.850 -3.420 1.00 0.00 O ATOM 1521 CB LEU A 93 -9.577 -1.627 -4.004 1.00 0.00 C ATOM 1522 CG LEU A 93 -10.458 -0.399 -4.228 1.00 0.00 C ATOM 1523 CD1 LEU A 93 -9.828 0.515 -5.267 1.00 0.00 C ATOM 1524 CD2 LEU A 93 -11.859 -0.813 -4.660 1.00 0.00 C ATOM 0 H LEU A 93 -9.248 -0.987 -1.623 1.00 0.00 H new ATOM 0 HA LEU A 93 -11.053 -2.737 -2.906 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -8.553 -1.292 -3.839 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -9.574 -2.221 -4.918 1.00 0.00 H new ATOM 0 HG LEU A 93 -10.540 0.145 -3.287 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -10.465 1.387 -5.419 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -8.847 0.838 -4.920 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -9.721 -0.024 -6.208 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -12.470 0.076 -4.814 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -11.801 -1.379 -5.590 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -12.310 -1.433 -3.886 1.00 0.00 H new ATOM 1536 N ALA A 94 -7.970 -3.821 -2.427 1.00 0.00 N ATOM 1537 CA ALA A 94 -7.095 -4.993 -2.455 1.00 0.00 C ATOM 1538 C ALA A 94 -7.657 -6.138 -1.630 1.00 0.00 C ATOM 1539 O ALA A 94 -7.542 -7.302 -2.019 1.00 0.00 O ATOM 1540 CB ALA A 94 -5.693 -4.631 -1.993 1.00 0.00 C ATOM 0 H ALA A 94 -7.550 -2.997 -1.997 1.00 0.00 H new ATOM 0 HA ALA A 94 -7.040 -5.334 -3.489 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -5.060 -5.518 -2.022 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -5.279 -3.868 -2.652 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -5.734 -4.247 -0.974 1.00 0.00 H new ATOM 1546 N GLU A 95 -8.255 -5.812 -0.489 1.00 0.00 N ATOM 1547 CA GLU A 95 -8.844 -6.824 0.376 1.00 0.00 C ATOM 1548 C GLU A 95 -9.967 -7.548 -0.360 1.00 0.00 C ATOM 1549 O GLU A 95 -10.129 -8.762 -0.228 1.00 0.00 O ATOM 1550 CB GLU A 95 -9.383 -6.175 1.653 1.00 0.00 C ATOM 1551 CG GLU A 95 -8.295 -5.658 2.585 1.00 0.00 C ATOM 1552 CD GLU A 95 -7.349 -6.748 3.051 1.00 0.00 C ATOM 1553 OE1 GLU A 95 -7.838 -7.801 3.512 1.00 0.00 O ATOM 1554 OE2 GLU A 95 -6.121 -6.549 2.954 1.00 0.00 O ATOM 0 H GLU A 95 -8.344 -4.856 -0.143 1.00 0.00 H new ATOM 0 HA GLU A 95 -8.076 -7.548 0.648 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -10.038 -5.348 1.380 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -9.993 -6.902 2.189 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -7.724 -4.883 2.074 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -8.759 -5.191 3.454 1.00 0.00 H new ATOM 1561 N GLU A 96 -10.738 -6.786 -1.131 1.00 0.00 N ATOM 1562 CA GLU A 96 -11.834 -7.340 -1.917 1.00 0.00 C ATOM 1563 C GLU A 96 -11.300 -8.303 -2.972 1.00 0.00 C ATOM 1564 O GLU A 96 -11.888 -9.350 -3.224 1.00 0.00 O ATOM 1565 CB GLU A 96 -12.604 -6.214 -2.608 1.00 0.00 C ATOM 1566 CG GLU A 96 -13.413 -5.348 -1.652 1.00 0.00 C ATOM 1567 CD GLU A 96 -14.001 -4.123 -2.324 1.00 0.00 C ATOM 1568 OE1 GLU A 96 -13.549 -3.779 -3.437 1.00 0.00 O ATOM 1569 OE2 GLU A 96 -14.915 -3.508 -1.737 1.00 0.00 O ATOM 0 H GLU A 96 -10.622 -5.777 -1.228 1.00 0.00 H new ATOM 0 HA GLU A 96 -12.500 -7.880 -1.244 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -11.899 -5.582 -3.148 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -13.276 -6.647 -3.349 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -14.219 -5.944 -1.223 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -12.775 -5.033 -0.826 1.00 0.00 H new ATOM 1576 N ILE A 97 -10.188 -7.918 -3.589 1.00 0.00 N ATOM 1577 CA ILE A 97 -9.543 -8.725 -4.619 1.00 0.00 C ATOM 1578 C ILE A 97 -8.992 -10.021 -4.025 1.00 0.00 C ATOM 1579 O ILE A 97 -9.171 -11.103 -4.586 1.00 0.00 O ATOM 1580 CB ILE A 97 -8.413 -7.919 -5.292 1.00 0.00 C ATOM 1581 CG1 ILE A 97 -9.026 -6.706 -5.987 1.00 0.00 C ATOM 1582 CG2 ILE A 97 -7.632 -8.772 -6.291 1.00 0.00 C ATOM 1583 CD1 ILE A 97 -8.015 -5.690 -6.435 1.00 0.00 C ATOM 0 H ILE A 97 -9.709 -7.040 -3.390 1.00 0.00 H new ATOM 0 HA ILE A 97 -10.287 -8.985 -5.372 1.00 0.00 H new ATOM 0 HB ILE A 97 -7.706 -7.594 -4.529 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -9.596 -7.044 -6.853 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -9.732 -6.228 -5.308 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -6.844 -8.171 -6.745 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -7.187 -9.622 -5.774 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -8.307 -9.132 -7.067 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -8.526 -4.858 -6.920 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -7.461 -5.322 -5.571 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -7.323 -6.151 -7.140 1.00 0.00 H new ATOM 1595 N GLY A 98 -8.320 -9.893 -2.881 1.00 0.00 N ATOM 1596 CA GLY A 98 -7.757 -11.048 -2.204 1.00 0.00 C ATOM 1597 C GLY A 98 -8.815 -12.031 -1.736 1.00 0.00 C ATOM 1598 O GLY A 98 -8.602 -13.242 -1.766 1.00 0.00 O ATOM 0 H GLY A 98 -8.156 -9.003 -2.410 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -7.067 -11.557 -2.877 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -7.175 -10.712 -1.346 1.00 0.00 H new ATOM 1602 N ASP A 99 -9.958 -11.508 -1.300 1.00 0.00 N ATOM 1603 CA ASP A 99 -11.050 -12.349 -0.820 1.00 0.00 C ATOM 1604 C ASP A 99 -12.197 -12.395 -1.829 1.00 0.00 C ATOM 1605 O ASP A 99 -13.369 -12.433 -1.452 1.00 0.00 O ATOM 1606 CB ASP A 99 -11.561 -11.834 0.529 1.00 0.00 C ATOM 1607 CG ASP A 99 -12.272 -12.907 1.332 1.00 0.00 C ATOM 1608 OD1 ASP A 99 -12.022 -14.104 1.077 1.00 0.00 O ATOM 1609 OD2 ASP A 99 -13.074 -12.550 2.220 1.00 0.00 O ATOM 0 H ASP A 99 -10.152 -10.507 -1.269 1.00 0.00 H new ATOM 0 HA ASP A 99 -10.665 -13.361 -0.696 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -10.722 -11.448 1.108 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -12.242 -11.000 0.361 1.00 0.00 H new ATOM 1614 N TYR A 100 -11.855 -12.381 -3.113 1.00 0.00 N ATOM 1615 CA TYR A 100 -12.856 -12.432 -4.167 1.00 0.00 C ATOM 1616 C TYR A 100 -13.174 -13.878 -4.525 1.00 0.00 C ATOM 1617 O TYR A 100 -12.302 -14.631 -4.962 1.00 0.00 O ATOM 1618 CB TYR A 100 -12.364 -11.675 -5.408 1.00 0.00 C ATOM 1619 CG TYR A 100 -13.348 -11.677 -6.559 1.00 0.00 C ATOM 1620 CD1 TYR A 100 -14.455 -10.836 -6.554 1.00 0.00 C ATOM 1621 CD2 TYR A 100 -13.169 -12.516 -7.652 1.00 0.00 C ATOM 1622 CE1 TYR A 100 -15.355 -10.835 -7.603 1.00 0.00 C ATOM 1623 CE2 TYR A 100 -14.064 -12.519 -8.705 1.00 0.00 C ATOM 1624 CZ TYR A 100 -15.155 -11.678 -8.675 1.00 0.00 C ATOM 1625 OH TYR A 100 -16.048 -11.680 -9.721 1.00 0.00 O ATOM 0 H TYR A 100 -10.892 -12.335 -3.447 1.00 0.00 H new ATOM 0 HA TYR A 100 -13.766 -11.953 -3.804 1.00 0.00 H new ATOM 0 HB2 TYR A 100 -12.147 -10.644 -5.130 1.00 0.00 H new ATOM 0 HB3 TYR A 100 -11.426 -12.118 -5.744 1.00 0.00 H new ATOM 0 HD1 TYR A 100 -14.614 -10.173 -5.717 1.00 0.00 H new ATOM 0 HD2 TYR A 100 -12.316 -13.177 -7.679 1.00 0.00 H new ATOM 0 HE1 TYR A 100 -16.211 -10.177 -7.583 1.00 0.00 H new ATOM 0 HE2 TYR A 100 -13.909 -13.177 -9.547 1.00 0.00 H new ATOM 0 HH TYR A 100 -15.761 -12.330 -10.395 1.00 0.00 H new ATOM 1635 N LYS A 101 -14.425 -14.256 -4.331 1.00 0.00 N ATOM 1636 CA LYS A 101 -14.873 -15.610 -4.632 1.00 0.00 C ATOM 1637 C LYS A 101 -15.823 -15.610 -5.826 1.00 0.00 C ATOM 1638 O LYS A 101 -16.633 -14.696 -5.987 1.00 0.00 O ATOM 1639 CB LYS A 101 -15.568 -16.227 -3.414 1.00 0.00 C ATOM 1640 CG LYS A 101 -14.651 -16.408 -2.214 1.00 0.00 C ATOM 1641 CD LYS A 101 -15.389 -17.024 -1.036 1.00 0.00 C ATOM 1642 CE LYS A 101 -14.472 -17.201 0.162 1.00 0.00 C ATOM 1643 NZ LYS A 101 -15.185 -17.798 1.326 1.00 0.00 N ATOM 0 H LYS A 101 -15.154 -13.644 -3.965 1.00 0.00 H new ATOM 0 HA LYS A 101 -13.997 -16.209 -4.881 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -16.408 -15.594 -3.126 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -15.981 -17.196 -3.694 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -13.810 -17.044 -2.490 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -14.238 -15.443 -1.921 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -16.231 -16.390 -0.761 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -15.800 -17.991 -1.327 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -13.632 -17.839 -0.115 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -14.057 -16.234 0.447 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -14.524 -17.902 2.122 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -15.971 -17.177 1.607 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -15.559 -18.732 1.062 1.00 0.00 H new ATOM 1657 N ASP A 102 -15.720 -16.638 -6.661 1.00 0.00 N ATOM 1658 CA ASP A 102 -16.574 -16.752 -7.839 1.00 0.00 C ATOM 1659 C ASP A 102 -17.848 -17.521 -7.504 1.00 0.00 C ATOM 1660 O ASP A 102 -17.830 -18.747 -7.390 1.00 0.00 O ATOM 1661 CB ASP A 102 -15.825 -17.452 -8.978 1.00 0.00 C ATOM 1662 CG ASP A 102 -16.618 -17.471 -10.271 1.00 0.00 C ATOM 1663 OD1 ASP A 102 -17.502 -16.603 -10.441 1.00 0.00 O ATOM 1664 OD2 ASP A 102 -16.354 -18.353 -11.114 1.00 0.00 O ATOM 0 H ASP A 102 -15.055 -17.403 -6.545 1.00 0.00 H new ATOM 0 HA ASP A 102 -16.846 -15.747 -8.162 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -14.874 -16.947 -9.147 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -15.595 -18.475 -8.682 1.00 0.00 H new ATOM 1669 N ASP A 103 -18.950 -16.797 -7.350 1.00 0.00 N ATOM 1670 CA ASP A 103 -20.231 -17.418 -7.030 1.00 0.00 C ATOM 1671 C ASP A 103 -20.990 -17.780 -8.302 1.00 0.00 C ATOM 1672 O ASP A 103 -21.572 -16.916 -8.955 1.00 0.00 O ATOM 1673 CB ASP A 103 -21.080 -16.482 -6.164 1.00 0.00 C ATOM 1674 CG ASP A 103 -22.403 -17.104 -5.769 1.00 0.00 C ATOM 1675 OD1 ASP A 103 -22.388 -18.147 -5.083 1.00 0.00 O ATOM 1676 OD2 ASP A 103 -23.456 -16.550 -6.146 1.00 0.00 O ATOM 0 H ASP A 103 -18.983 -15.782 -7.441 1.00 0.00 H new ATOM 0 HA ASP A 103 -20.032 -18.333 -6.471 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -20.523 -16.218 -5.265 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -21.265 -15.556 -6.708 1.00 0.00 H new ATOM 1681 N ASP A 104 -20.982 -19.063 -8.647 1.00 0.00 N ATOM 1682 CA ASP A 104 -21.674 -19.540 -9.845 1.00 0.00 C ATOM 1683 C ASP A 104 -23.067 -20.078 -9.514 1.00 0.00 C ATOM 1684 O ASP A 104 -23.733 -20.653 -10.378 1.00 0.00 O ATOM 1685 CB ASP A 104 -20.843 -20.613 -10.570 1.00 0.00 C ATOM 1686 CG ASP A 104 -20.590 -21.864 -9.739 1.00 0.00 C ATOM 1687 OD1 ASP A 104 -20.971 -21.888 -8.548 1.00 0.00 O ATOM 1688 OD2 ASP A 104 -20.000 -22.820 -10.284 1.00 0.00 O ATOM 0 H ASP A 104 -20.506 -19.793 -8.117 1.00 0.00 H new ATOM 0 HA ASP A 104 -21.795 -18.686 -10.511 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -21.356 -20.897 -11.489 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -19.885 -20.182 -10.860 1.00 0.00 H new ATOM 1693 N ASP A 105 -23.487 -19.885 -8.257 1.00 0.00 N ATOM 1694 CA ASP A 105 -24.800 -20.330 -7.764 1.00 0.00 C ATOM 1695 C ASP A 105 -24.884 -21.856 -7.659 1.00 0.00 C ATOM 1696 O ASP A 105 -25.002 -22.401 -6.564 1.00 0.00 O ATOM 1697 CB ASP A 105 -25.935 -19.795 -8.646 1.00 0.00 C ATOM 1698 CG ASP A 105 -27.304 -20.069 -8.058 1.00 0.00 C ATOM 1699 OD1 ASP A 105 -27.594 -19.546 -6.962 1.00 0.00 O ATOM 1700 OD2 ASP A 105 -28.087 -20.805 -8.694 1.00 0.00 O ATOM 0 H ASP A 105 -22.924 -19.414 -7.549 1.00 0.00 H new ATOM 0 HA ASP A 105 -24.916 -19.919 -6.761 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -25.810 -18.721 -8.782 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -25.869 -20.251 -9.634 1.00 0.00 H new ATOM 1705 N LYS A 106 -24.826 -22.539 -8.796 1.00 0.00 N ATOM 1706 CA LYS A 106 -24.902 -23.996 -8.817 1.00 0.00 C ATOM 1707 C LYS A 106 -23.595 -24.598 -9.322 1.00 0.00 C ATOM 1708 O LYS A 106 -23.037 -24.058 -10.301 1.00 0.00 O ATOM 1709 CB LYS A 106 -26.065 -24.461 -9.699 1.00 0.00 C ATOM 1710 CG LYS A 106 -27.437 -24.114 -9.140 1.00 0.00 C ATOM 1711 CD LYS A 106 -28.551 -24.603 -10.053 1.00 0.00 C ATOM 1712 CE LYS A 106 -29.921 -24.232 -9.507 1.00 0.00 C ATOM 1713 NZ LYS A 106 -30.189 -24.875 -8.191 1.00 0.00 N ATOM 1714 OXT LYS A 106 -23.143 -25.605 -8.737 1.00 0.00 O ATOM 0 H LYS A 106 -24.727 -22.108 -9.715 1.00 0.00 H new ATOM 0 HA LYS A 106 -25.073 -24.339 -7.797 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -25.961 -24.012 -10.687 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -25.999 -25.541 -9.831 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -27.552 -24.561 -8.152 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -27.517 -23.034 -9.013 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -28.425 -24.172 -11.046 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -28.483 -25.685 -10.164 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -29.988 -23.149 -9.402 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -30.689 -24.532 -10.220 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -31.195 -24.766 -7.950 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -29.953 -25.886 -8.244 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -29.607 -24.422 -7.458 1.00 0.00 H new TER 1728 LYS A 106