USER MOD reduce.3.24.130724 H: found=0, std=0, add=835, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 814 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 Single : A 1 ARG N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 HIS : no HD1:sc= -2.93 X(o=-2.9,f=-3) USER MOD Single : A 13 HIS : no HD1:sc= -0.355 K(o=-0.35,f=-1.5) USER MOD Single : A 14 ASN : amide:sc= -0.432 K(o=-0.43,f=-2.3!) USER MOD Single : A 16 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 17 MET CE :methyl 147:sc= 0 (180deg=-1.23) USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 GLN : amide:sc= -0.0194 X(o=-0.019,f=0) USER MOD Single : A 22 THR OG1 : rot -48:sc= 0.874 USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 ASN : amide:sc= -0.981! C(o=-0.98!,f=-1.1!) USER MOD Single : A 31 ASN : amide:sc= -8.63! C(o=-8.6!,f=-19!) USER MOD Single : A 36 THR OG1 : rot 75:sc= 0.509 USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 ASN : amide:sc= -1.69 K(o=-1.7,f=-4.9!) USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ -151:sc= -0.17 (180deg=-0.859) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 HIS : no HD1:sc= -0.268 X(o=-0.27,f=-0.0022) USER MOD Single : A 53 LYS NZ :NH3+ 149:sc= -0.0434 (180deg=-1.3!) USER MOD Single : A 56 LYS NZ :NH3+ -164:sc=-0.00639 (180deg=-0.392) USER MOD Single : A 57 HIS : no HD1:sc= -1.92 K(o=-1.9,f=-2.8) USER MOD Single : A 58 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 66 HIS : no HD1:sc= -0.0366 X(o=-0.037,f=-0.16) USER MOD Single : A 67 GLN : amide:sc= -0.404 K(o=-0.4,f=-2.3!) USER MOD Single : A 70 SER OG : rot 180:sc= -0.0581 USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 75 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 81 GLN : amide:sc= -0.0173 X(o=-0.017,f=0) USER MOD Single : A 83 ASN : amide:sc= -0.678 K(o=-0.68,f=-7.4!) USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 THR OG1 : rot 58:sc= 0.199 USER MOD Single : A 92 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 1 66.474 -14.521 14.127 1.00 0.00 N ATOM 2 CA ARG A 1 65.357 -14.558 15.055 1.00 0.00 C ATOM 3 C ARG A 1 64.953 -13.138 15.457 1.00 0.00 C ATOM 4 O ARG A 1 65.376 -12.640 16.499 1.00 0.00 O ATOM 5 CB ARG A 1 65.711 -15.355 16.312 1.00 0.00 C ATOM 6 CG ARG A 1 64.464 -16.001 16.921 1.00 0.00 C ATOM 7 CD ARG A 1 64.707 -16.393 18.380 1.00 0.00 C ATOM 8 NE ARG A 1 64.682 -15.187 19.238 1.00 0.00 N ATOM 9 CZ ARG A 1 63.555 -14.531 19.588 1.00 0.00 C ATOM 10 NH1 ARG A 1 62.350 -14.958 19.154 1.00 0.00 N ATOM 11 NH2 ARG A 1 63.650 -13.464 20.360 1.00 0.00 N ATOM 0 H1 ARG A 1 66.738 -15.492 13.862 1.00 0.00 H new ATOM 0 H2 ARG A 1 66.200 -13.992 13.275 1.00 0.00 H new ATOM 0 H3 ARG A 1 67.285 -14.053 14.579 1.00 0.00 H new ATOM 0 HA ARG A 1 64.524 -15.048 14.551 1.00 0.00 H new ATOM 0 HB2 ARG A 1 66.440 -16.126 16.065 1.00 0.00 H new ATOM 0 HB3 ARG A 1 66.179 -14.697 17.044 1.00 0.00 H new ATOM 0 HG2 ARG A 1 63.625 -15.308 16.862 1.00 0.00 H new ATOM 0 HG3 ARG A 1 64.189 -16.884 16.344 1.00 0.00 H new ATOM 0 HD2 ARG A 1 63.944 -17.099 18.708 1.00 0.00 H new ATOM 0 HD3 ARG A 1 65.669 -16.897 18.475 1.00 0.00 H new ATOM 0 HE ARG A 1 65.571 -14.829 19.586 1.00 0.00 H new ATOM 0 HH11 ARG A 1 62.286 -15.782 18.557 1.00 0.00 H new ATOM 0 HH12 ARG A 1 61.504 -14.456 19.423 1.00 0.00 H new ATOM 0 HH21 ARG A 1 64.565 -13.147 20.682 1.00 0.00 H new ATOM 0 HH22 ARG A 1 62.809 -12.956 20.634 1.00 0.00 H new ATOM 24 N LYS A 2 64.139 -12.527 14.609 1.00 0.00 N ATOM 25 CA LYS A 2 63.673 -11.174 14.863 1.00 0.00 C ATOM 26 C LYS A 2 62.306 -11.229 15.546 1.00 0.00 C ATOM 27 O LYS A 2 61.403 -11.925 15.082 1.00 0.00 O ATOM 28 CB LYS A 2 63.682 -10.353 13.572 1.00 0.00 C ATOM 29 CG LYS A 2 64.312 -8.978 13.800 1.00 0.00 C ATOM 30 CD LYS A 2 65.006 -8.474 12.533 1.00 0.00 C ATOM 31 CE LYS A 2 65.777 -7.181 12.806 1.00 0.00 C ATOM 32 NZ LYS A 2 65.602 -6.228 11.688 1.00 0.00 N ATOM 0 H LYS A 2 63.790 -12.944 13.746 1.00 0.00 H new ATOM 0 HA LYS A 2 64.350 -10.660 15.546 1.00 0.00 H new ATOM 0 HB2 LYS A 2 64.237 -10.888 12.801 1.00 0.00 H new ATOM 0 HB3 LYS A 2 62.662 -10.233 13.206 1.00 0.00 H new ATOM 0 HG2 LYS A 2 63.543 -8.268 14.104 1.00 0.00 H new ATOM 0 HG3 LYS A 2 65.033 -9.035 14.615 1.00 0.00 H new ATOM 0 HD2 LYS A 2 65.689 -9.237 12.161 1.00 0.00 H new ATOM 0 HD3 LYS A 2 64.265 -8.302 11.753 1.00 0.00 H new ATOM 0 HE2 LYS A 2 65.426 -6.730 13.734 1.00 0.00 H new ATOM 0 HE3 LYS A 2 66.836 -7.403 12.940 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 66.132 -5.356 11.889 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 65.959 -6.655 10.809 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 64.593 -6.003 11.579 1.00 0.00 H new ATOM 45 N LEU A 3 62.195 -10.488 16.639 1.00 0.00 N ATOM 46 CA LEU A 3 60.953 -10.444 17.391 1.00 0.00 C ATOM 47 C LEU A 3 60.542 -11.868 17.773 1.00 0.00 C ATOM 48 O LEU A 3 61.187 -12.834 17.367 1.00 0.00 O ATOM 49 CB LEU A 3 59.880 -9.684 16.609 1.00 0.00 C ATOM 50 CG LEU A 3 59.332 -8.421 17.277 1.00 0.00 C ATOM 51 CD1 LEU A 3 58.544 -8.766 18.542 1.00 0.00 C ATOM 52 CD2 LEU A 3 60.454 -7.418 17.557 1.00 0.00 C ATOM 0 H LEU A 3 62.946 -9.913 17.022 1.00 0.00 H new ATOM 0 HA LEU A 3 61.090 -9.891 18.320 1.00 0.00 H new ATOM 0 HB2 LEU A 3 60.293 -9.408 15.639 1.00 0.00 H new ATOM 0 HB3 LEU A 3 59.047 -10.362 16.420 1.00 0.00 H new ATOM 0 HG LEU A 3 58.637 -7.944 16.586 1.00 0.00 H new ATOM 0 HD11 LEU A 3 58.166 -7.850 18.996 1.00 0.00 H new ATOM 0 HD12 LEU A 3 57.707 -9.415 18.284 1.00 0.00 H new ATOM 0 HD13 LEU A 3 59.196 -9.279 19.249 1.00 0.00 H new ATOM 0 HD21 LEU A 3 60.038 -6.530 18.032 1.00 0.00 H new ATOM 0 HD22 LEU A 3 61.191 -7.872 18.220 1.00 0.00 H new ATOM 0 HD23 LEU A 3 60.933 -7.137 16.619 1.00 0.00 H new ATOM 64 N GLU A 4 59.471 -11.953 18.548 1.00 0.00 N ATOM 65 CA GLU A 4 58.967 -13.242 18.989 1.00 0.00 C ATOM 66 C GLU A 4 59.054 -14.263 17.852 1.00 0.00 C ATOM 67 O GLU A 4 59.716 -15.291 17.986 1.00 0.00 O ATOM 68 CB GLU A 4 57.533 -13.122 19.509 1.00 0.00 C ATOM 69 CG GLU A 4 57.403 -13.734 20.906 1.00 0.00 C ATOM 70 CD GLU A 4 56.500 -12.879 21.797 1.00 0.00 C ATOM 71 OE1 GLU A 4 56.998 -12.163 22.679 1.00 0.00 O ATOM 72 OE2 GLU A 4 55.238 -12.976 21.547 1.00 0.00 O ATOM 0 H GLU A 4 58.938 -11.150 18.882 1.00 0.00 H new ATOM 0 HA GLU A 4 59.589 -13.591 19.813 1.00 0.00 H new ATOM 0 HB2 GLU A 4 57.240 -12.073 19.539 1.00 0.00 H new ATOM 0 HB3 GLU A 4 56.850 -13.624 18.823 1.00 0.00 H new ATOM 0 HG2 GLU A 4 56.995 -14.742 20.829 1.00 0.00 H new ATOM 0 HG3 GLU A 4 58.389 -13.823 21.361 1.00 0.00 H new ATOM 80 N LEU A 5 58.375 -13.944 16.760 1.00 0.00 N ATOM 81 CA LEU A 5 58.367 -14.820 15.601 1.00 0.00 C ATOM 82 C LEU A 5 58.316 -13.974 14.328 1.00 0.00 C ATOM 83 O LEU A 5 59.344 -13.732 13.697 1.00 0.00 O ATOM 84 CB LEU A 5 57.232 -15.840 15.708 1.00 0.00 C ATOM 85 CG LEU A 5 57.073 -16.794 14.522 1.00 0.00 C ATOM 86 CD1 LEU A 5 57.910 -18.059 14.720 1.00 0.00 C ATOM 87 CD2 LEU A 5 55.598 -17.116 14.272 1.00 0.00 C ATOM 0 H LEU A 5 57.826 -13.091 16.653 1.00 0.00 H new ATOM 0 HA LEU A 5 59.286 -15.404 15.559 1.00 0.00 H new ATOM 0 HB2 LEU A 5 57.388 -16.434 16.608 1.00 0.00 H new ATOM 0 HB3 LEU A 5 56.295 -15.299 15.842 1.00 0.00 H new ATOM 0 HG LEU A 5 57.450 -16.295 13.629 1.00 0.00 H new ATOM 0 HD11 LEU A 5 57.779 -18.720 13.863 1.00 0.00 H new ATOM 0 HD12 LEU A 5 58.962 -17.789 14.812 1.00 0.00 H new ATOM 0 HD13 LEU A 5 57.586 -18.571 15.626 1.00 0.00 H new ATOM 0 HD21 LEU A 5 55.513 -17.796 13.424 1.00 0.00 H new ATOM 0 HD22 LEU A 5 55.173 -17.587 15.159 1.00 0.00 H new ATOM 0 HD23 LEU A 5 55.056 -16.195 14.055 1.00 0.00 H new ATOM 99 N THR A 6 57.109 -13.548 13.987 1.00 0.00 N ATOM 100 CA THR A 6 56.910 -12.733 12.800 1.00 0.00 C ATOM 101 C THR A 6 55.492 -12.159 12.778 1.00 0.00 C ATOM 102 O THR A 6 54.516 -12.902 12.871 1.00 0.00 O ATOM 103 CB THR A 6 57.236 -13.593 11.577 1.00 0.00 C ATOM 104 OG1 THR A 6 56.797 -12.806 10.473 1.00 0.00 O ATOM 105 CG2 THR A 6 56.374 -14.855 11.502 1.00 0.00 C ATOM 0 H THR A 6 56.258 -13.752 14.512 1.00 0.00 H new ATOM 0 HA THR A 6 57.576 -11.870 12.797 1.00 0.00 H new ATOM 0 HB THR A 6 58.289 -13.874 11.601 1.00 0.00 H new ATOM 0 HG1 THR A 6 56.972 -13.288 9.638 1.00 0.00 H new ATOM 0 HG21 THR A 6 56.646 -15.429 10.616 1.00 0.00 H new ATOM 0 HG22 THR A 6 56.539 -15.462 12.392 1.00 0.00 H new ATOM 0 HG23 THR A 6 55.322 -14.574 11.444 1.00 0.00 H new ATOM 113 N LYS A 7 55.423 -10.842 12.656 1.00 0.00 N ATOM 114 CA LYS A 7 54.141 -10.160 12.621 1.00 0.00 C ATOM 115 C LYS A 7 53.359 -10.614 11.386 1.00 0.00 C ATOM 116 O LYS A 7 53.871 -10.561 10.269 1.00 0.00 O ATOM 117 CB LYS A 7 54.338 -8.644 12.700 1.00 0.00 C ATOM 118 CG LYS A 7 55.227 -8.147 11.559 1.00 0.00 C ATOM 119 CD LYS A 7 54.394 -7.824 10.316 1.00 0.00 C ATOM 120 CE LYS A 7 54.129 -6.321 10.210 1.00 0.00 C ATOM 121 NZ LYS A 7 53.642 -5.975 8.855 1.00 0.00 N ATOM 0 H LYS A 7 56.235 -10.229 12.580 1.00 0.00 H new ATOM 0 HA LYS A 7 53.544 -10.427 13.493 1.00 0.00 H new ATOM 0 HB2 LYS A 7 53.370 -8.145 12.655 1.00 0.00 H new ATOM 0 HB3 LYS A 7 54.788 -8.381 13.657 1.00 0.00 H new ATOM 0 HG2 LYS A 7 55.771 -7.258 11.878 1.00 0.00 H new ATOM 0 HG3 LYS A 7 55.971 -8.906 11.316 1.00 0.00 H new ATOM 0 HD2 LYS A 7 54.917 -8.169 9.424 1.00 0.00 H new ATOM 0 HD3 LYS A 7 53.447 -8.362 10.358 1.00 0.00 H new ATOM 0 HE2 LYS A 7 53.392 -6.022 10.955 1.00 0.00 H new ATOM 0 HE3 LYS A 7 55.043 -5.768 10.427 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 53.467 -4.951 8.800 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 54.358 -6.242 8.150 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 52.758 -6.488 8.662 1.00 0.00 H new ATOM 134 N ALA A 8 52.132 -11.052 11.630 1.00 0.00 N ATOM 135 CA ALA A 8 51.275 -11.515 10.553 1.00 0.00 C ATOM 136 C ALA A 8 49.999 -12.117 11.144 1.00 0.00 C ATOM 137 O ALA A 8 49.815 -13.334 11.125 1.00 0.00 O ATOM 138 CB ALA A 8 52.043 -12.514 9.684 1.00 0.00 C ATOM 0 H ALA A 8 51.712 -11.096 12.558 1.00 0.00 H new ATOM 0 HA ALA A 8 50.980 -10.684 9.913 1.00 0.00 H new ATOM 0 HB1 ALA A 8 51.400 -12.862 8.875 1.00 0.00 H new ATOM 0 HB2 ALA A 8 52.924 -12.029 9.264 1.00 0.00 H new ATOM 0 HB3 ALA A 8 52.352 -13.364 10.293 1.00 0.00 H new ATOM 144 N GLU A 9 49.151 -11.238 11.657 1.00 0.00 N ATOM 145 CA GLU A 9 47.898 -11.668 12.254 1.00 0.00 C ATOM 146 C GLU A 9 46.776 -11.636 11.213 1.00 0.00 C ATOM 147 O GLU A 9 45.611 -11.441 11.557 1.00 0.00 O ATOM 148 CB GLU A 9 47.544 -10.806 13.467 1.00 0.00 C ATOM 149 CG GLU A 9 47.101 -11.674 14.646 1.00 0.00 C ATOM 150 CD GLU A 9 45.972 -11.001 15.429 1.00 0.00 C ATOM 151 OE1 GLU A 9 44.792 -11.174 15.089 1.00 0.00 O ATOM 152 OE2 GLU A 9 46.356 -10.276 16.425 1.00 0.00 O ATOM 0 H GLU A 9 49.307 -10.230 11.672 1.00 0.00 H new ATOM 0 HA GLU A 9 48.017 -12.694 12.601 1.00 0.00 H new ATOM 0 HB2 GLU A 9 48.407 -10.207 13.756 1.00 0.00 H new ATOM 0 HB3 GLU A 9 46.747 -10.110 13.203 1.00 0.00 H new ATOM 0 HG2 GLU A 9 46.767 -12.645 14.282 1.00 0.00 H new ATOM 0 HG3 GLU A 9 47.948 -11.856 15.307 1.00 0.00 H new ATOM 160 N LYS A 10 47.167 -11.831 9.962 1.00 0.00 N ATOM 161 CA LYS A 10 46.210 -11.827 8.870 1.00 0.00 C ATOM 162 C LYS A 10 46.234 -13.187 8.171 1.00 0.00 C ATOM 163 O LYS A 10 45.187 -13.731 7.825 1.00 0.00 O ATOM 164 CB LYS A 10 46.473 -10.648 7.930 1.00 0.00 C ATOM 165 CG LYS A 10 47.974 -10.407 7.761 1.00 0.00 C ATOM 166 CD LYS A 10 48.263 -9.626 6.477 1.00 0.00 C ATOM 167 CE LYS A 10 47.858 -8.158 6.626 1.00 0.00 C ATOM 168 NZ LYS A 10 49.008 -7.272 6.338 1.00 0.00 N ATOM 0 H LYS A 10 48.134 -11.993 9.681 1.00 0.00 H new ATOM 0 HA LYS A 10 45.199 -11.682 9.251 1.00 0.00 H new ATOM 0 HB2 LYS A 10 46.021 -10.845 6.958 1.00 0.00 H new ATOM 0 HB3 LYS A 10 45.999 -9.750 8.326 1.00 0.00 H new ATOM 0 HG2 LYS A 10 48.356 -9.856 8.620 1.00 0.00 H new ATOM 0 HG3 LYS A 10 48.499 -11.362 7.736 1.00 0.00 H new ATOM 0 HD2 LYS A 10 49.324 -9.692 6.238 1.00 0.00 H new ATOM 0 HD3 LYS A 10 47.721 -10.074 5.645 1.00 0.00 H new ATOM 0 HE2 LYS A 10 47.037 -7.930 5.947 1.00 0.00 H new ATOM 0 HE3 LYS A 10 47.495 -7.975 7.637 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 48.716 -6.279 6.444 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 49.780 -7.479 7.003 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 49.336 -7.435 5.365 1.00 0.00 H new ATOM 181 N HIS A 11 47.443 -13.698 7.983 1.00 0.00 N ATOM 182 CA HIS A 11 47.618 -14.985 7.331 1.00 0.00 C ATOM 183 C HIS A 11 46.655 -15.096 6.147 1.00 0.00 C ATOM 184 O HIS A 11 45.651 -15.803 6.223 1.00 0.00 O ATOM 185 CB HIS A 11 47.457 -16.129 8.335 1.00 0.00 C ATOM 186 CG HIS A 11 46.101 -16.180 8.996 1.00 0.00 C ATOM 187 ND1 HIS A 11 45.803 -15.482 10.153 1.00 0.00 N ATOM 188 CD2 HIS A 11 44.965 -16.853 8.649 1.00 0.00 C ATOM 189 CE1 HIS A 11 44.544 -15.731 10.480 1.00 0.00 C ATOM 190 NE2 HIS A 11 44.026 -16.581 9.547 1.00 0.00 N ATOM 0 H HIS A 11 48.310 -13.244 8.271 1.00 0.00 H new ATOM 0 HA HIS A 11 48.632 -15.063 6.939 1.00 0.00 H new ATOM 0 HB2 HIS A 11 47.636 -17.075 7.824 1.00 0.00 H new ATOM 0 HB3 HIS A 11 48.222 -16.033 9.106 1.00 0.00 H new ATOM 0 HD2 HIS A 11 44.850 -17.497 7.790 1.00 0.00 H new ATOM 0 HE1 HIS A 11 44.019 -15.331 11.335 1.00 0.00 H new ATOM 0 HE2 HIS A 11 43.074 -16.947 9.541 1.00 0.00 H new ATOM 198 N VAL A 12 46.995 -14.388 5.081 1.00 0.00 N ATOM 199 CA VAL A 12 46.173 -14.398 3.883 1.00 0.00 C ATOM 200 C VAL A 12 47.011 -14.886 2.699 1.00 0.00 C ATOM 201 O VAL A 12 46.554 -14.857 1.557 1.00 0.00 O ATOM 202 CB VAL A 12 45.565 -13.012 3.654 1.00 0.00 C ATOM 203 CG1 VAL A 12 46.457 -12.165 2.744 1.00 0.00 C ATOM 204 CG2 VAL A 12 44.149 -13.123 3.085 1.00 0.00 C ATOM 0 H VAL A 12 47.829 -13.803 5.021 1.00 0.00 H new ATOM 0 HA VAL A 12 45.338 -15.090 3.998 1.00 0.00 H new ATOM 0 HB VAL A 12 45.500 -12.510 4.620 1.00 0.00 H new ATOM 0 HG11 VAL A 12 46.002 -11.185 2.598 1.00 0.00 H new ATOM 0 HG12 VAL A 12 47.437 -12.044 3.205 1.00 0.00 H new ATOM 0 HG13 VAL A 12 46.568 -12.661 1.780 1.00 0.00 H new ATOM 0 HG21 VAL A 12 43.739 -12.125 2.931 1.00 0.00 H new ATOM 0 HG22 VAL A 12 44.180 -13.653 2.133 1.00 0.00 H new ATOM 0 HG23 VAL A 12 43.518 -13.671 3.785 1.00 0.00 H new ATOM 214 N HIS A 13 48.222 -15.322 3.012 1.00 0.00 N ATOM 215 CA HIS A 13 49.127 -15.816 1.989 1.00 0.00 C ATOM 216 C HIS A 13 48.850 -17.298 1.729 1.00 0.00 C ATOM 217 O HIS A 13 49.767 -18.116 1.741 1.00 0.00 O ATOM 218 CB HIS A 13 50.583 -15.544 2.375 1.00 0.00 C ATOM 219 CG HIS A 13 50.915 -15.895 3.805 1.00 0.00 C ATOM 220 ND1 HIS A 13 50.360 -16.982 4.459 1.00 0.00 N ATOM 221 CD2 HIS A 13 51.750 -15.293 4.700 1.00 0.00 C ATOM 222 CE1 HIS A 13 50.846 -17.021 5.691 1.00 0.00 C ATOM 223 NE2 HIS A 13 51.707 -15.973 5.839 1.00 0.00 N ATOM 0 H HIS A 13 48.598 -15.343 3.960 1.00 0.00 H new ATOM 0 HA HIS A 13 48.952 -15.281 1.056 1.00 0.00 H new ATOM 0 HB2 HIS A 13 51.236 -16.111 1.712 1.00 0.00 H new ATOM 0 HB3 HIS A 13 50.801 -14.489 2.211 1.00 0.00 H new ATOM 0 HD2 HIS A 13 52.346 -14.412 4.513 1.00 0.00 H new ATOM 0 HE1 HIS A 13 50.603 -17.754 6.446 1.00 0.00 H new ATOM 0 HE2 HIS A 13 52.231 -15.749 6.685 1.00 0.00 H new ATOM 231 N ASN A 14 47.579 -17.597 1.500 1.00 0.00 N ATOM 232 CA ASN A 14 47.169 -18.966 1.237 1.00 0.00 C ATOM 233 C ASN A 14 45.962 -18.960 0.297 1.00 0.00 C ATOM 234 O ASN A 14 45.739 -17.992 -0.427 1.00 0.00 O ATOM 235 CB ASN A 14 46.759 -19.675 2.529 1.00 0.00 C ATOM 236 CG ASN A 14 47.295 -21.108 2.562 1.00 0.00 C ATOM 237 OD1 ASN A 14 47.777 -21.641 1.576 1.00 0.00 O ATOM 238 ND2 ASN A 14 47.187 -21.699 3.748 1.00 0.00 N ATOM 0 H ASN A 14 46.821 -16.915 1.491 1.00 0.00 H new ATOM 0 HA ASN A 14 48.013 -19.491 0.789 1.00 0.00 H new ATOM 0 HB2 ASN A 14 47.138 -19.121 3.388 1.00 0.00 H new ATOM 0 HB3 ASN A 14 45.672 -19.687 2.612 1.00 0.00 H new ATOM 0 HD21 ASN A 14 47.518 -22.656 3.873 1.00 0.00 H new ATOM 0 HD22 ASN A 14 46.773 -21.196 4.533 1.00 0.00 H new ATOM 245 N PHE A 15 45.214 -20.054 0.339 1.00 0.00 N ATOM 246 CA PHE A 15 44.035 -20.187 -0.500 1.00 0.00 C ATOM 247 C PHE A 15 43.157 -18.937 -0.413 1.00 0.00 C ATOM 248 O PHE A 15 42.451 -18.604 -1.364 1.00 0.00 O ATOM 249 CB PHE A 15 43.246 -21.388 0.025 1.00 0.00 C ATOM 250 CG PHE A 15 42.929 -21.319 1.521 1.00 0.00 C ATOM 251 CD1 PHE A 15 43.802 -21.838 2.426 1.00 0.00 C ATOM 252 CD2 PHE A 15 41.775 -20.738 1.945 1.00 0.00 C ATOM 253 CE1 PHE A 15 43.507 -21.773 3.813 1.00 0.00 C ATOM 254 CE2 PHE A 15 41.480 -20.673 3.332 1.00 0.00 C ATOM 255 CZ PHE A 15 42.353 -21.192 4.237 1.00 0.00 C ATOM 0 H PHE A 15 45.402 -20.856 0.941 1.00 0.00 H new ATOM 0 HA PHE A 15 44.331 -20.318 -1.541 1.00 0.00 H new ATOM 0 HB2 PHE A 15 42.312 -21.467 -0.531 1.00 0.00 H new ATOM 0 HB3 PHE A 15 43.813 -22.297 -0.174 1.00 0.00 H new ATOM 0 HD1 PHE A 15 44.719 -22.299 2.090 1.00 0.00 H new ATOM 0 HD2 PHE A 15 41.082 -20.326 1.226 1.00 0.00 H new ATOM 0 HE1 PHE A 15 44.200 -22.185 4.532 1.00 0.00 H new ATOM 0 HE2 PHE A 15 40.563 -20.212 3.668 1.00 0.00 H new ATOM 0 HZ PHE A 15 42.130 -21.143 5.292 1.00 0.00 H new ATOM 265 N MET A 16 43.229 -18.280 0.735 1.00 0.00 N ATOM 266 CA MET A 16 42.450 -17.074 0.958 1.00 0.00 C ATOM 267 C MET A 16 42.394 -16.216 -0.308 1.00 0.00 C ATOM 268 O MET A 16 41.316 -15.970 -0.848 1.00 0.00 O ATOM 269 CB MET A 16 43.074 -16.265 2.096 1.00 0.00 C ATOM 270 CG MET A 16 42.753 -16.894 3.454 1.00 0.00 C ATOM 271 SD MET A 16 41.691 -15.809 4.393 1.00 0.00 S ATOM 272 CE MET A 16 40.219 -16.816 4.479 1.00 0.00 C ATOM 0 H MET A 16 43.815 -18.560 1.521 1.00 0.00 H new ATOM 0 HA MET A 16 41.433 -17.365 1.223 1.00 0.00 H new ATOM 0 HB2 MET A 16 44.154 -16.214 1.961 1.00 0.00 H new ATOM 0 HB3 MET A 16 42.700 -15.242 2.067 1.00 0.00 H new ATOM 0 HG2 MET A 16 42.266 -17.859 3.311 1.00 0.00 H new ATOM 0 HG3 MET A 16 43.675 -17.080 4.005 1.00 0.00 H new ATOM 0 HE1 MET A 16 39.447 -16.285 5.037 1.00 0.00 H new ATOM 0 HE2 MET A 16 39.861 -17.023 3.471 1.00 0.00 H new ATOM 0 HE3 MET A 16 40.449 -17.755 4.982 1.00 0.00 H new ATOM 282 N MET A 17 43.568 -15.784 -0.744 1.00 0.00 N ATOM 283 CA MET A 17 43.666 -14.959 -1.935 1.00 0.00 C ATOM 284 C MET A 17 45.110 -14.510 -2.174 1.00 0.00 C ATOM 285 O MET A 17 45.723 -13.893 -1.305 1.00 0.00 O ATOM 286 CB MET A 17 42.769 -13.729 -1.780 1.00 0.00 C ATOM 287 CG MET A 17 42.506 -13.425 -0.304 1.00 0.00 C ATOM 288 SD MET A 17 42.212 -11.678 -0.084 1.00 0.00 S ATOM 289 CE MET A 17 41.270 -11.710 1.432 1.00 0.00 C ATOM 0 H MET A 17 44.460 -15.990 -0.293 1.00 0.00 H new ATOM 0 HA MET A 17 43.342 -15.551 -2.791 1.00 0.00 H new ATOM 0 HB2 MET A 17 43.241 -12.868 -2.254 1.00 0.00 H new ATOM 0 HB3 MET A 17 41.823 -13.897 -2.295 1.00 0.00 H new ATOM 0 HG2 MET A 17 41.644 -13.994 0.045 1.00 0.00 H new ATOM 0 HG3 MET A 17 43.359 -13.737 0.298 1.00 0.00 H new ATOM 0 HE1 MET A 17 41.488 -10.815 2.015 1.00 0.00 H new ATOM 0 HE2 MET A 17 40.206 -11.741 1.198 1.00 0.00 H new ATOM 0 HE3 MET A 17 41.540 -12.594 2.010 1.00 0.00 H new ATOM 299 N ASP A 18 45.610 -14.838 -3.356 1.00 0.00 N ATOM 300 CA ASP A 18 46.969 -14.477 -3.720 1.00 0.00 C ATOM 301 C ASP A 18 47.121 -14.544 -5.241 1.00 0.00 C ATOM 302 O ASP A 18 47.616 -15.534 -5.776 1.00 0.00 O ATOM 303 CB ASP A 18 47.981 -15.444 -3.101 1.00 0.00 C ATOM 304 CG ASP A 18 49.437 -15.200 -3.501 1.00 0.00 C ATOM 305 OD1 ASP A 18 49.877 -14.049 -3.641 1.00 0.00 O ATOM 306 OD2 ASP A 18 50.141 -16.267 -3.674 1.00 0.00 O ATOM 0 H ASP A 18 45.098 -15.350 -4.074 1.00 0.00 H new ATOM 0 HA ASP A 18 47.160 -13.469 -3.350 1.00 0.00 H new ATOM 0 HB2 ASP A 18 47.903 -15.382 -2.016 1.00 0.00 H new ATOM 0 HB3 ASP A 18 47.708 -16.461 -3.383 1.00 0.00 H new ATOM 312 N THR A 19 46.684 -13.477 -5.894 1.00 0.00 N ATOM 313 CA THR A 19 46.765 -13.402 -7.343 1.00 0.00 C ATOM 314 C THR A 19 46.242 -12.052 -7.838 1.00 0.00 C ATOM 315 O THR A 19 46.803 -11.466 -8.761 1.00 0.00 O ATOM 316 CB THR A 19 46.004 -14.597 -7.921 1.00 0.00 C ATOM 317 OG1 THR A 19 45.778 -14.239 -9.282 1.00 0.00 O ATOM 318 CG2 THR A 19 44.598 -14.736 -7.334 1.00 0.00 C ATOM 0 H THR A 19 46.273 -12.658 -5.447 1.00 0.00 H new ATOM 0 HA THR A 19 47.798 -13.459 -7.685 1.00 0.00 H new ATOM 0 HB THR A 19 46.567 -15.511 -7.733 1.00 0.00 H new ATOM 0 HG1 THR A 19 45.291 -14.960 -9.733 1.00 0.00 H new ATOM 0 HG21 THR A 19 44.102 -15.599 -7.778 1.00 0.00 H new ATOM 0 HG22 THR A 19 44.666 -14.872 -6.255 1.00 0.00 H new ATOM 0 HG23 THR A 19 44.023 -13.836 -7.550 1.00 0.00 H new ATOM 326 N GLN A 20 45.173 -11.599 -7.200 1.00 0.00 N ATOM 327 CA GLN A 20 44.568 -10.329 -7.564 1.00 0.00 C ATOM 328 C GLN A 20 44.104 -9.583 -6.310 1.00 0.00 C ATOM 329 O GLN A 20 42.942 -9.195 -6.209 1.00 0.00 O ATOM 330 CB GLN A 20 43.407 -10.533 -8.540 1.00 0.00 C ATOM 331 CG GLN A 20 43.913 -11.036 -9.894 1.00 0.00 C ATOM 332 CD GLN A 20 43.247 -10.276 -11.043 1.00 0.00 C ATOM 333 OE1 GLN A 20 42.034 -10.194 -11.147 1.00 0.00 O ATOM 334 NE2 GLN A 20 44.105 -9.729 -11.899 1.00 0.00 N ATOM 0 H GLN A 20 44.710 -12.088 -6.434 1.00 0.00 H new ATOM 0 HA GLN A 20 45.321 -9.722 -8.068 1.00 0.00 H new ATOM 0 HB2 GLN A 20 42.698 -11.249 -8.124 1.00 0.00 H new ATOM 0 HB3 GLN A 20 42.870 -9.594 -8.674 1.00 0.00 H new ATOM 0 HG2 GLN A 20 44.995 -10.914 -9.951 1.00 0.00 H new ATOM 0 HG3 GLN A 20 43.707 -12.102 -9.990 1.00 0.00 H new ATOM 0 HE21 GLN A 20 45.109 -9.836 -11.753 1.00 0.00 H new ATOM 0 HE22 GLN A 20 43.759 -9.203 -12.701 1.00 0.00 H new ATOM 343 N LEU A 21 45.038 -9.407 -5.387 1.00 0.00 N ATOM 344 CA LEU A 21 44.740 -8.715 -4.144 1.00 0.00 C ATOM 345 C LEU A 21 43.987 -7.420 -4.454 1.00 0.00 C ATOM 346 O LEU A 21 42.950 -7.142 -3.854 1.00 0.00 O ATOM 347 CB LEU A 21 46.017 -8.504 -3.329 1.00 0.00 C ATOM 348 CG LEU A 21 46.351 -9.595 -2.310 1.00 0.00 C ATOM 349 CD1 LEU A 21 47.845 -9.600 -1.982 1.00 0.00 C ATOM 350 CD2 LEU A 21 45.489 -9.454 -1.054 1.00 0.00 C ATOM 0 H LEU A 21 46.001 -9.731 -5.475 1.00 0.00 H new ATOM 0 HA LEU A 21 44.086 -9.322 -3.517 1.00 0.00 H new ATOM 0 HB2 LEU A 21 46.854 -8.412 -4.021 1.00 0.00 H new ATOM 0 HB3 LEU A 21 45.934 -7.554 -2.801 1.00 0.00 H new ATOM 0 HG LEU A 21 46.116 -10.562 -2.755 1.00 0.00 H new ATOM 0 HD11 LEU A 21 48.055 -10.385 -1.255 1.00 0.00 H new ATOM 0 HD12 LEU A 21 48.417 -9.785 -2.892 1.00 0.00 H new ATOM 0 HD13 LEU A 21 48.129 -8.634 -1.565 1.00 0.00 H new ATOM 0 HD21 LEU A 21 45.746 -10.242 -0.346 1.00 0.00 H new ATOM 0 HD22 LEU A 21 45.669 -8.481 -0.596 1.00 0.00 H new ATOM 0 HD23 LEU A 21 44.436 -9.538 -1.324 1.00 0.00 H new ATOM 362 N THR A 22 44.538 -6.662 -5.391 1.00 0.00 N ATOM 363 CA THR A 22 43.932 -5.403 -5.788 1.00 0.00 C ATOM 364 C THR A 22 43.551 -4.582 -4.554 1.00 0.00 C ATOM 365 O THR A 22 42.578 -3.831 -4.580 1.00 0.00 O ATOM 366 CB THR A 22 42.743 -5.717 -6.699 1.00 0.00 C ATOM 367 OG1 THR A 22 42.318 -4.440 -7.167 1.00 0.00 O ATOM 368 CG2 THR A 22 41.537 -6.251 -5.924 1.00 0.00 C ATOM 0 H THR A 22 45.398 -6.896 -5.887 1.00 0.00 H new ATOM 0 HA THR A 22 44.635 -4.785 -6.347 1.00 0.00 H new ATOM 0 HB THR A 22 43.044 -6.447 -7.450 1.00 0.00 H new ATOM 0 HG1 THR A 22 42.240 -3.823 -6.409 1.00 0.00 H new ATOM 0 HG21 THR A 22 40.722 -6.458 -6.617 1.00 0.00 H new ATOM 0 HG22 THR A 22 41.815 -7.169 -5.406 1.00 0.00 H new ATOM 0 HG23 THR A 22 41.214 -5.507 -5.196 1.00 0.00 H new ATOM 376 N LYS A 23 44.339 -4.753 -3.503 1.00 0.00 N ATOM 377 CA LYS A 23 44.097 -4.037 -2.262 1.00 0.00 C ATOM 378 C LYS A 23 44.205 -2.532 -2.516 1.00 0.00 C ATOM 379 O LYS A 23 44.668 -2.110 -3.575 1.00 0.00 O ATOM 380 CB LYS A 23 45.032 -4.543 -1.161 1.00 0.00 C ATOM 381 CG LYS A 23 46.398 -3.859 -1.244 1.00 0.00 C ATOM 382 CD LYS A 23 47.529 -4.889 -1.202 1.00 0.00 C ATOM 383 CE LYS A 23 48.711 -4.441 -2.065 1.00 0.00 C ATOM 384 NZ LYS A 23 48.479 -4.792 -3.483 1.00 0.00 N ATOM 0 H LYS A 23 45.146 -5.377 -3.485 1.00 0.00 H new ATOM 0 HA LYS A 23 43.086 -4.228 -1.903 1.00 0.00 H new ATOM 0 HB2 LYS A 23 44.586 -4.354 -0.185 1.00 0.00 H new ATOM 0 HB3 LYS A 23 45.156 -5.622 -1.252 1.00 0.00 H new ATOM 0 HG2 LYS A 23 46.463 -3.279 -2.165 1.00 0.00 H new ATOM 0 HG3 LYS A 23 46.509 -3.158 -0.417 1.00 0.00 H new ATOM 0 HD2 LYS A 23 47.859 -5.031 -0.173 1.00 0.00 H new ATOM 0 HD3 LYS A 23 47.161 -5.853 -1.554 1.00 0.00 H new ATOM 0 HE2 LYS A 23 48.852 -3.364 -1.969 1.00 0.00 H new ATOM 0 HE3 LYS A 23 49.627 -4.915 -1.712 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 49.290 -4.481 -4.055 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 48.367 -5.822 -3.572 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 47.616 -4.320 -3.821 1.00 0.00 H new ATOM 397 N ARG A 24 43.770 -1.764 -1.528 1.00 0.00 N ATOM 398 CA ARG A 24 43.811 -0.316 -1.632 1.00 0.00 C ATOM 399 C ARG A 24 45.248 0.186 -1.481 1.00 0.00 C ATOM 400 O ARG A 24 46.197 -0.546 -1.756 1.00 0.00 O ATOM 401 CB ARG A 24 42.935 0.339 -0.562 1.00 0.00 C ATOM 402 CG ARG A 24 42.060 1.439 -1.167 1.00 0.00 C ATOM 403 CD ARG A 24 41.717 2.503 -0.122 1.00 0.00 C ATOM 404 NE ARG A 24 41.215 3.724 -0.790 1.00 0.00 N ATOM 405 CZ ARG A 24 42.004 4.736 -1.212 1.00 0.00 C ATOM 406 NH1 ARG A 24 43.341 4.680 -1.037 1.00 0.00 N ATOM 407 NH2 ARG A 24 41.448 5.780 -1.796 1.00 0.00 N ATOM 0 H ARG A 24 43.387 -2.118 -0.651 1.00 0.00 H new ATOM 0 HA ARG A 24 43.428 -0.044 -2.615 1.00 0.00 H new ATOM 0 HB2 ARG A 24 42.304 -0.415 -0.092 1.00 0.00 H new ATOM 0 HB3 ARG A 24 43.565 0.760 0.221 1.00 0.00 H new ATOM 0 HG2 ARG A 24 42.580 1.902 -2.006 1.00 0.00 H new ATOM 0 HG3 ARG A 24 41.142 1.003 -1.562 1.00 0.00 H new ATOM 0 HD2 ARG A 24 40.964 2.119 0.566 1.00 0.00 H new ATOM 0 HD3 ARG A 24 42.600 2.740 0.471 1.00 0.00 H new ATOM 0 HE ARG A 24 40.210 3.807 -0.941 1.00 0.00 H new ATOM 0 HH11 ARG A 24 43.762 3.869 -0.583 1.00 0.00 H new ATOM 0 HH12 ARG A 24 43.930 5.448 -1.358 1.00 0.00 H new ATOM 0 HH21 ARG A 24 40.437 5.815 -1.923 1.00 0.00 H new ATOM 0 HH22 ARG A 24 42.030 6.553 -2.120 1.00 0.00 H new ATOM 420 N VAL A 25 45.364 1.432 -1.046 1.00 0.00 N ATOM 421 CA VAL A 25 46.669 2.041 -0.855 1.00 0.00 C ATOM 422 C VAL A 25 47.220 1.637 0.514 1.00 0.00 C ATOM 423 O VAL A 25 47.644 2.490 1.292 1.00 0.00 O ATOM 424 CB VAL A 25 46.572 3.557 -1.037 1.00 0.00 C ATOM 425 CG1 VAL A 25 47.959 4.201 -1.021 1.00 0.00 C ATOM 426 CG2 VAL A 25 45.819 3.907 -2.322 1.00 0.00 C ATOM 0 H VAL A 25 44.574 2.037 -0.820 1.00 0.00 H new ATOM 0 HA VAL A 25 47.371 1.682 -1.607 1.00 0.00 H new ATOM 0 HB VAL A 25 46.007 3.960 -0.197 1.00 0.00 H new ATOM 0 HG11 VAL A 25 47.861 5.279 -1.152 1.00 0.00 H new ATOM 0 HG12 VAL A 25 48.445 3.994 -0.068 1.00 0.00 H new ATOM 0 HG13 VAL A 25 48.560 3.790 -1.832 1.00 0.00 H new ATOM 0 HG21 VAL A 25 45.764 4.990 -2.428 1.00 0.00 H new ATOM 0 HG22 VAL A 25 46.345 3.485 -3.178 1.00 0.00 H new ATOM 0 HG23 VAL A 25 44.811 3.495 -2.277 1.00 0.00 H new ATOM 436 N LYS A 26 47.196 0.337 0.766 1.00 0.00 N ATOM 437 CA LYS A 26 47.687 -0.190 2.028 1.00 0.00 C ATOM 438 C LYS A 26 46.691 0.147 3.139 1.00 0.00 C ATOM 439 O LYS A 26 47.079 0.642 4.197 1.00 0.00 O ATOM 440 CB LYS A 26 49.106 0.312 2.302 1.00 0.00 C ATOM 441 CG LYS A 26 50.136 -0.793 2.058 1.00 0.00 C ATOM 442 CD LYS A 26 49.760 -2.069 2.812 1.00 0.00 C ATOM 443 CE LYS A 26 50.939 -2.585 3.639 1.00 0.00 C ATOM 444 NZ LYS A 26 50.903 -4.062 3.728 1.00 0.00 N ATOM 0 H LYS A 26 46.844 -0.367 0.118 1.00 0.00 H new ATOM 0 HA LYS A 26 47.760 -1.277 1.984 1.00 0.00 H new ATOM 0 HB2 LYS A 26 49.324 1.165 1.660 1.00 0.00 H new ATOM 0 HB3 LYS A 26 49.179 0.661 3.332 1.00 0.00 H new ATOM 0 HG2 LYS A 26 50.203 -1.003 0.991 1.00 0.00 H new ATOM 0 HG3 LYS A 26 51.121 -0.454 2.378 1.00 0.00 H new ATOM 0 HD2 LYS A 26 48.911 -1.872 3.466 1.00 0.00 H new ATOM 0 HD3 LYS A 26 49.445 -2.835 2.103 1.00 0.00 H new ATOM 0 HE2 LYS A 26 51.877 -2.265 3.185 1.00 0.00 H new ATOM 0 HE3 LYS A 26 50.906 -2.154 4.639 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 51.710 -4.396 4.293 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 50.016 -4.361 4.181 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 50.957 -4.469 2.772 1.00 0.00 H new ATOM 457 N ASN A 27 45.427 -0.136 2.862 1.00 0.00 N ATOM 458 CA ASN A 27 44.372 0.131 3.825 1.00 0.00 C ATOM 459 C ASN A 27 44.644 1.468 4.516 1.00 0.00 C ATOM 460 O ASN A 27 44.304 1.648 5.685 1.00 0.00 O ATOM 461 CB ASN A 27 44.321 -0.956 4.901 1.00 0.00 C ATOM 462 CG ASN A 27 43.190 -0.689 5.896 1.00 0.00 C ATOM 463 OD1 ASN A 27 42.060 -0.406 5.532 1.00 0.00 O ATOM 464 ND2 ASN A 27 43.555 -0.793 7.171 1.00 0.00 N ATOM 0 H ASN A 27 45.109 -0.548 1.984 1.00 0.00 H new ATOM 0 HA ASN A 27 43.423 0.153 3.289 1.00 0.00 H new ATOM 0 HB2 ASN A 27 44.176 -1.930 4.433 1.00 0.00 H new ATOM 0 HB3 ASN A 27 45.274 -0.995 5.429 1.00 0.00 H new ATOM 0 HD21 ASN A 27 42.872 -0.632 7.912 1.00 0.00 H new ATOM 0 HD22 ASN A 27 44.518 -1.033 7.408 1.00 0.00 H new ATOM 471 N ALA A 28 45.256 2.373 3.765 1.00 0.00 N ATOM 472 CA ALA A 28 45.578 3.688 4.291 1.00 0.00 C ATOM 473 C ALA A 28 44.315 4.552 4.301 1.00 0.00 C ATOM 474 O ALA A 28 44.306 5.638 4.879 1.00 0.00 O ATOM 475 CB ALA A 28 46.703 4.309 3.461 1.00 0.00 C ATOM 0 H ALA A 28 45.537 2.221 2.796 1.00 0.00 H new ATOM 0 HA ALA A 28 45.934 3.613 5.318 1.00 0.00 H new ATOM 0 HB1 ALA A 28 46.944 5.296 3.856 1.00 0.00 H new ATOM 0 HB2 ALA A 28 47.586 3.672 3.511 1.00 0.00 H new ATOM 0 HB3 ALA A 28 46.381 4.402 2.424 1.00 0.00 H new ATOM 481 N ALA A 29 43.279 4.037 3.654 1.00 0.00 N ATOM 482 CA ALA A 29 42.014 4.748 3.581 1.00 0.00 C ATOM 483 C ALA A 29 41.208 4.478 4.853 1.00 0.00 C ATOM 484 O ALA A 29 40.642 5.398 5.441 1.00 0.00 O ATOM 485 CB ALA A 29 41.265 4.328 2.315 1.00 0.00 C ATOM 0 H ALA A 29 43.290 3.136 3.176 1.00 0.00 H new ATOM 0 HA ALA A 29 42.181 5.823 3.519 1.00 0.00 H new ATOM 0 HB1 ALA A 29 40.316 4.861 2.260 1.00 0.00 H new ATOM 0 HB2 ALA A 29 41.868 4.568 1.439 1.00 0.00 H new ATOM 0 HB3 ALA A 29 41.077 3.255 2.343 1.00 0.00 H new ATOM 491 N ALA A 30 41.181 3.211 5.240 1.00 0.00 N ATOM 492 CA ALA A 30 40.453 2.807 6.431 1.00 0.00 C ATOM 493 C ALA A 30 38.966 3.112 6.243 1.00 0.00 C ATOM 494 O ALA A 30 38.186 2.226 5.898 1.00 0.00 O ATOM 495 CB ALA A 30 41.043 3.514 7.653 1.00 0.00 C ATOM 0 H ALA A 30 41.652 2.451 4.750 1.00 0.00 H new ATOM 0 HA ALA A 30 40.551 1.734 6.595 1.00 0.00 H new ATOM 0 HB1 ALA A 30 40.498 3.212 8.547 1.00 0.00 H new ATOM 0 HB2 ALA A 30 42.093 3.242 7.759 1.00 0.00 H new ATOM 0 HB3 ALA A 30 40.959 4.593 7.525 1.00 0.00 H new ATOM 501 N ASN A 31 38.618 4.369 6.477 1.00 0.00 N ATOM 502 CA ASN A 31 37.238 4.802 6.337 1.00 0.00 C ATOM 503 C ASN A 31 37.204 6.169 5.652 1.00 0.00 C ATOM 504 O ASN A 31 36.173 6.841 5.650 1.00 0.00 O ATOM 505 CB ASN A 31 36.563 4.940 7.703 1.00 0.00 C ATOM 506 CG ASN A 31 37.377 5.848 8.627 1.00 0.00 C ATOM 507 OD1 ASN A 31 37.429 7.056 8.466 1.00 0.00 O ATOM 508 ND2 ASN A 31 38.008 5.200 9.603 1.00 0.00 N ATOM 0 H ASN A 31 39.268 5.101 6.763 1.00 0.00 H new ATOM 0 HA ASN A 31 36.708 4.054 5.747 1.00 0.00 H new ATOM 0 HB2 ASN A 31 35.560 5.348 7.578 1.00 0.00 H new ATOM 0 HB3 ASN A 31 36.452 3.956 8.159 1.00 0.00 H new ATOM 0 HD21 ASN A 31 38.578 5.717 10.273 1.00 0.00 H new ATOM 0 HD22 ASN A 31 37.922 4.187 9.681 1.00 0.00 H new ATOM 515 N VAL A 32 38.343 6.542 5.088 1.00 0.00 N ATOM 516 CA VAL A 32 38.457 7.817 4.401 1.00 0.00 C ATOM 517 C VAL A 32 38.094 8.946 5.368 1.00 0.00 C ATOM 518 O VAL A 32 37.799 10.062 4.943 1.00 0.00 O ATOM 519 CB VAL A 32 37.592 7.810 3.139 1.00 0.00 C ATOM 520 CG1 VAL A 32 37.215 6.382 2.740 1.00 0.00 C ATOM 521 CG2 VAL A 32 36.345 8.676 3.324 1.00 0.00 C ATOM 0 H VAL A 32 39.196 5.983 5.093 1.00 0.00 H new ATOM 0 HA VAL A 32 39.483 7.985 4.075 1.00 0.00 H new ATOM 0 HB VAL A 32 38.180 8.239 2.328 1.00 0.00 H new ATOM 0 HG11 VAL A 32 36.600 6.406 1.840 1.00 0.00 H new ATOM 0 HG12 VAL A 32 38.121 5.807 2.546 1.00 0.00 H new ATOM 0 HG13 VAL A 32 36.655 5.914 3.550 1.00 0.00 H new ATOM 0 HG21 VAL A 32 35.748 8.654 2.412 1.00 0.00 H new ATOM 0 HG22 VAL A 32 35.754 8.290 4.155 1.00 0.00 H new ATOM 0 HG23 VAL A 32 36.643 9.703 3.537 1.00 0.00 H new ATOM 531 N LEU A 33 38.127 8.617 6.651 1.00 0.00 N ATOM 532 CA LEU A 33 37.805 9.589 7.682 1.00 0.00 C ATOM 533 C LEU A 33 36.287 9.758 7.761 1.00 0.00 C ATOM 534 O LEU A 33 35.693 9.572 8.822 1.00 0.00 O ATOM 535 CB LEU A 33 38.558 10.898 7.437 1.00 0.00 C ATOM 536 CG LEU A 33 38.766 11.792 8.662 1.00 0.00 C ATOM 537 CD1 LEU A 33 39.782 11.174 9.624 1.00 0.00 C ATOM 538 CD2 LEU A 33 39.159 13.210 8.245 1.00 0.00 C ATOM 0 H LEU A 33 38.372 7.690 7.000 1.00 0.00 H new ATOM 0 HA LEU A 33 38.137 9.235 8.658 1.00 0.00 H new ATOM 0 HB2 LEU A 33 39.535 10.659 7.016 1.00 0.00 H new ATOM 0 HB3 LEU A 33 38.017 11.469 6.683 1.00 0.00 H new ATOM 0 HG LEU A 33 37.819 11.865 9.197 1.00 0.00 H new ATOM 0 HD11 LEU A 33 39.912 11.829 10.486 1.00 0.00 H new ATOM 0 HD12 LEU A 33 39.422 10.201 9.958 1.00 0.00 H new ATOM 0 HD13 LEU A 33 40.738 11.051 9.114 1.00 0.00 H new ATOM 0 HD21 LEU A 33 39.301 13.825 9.134 1.00 0.00 H new ATOM 0 HD22 LEU A 33 40.087 13.177 7.675 1.00 0.00 H new ATOM 0 HD23 LEU A 33 38.369 13.640 7.629 1.00 0.00 H new ATOM 550 N ARG A 34 35.702 10.108 6.625 1.00 0.00 N ATOM 551 CA ARG A 34 34.264 10.304 6.553 1.00 0.00 C ATOM 552 C ARG A 34 33.533 9.019 6.947 1.00 0.00 C ATOM 553 O ARG A 34 32.644 9.042 7.796 1.00 0.00 O ATOM 554 CB ARG A 34 33.835 10.715 5.143 1.00 0.00 C ATOM 555 CG ARG A 34 34.608 11.949 4.672 1.00 0.00 C ATOM 556 CD ARG A 34 33.744 13.208 4.772 1.00 0.00 C ATOM 557 NE ARG A 34 34.588 14.375 5.113 1.00 0.00 N ATOM 558 CZ ARG A 34 34.978 14.686 6.367 1.00 0.00 C ATOM 559 NH1 ARG A 34 34.601 13.919 7.412 1.00 0.00 N ATOM 560 NH2 ARG A 34 35.732 15.753 6.557 1.00 0.00 N ATOM 0 H ARG A 34 36.198 10.261 5.747 1.00 0.00 H new ATOM 0 HA ARG A 34 34.002 11.102 7.248 1.00 0.00 H new ATOM 0 HB2 ARG A 34 34.005 9.889 4.452 1.00 0.00 H new ATOM 0 HB3 ARG A 34 32.766 10.925 5.131 1.00 0.00 H new ATOM 0 HG2 ARG A 34 35.507 12.072 5.276 1.00 0.00 H new ATOM 0 HG3 ARG A 34 34.933 11.807 3.641 1.00 0.00 H new ATOM 0 HD2 ARG A 34 33.231 13.383 3.826 1.00 0.00 H new ATOM 0 HD3 ARG A 34 32.974 13.071 5.531 1.00 0.00 H new ATOM 0 HE ARG A 34 34.894 14.982 4.353 1.00 0.00 H new ATOM 0 HH11 ARG A 34 34.017 13.097 7.257 1.00 0.00 H new ATOM 0 HH12 ARG A 34 34.900 14.161 8.357 1.00 0.00 H new ATOM 0 HH21 ARG A 34 36.011 16.328 5.762 1.00 0.00 H new ATOM 0 HH22 ARG A 34 36.035 16.002 7.498 1.00 0.00 H new ATOM 573 N GLU A 35 33.934 7.928 6.310 1.00 0.00 N ATOM 574 CA GLU A 35 33.328 6.636 6.583 1.00 0.00 C ATOM 575 C GLU A 35 31.906 6.588 6.021 1.00 0.00 C ATOM 576 O GLU A 35 31.095 5.764 6.443 1.00 0.00 O ATOM 577 CB GLU A 35 33.335 6.334 8.083 1.00 0.00 C ATOM 578 CG GLU A 35 34.463 7.089 8.789 1.00 0.00 C ATOM 579 CD GLU A 35 34.981 6.299 9.993 1.00 0.00 C ATOM 580 OE1 GLU A 35 35.018 5.061 9.953 1.00 0.00 O ATOM 581 OE2 GLU A 35 35.355 7.019 10.997 1.00 0.00 O ATOM 0 H GLU A 35 34.671 7.913 5.605 1.00 0.00 H new ATOM 0 HA GLU A 35 33.920 5.866 6.088 1.00 0.00 H new ATOM 0 HB2 GLU A 35 32.376 6.615 8.519 1.00 0.00 H new ATOM 0 HB3 GLU A 35 33.455 5.262 8.241 1.00 0.00 H new ATOM 0 HG2 GLU A 35 35.279 7.269 8.089 1.00 0.00 H new ATOM 0 HG3 GLU A 35 34.103 8.064 9.117 1.00 0.00 H new ATOM 589 N THR A 36 31.646 7.480 5.076 1.00 0.00 N ATOM 590 CA THR A 36 30.336 7.549 4.452 1.00 0.00 C ATOM 591 C THR A 36 29.931 6.177 3.910 1.00 0.00 C ATOM 592 O THR A 36 28.745 5.853 3.854 1.00 0.00 O ATOM 593 CB THR A 36 30.382 8.638 3.377 1.00 0.00 C ATOM 594 OG1 THR A 36 31.497 8.278 2.566 1.00 0.00 O ATOM 595 CG2 THR A 36 30.761 10.007 3.946 1.00 0.00 C ATOM 0 H THR A 36 32.321 8.161 4.728 1.00 0.00 H new ATOM 0 HA THR A 36 29.566 7.818 5.175 1.00 0.00 H new ATOM 0 HB THR A 36 29.411 8.705 2.887 1.00 0.00 H new ATOM 0 HG1 THR A 36 31.257 7.514 2.001 1.00 0.00 H new ATOM 0 HG21 THR A 36 30.779 10.743 3.142 1.00 0.00 H new ATOM 0 HG22 THR A 36 30.027 10.306 4.695 1.00 0.00 H new ATOM 0 HG23 THR A 36 31.747 9.949 4.407 1.00 0.00 H new ATOM 603 N TRP A 37 30.938 5.407 3.524 1.00 0.00 N ATOM 604 CA TRP A 37 30.701 4.077 2.989 1.00 0.00 C ATOM 605 C TRP A 37 30.790 3.080 4.145 1.00 0.00 C ATOM 606 O TRP A 37 31.064 1.900 3.932 1.00 0.00 O ATOM 607 CB TRP A 37 31.675 3.763 1.852 1.00 0.00 C ATOM 608 CG TRP A 37 32.545 4.949 1.432 1.00 0.00 C ATOM 609 CD1 TRP A 37 33.770 5.270 1.871 1.00 0.00 C ATOM 610 CD2 TRP A 37 32.206 5.965 0.464 1.00 0.00 C ATOM 611 NE1 TRP A 37 34.242 6.414 1.261 1.00 0.00 N ATOM 612 CE2 TRP A 37 33.261 6.850 0.378 1.00 0.00 C ATOM 613 CE3 TRP A 37 31.045 6.130 -0.312 1.00 0.00 C ATOM 614 CZ2 TRP A 37 33.261 7.962 -0.473 1.00 0.00 C ATOM 615 CZ3 TRP A 37 31.061 7.246 -1.158 1.00 0.00 C ATOM 616 CH2 TRP A 37 32.115 8.146 -1.256 1.00 0.00 C ATOM 0 H TRP A 37 31.920 5.679 3.571 1.00 0.00 H new ATOM 0 HA TRP A 37 29.707 4.010 2.548 1.00 0.00 H new ATOM 0 HB2 TRP A 37 32.322 2.941 2.159 1.00 0.00 H new ATOM 0 HB3 TRP A 37 31.109 3.417 0.987 1.00 0.00 H new ATOM 0 HD1 TRP A 37 34.319 4.704 2.609 1.00 0.00 H new ATOM 0 HE1 TRP A 37 35.145 6.858 1.427 1.00 0.00 H new ATOM 0 HE3 TRP A 37 30.207 5.450 -0.260 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 34.099 8.641 -0.523 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 30.193 7.419 -1.778 1.00 0.00 H new ATOM 0 HH2 TRP A 37 32.051 8.984 -1.934 1.00 0.00 H new ATOM 627 N LEU A 38 30.553 3.590 5.345 1.00 0.00 N ATOM 628 CA LEU A 38 30.603 2.758 6.535 1.00 0.00 C ATOM 629 C LEU A 38 29.488 3.180 7.494 1.00 0.00 C ATOM 630 O LEU A 38 28.776 2.335 8.034 1.00 0.00 O ATOM 631 CB LEU A 38 31.999 2.800 7.160 1.00 0.00 C ATOM 632 CG LEU A 38 33.164 2.477 6.221 1.00 0.00 C ATOM 633 CD1 LEU A 38 33.371 3.597 5.200 1.00 0.00 C ATOM 634 CD2 LEU A 38 34.439 2.178 7.011 1.00 0.00 C ATOM 0 H LEU A 38 30.326 4.569 5.518 1.00 0.00 H new ATOM 0 HA LEU A 38 30.425 1.714 6.277 1.00 0.00 H new ATOM 0 HB2 LEU A 38 32.159 3.794 7.577 1.00 0.00 H new ATOM 0 HB3 LEU A 38 32.024 2.097 7.993 1.00 0.00 H new ATOM 0 HG LEU A 38 32.913 1.575 5.663 1.00 0.00 H new ATOM 0 HD11 LEU A 38 34.204 3.343 4.545 1.00 0.00 H new ATOM 0 HD12 LEU A 38 32.466 3.719 4.605 1.00 0.00 H new ATOM 0 HD13 LEU A 38 33.590 4.529 5.721 1.00 0.00 H new ATOM 0 HD21 LEU A 38 35.251 1.952 6.320 1.00 0.00 H new ATOM 0 HD22 LEU A 38 34.706 3.047 7.613 1.00 0.00 H new ATOM 0 HD23 LEU A 38 34.270 1.322 7.664 1.00 0.00 H new ATOM 646 N ILE A 39 29.372 4.487 7.677 1.00 0.00 N ATOM 647 CA ILE A 39 28.356 5.032 8.562 1.00 0.00 C ATOM 648 C ILE A 39 26.978 4.849 7.922 1.00 0.00 C ATOM 649 O ILE A 39 26.001 4.567 8.614 1.00 0.00 O ATOM 650 CB ILE A 39 28.679 6.484 8.920 1.00 0.00 C ATOM 651 CG1 ILE A 39 29.098 7.275 7.679 1.00 0.00 C ATOM 652 CG2 ILE A 39 29.734 6.553 10.027 1.00 0.00 C ATOM 653 CD1 ILE A 39 28.391 8.631 7.630 1.00 0.00 C ATOM 0 H ILE A 39 29.965 5.185 7.228 1.00 0.00 H new ATOM 0 HA ILE A 39 28.344 4.490 9.508 1.00 0.00 H new ATOM 0 HB ILE A 39 27.773 6.950 9.308 1.00 0.00 H new ATOM 0 HG12 ILE A 39 30.178 7.424 7.685 1.00 0.00 H new ATOM 0 HG13 ILE A 39 28.860 6.704 6.782 1.00 0.00 H new ATOM 0 HG21 ILE A 39 29.946 7.596 10.263 1.00 0.00 H new ATOM 0 HG22 ILE A 39 29.360 6.048 10.918 1.00 0.00 H new ATOM 0 HG23 ILE A 39 30.648 6.064 9.689 1.00 0.00 H new ATOM 0 HD11 ILE A 39 28.706 9.174 6.739 1.00 0.00 H new ATOM 0 HD12 ILE A 39 27.312 8.478 7.599 1.00 0.00 H new ATOM 0 HD13 ILE A 39 28.650 9.209 8.517 1.00 0.00 H new ATOM 665 N TYR A 40 26.944 5.017 6.609 1.00 0.00 N ATOM 666 CA TYR A 40 25.702 4.874 5.868 1.00 0.00 C ATOM 667 C TYR A 40 24.603 5.756 6.464 1.00 0.00 C ATOM 668 O TYR A 40 24.801 6.382 7.505 1.00 0.00 O ATOM 669 CB TYR A 40 25.294 3.406 6.008 1.00 0.00 C ATOM 670 CG TYR A 40 25.902 2.487 4.947 1.00 0.00 C ATOM 671 CD1 TYR A 40 27.271 2.338 4.865 1.00 0.00 C ATOM 672 CD2 TYR A 40 25.080 1.806 4.072 1.00 0.00 C ATOM 673 CE1 TYR A 40 27.843 1.473 3.866 1.00 0.00 C ATOM 674 CE2 TYR A 40 25.652 0.941 3.073 1.00 0.00 C ATOM 675 CZ TYR A 40 27.006 0.817 3.019 1.00 0.00 C ATOM 676 OH TYR A 40 27.546 0.000 2.076 1.00 0.00 O ATOM 0 H TYR A 40 27.757 5.251 6.038 1.00 0.00 H new ATOM 0 HA TYR A 40 25.839 5.172 4.829 1.00 0.00 H new ATOM 0 HB2 TYR A 40 25.590 3.050 6.995 1.00 0.00 H new ATOM 0 HB3 TYR A 40 24.208 3.335 5.956 1.00 0.00 H new ATOM 0 HD1 TYR A 40 27.914 2.870 5.550 1.00 0.00 H new ATOM 0 HD2 TYR A 40 24.008 1.922 4.137 1.00 0.00 H new ATOM 0 HE1 TYR A 40 28.913 1.348 3.791 1.00 0.00 H new ATOM 0 HE2 TYR A 40 25.020 0.403 2.382 1.00 0.00 H new ATOM 0 HH TYR A 40 26.829 -0.403 1.543 1.00 0.00 H new ATOM 686 N LYS A 41 23.469 5.777 5.780 1.00 0.00 N ATOM 687 CA LYS A 41 22.338 6.572 6.229 1.00 0.00 C ATOM 688 C LYS A 41 21.578 5.803 7.311 1.00 0.00 C ATOM 689 O LYS A 41 21.361 6.318 8.407 1.00 0.00 O ATOM 690 CB LYS A 41 21.467 6.984 5.040 1.00 0.00 C ATOM 691 CG LYS A 41 21.403 8.507 4.909 1.00 0.00 C ATOM 692 CD LYS A 41 22.729 9.068 4.391 1.00 0.00 C ATOM 693 CE LYS A 41 23.273 10.146 5.331 1.00 0.00 C ATOM 694 NZ LYS A 41 24.099 11.118 4.582 1.00 0.00 N ATOM 0 H LYS A 41 23.309 5.256 4.918 1.00 0.00 H new ATOM 0 HA LYS A 41 22.681 7.503 6.680 1.00 0.00 H new ATOM 0 HB2 LYS A 41 21.869 6.553 4.123 1.00 0.00 H new ATOM 0 HB3 LYS A 41 20.461 6.584 5.166 1.00 0.00 H new ATOM 0 HG2 LYS A 41 20.597 8.784 4.230 1.00 0.00 H new ATOM 0 HG3 LYS A 41 21.170 8.950 5.877 1.00 0.00 H new ATOM 0 HD2 LYS A 41 23.457 8.262 4.296 1.00 0.00 H new ATOM 0 HD3 LYS A 41 22.586 9.487 3.395 1.00 0.00 H new ATOM 0 HE2 LYS A 41 22.446 10.662 5.819 1.00 0.00 H new ATOM 0 HE3 LYS A 41 23.869 9.684 6.118 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 24.460 11.842 5.235 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 24.898 10.624 4.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 23.520 11.572 3.847 1.00 0.00 H new ATOM 707 N ASN A 42 21.194 4.583 6.967 1.00 0.00 N ATOM 708 CA ASN A 42 20.463 3.738 7.896 1.00 0.00 C ATOM 709 C ASN A 42 21.435 3.159 8.925 1.00 0.00 C ATOM 710 O ASN A 42 21.609 1.944 9.005 1.00 0.00 O ATOM 711 CB ASN A 42 19.794 2.570 7.168 1.00 0.00 C ATOM 712 CG ASN A 42 20.807 1.800 6.319 1.00 0.00 C ATOM 713 OD1 ASN A 42 22.003 1.823 6.560 1.00 0.00 O ATOM 714 ND2 ASN A 42 20.264 1.118 5.315 1.00 0.00 N ATOM 0 H ASN A 42 21.375 4.159 6.057 1.00 0.00 H new ATOM 0 HA ASN A 42 19.699 4.348 8.378 1.00 0.00 H new ATOM 0 HB2 ASN A 42 19.338 1.898 7.894 1.00 0.00 H new ATOM 0 HB3 ASN A 42 18.992 2.945 6.532 1.00 0.00 H new ATOM 0 HD21 ASN A 42 20.857 0.571 4.691 1.00 0.00 H new ATOM 0 HD22 ASN A 42 19.255 1.142 5.169 1.00 0.00 H new ATOM 721 N THR A 43 22.043 4.056 9.688 1.00 0.00 N ATOM 722 CA THR A 43 22.993 3.649 10.709 1.00 0.00 C ATOM 723 C THR A 43 22.257 3.175 11.964 1.00 0.00 C ATOM 724 O THR A 43 21.166 3.655 12.266 1.00 0.00 O ATOM 725 CB THR A 43 23.941 4.822 10.967 1.00 0.00 C ATOM 726 OG1 THR A 43 24.996 4.253 11.739 1.00 0.00 O ATOM 727 CG2 THR A 43 23.330 5.876 11.892 1.00 0.00 C ATOM 0 H THR A 43 21.896 5.063 9.619 1.00 0.00 H new ATOM 0 HA THR A 43 23.588 2.798 10.379 1.00 0.00 H new ATOM 0 HB THR A 43 24.212 5.285 10.018 1.00 0.00 H new ATOM 0 HG1 THR A 43 25.657 4.945 11.950 1.00 0.00 H new ATOM 0 HG21 THR A 43 24.044 6.686 12.042 1.00 0.00 H new ATOM 0 HG22 THR A 43 22.421 6.273 11.441 1.00 0.00 H new ATOM 0 HG23 THR A 43 23.090 5.421 12.853 1.00 0.00 H new ATOM 735 N LYS A 44 22.884 2.239 12.661 1.00 0.00 N ATOM 736 CA LYS A 44 22.302 1.695 13.876 1.00 0.00 C ATOM 737 C LYS A 44 22.013 2.836 14.853 1.00 0.00 C ATOM 738 O LYS A 44 20.959 3.467 14.781 1.00 0.00 O ATOM 739 CB LYS A 44 23.201 0.601 14.457 1.00 0.00 C ATOM 740 CG LYS A 44 22.743 -0.785 13.999 1.00 0.00 C ATOM 741 CD LYS A 44 23.054 -1.843 15.059 1.00 0.00 C ATOM 742 CE LYS A 44 22.031 -2.980 15.016 1.00 0.00 C ATOM 743 NZ LYS A 44 20.679 -2.473 15.338 1.00 0.00 N ATOM 0 H LYS A 44 23.789 1.843 12.407 1.00 0.00 H new ATOM 0 HA LYS A 44 21.349 1.212 13.659 1.00 0.00 H new ATOM 0 HB2 LYS A 44 24.232 0.769 14.145 1.00 0.00 H new ATOM 0 HB3 LYS A 44 23.185 0.652 15.546 1.00 0.00 H new ATOM 0 HG2 LYS A 44 21.672 -0.770 13.798 1.00 0.00 H new ATOM 0 HG3 LYS A 44 23.239 -1.045 13.064 1.00 0.00 H new ATOM 0 HD2 LYS A 44 24.055 -2.243 14.896 1.00 0.00 H new ATOM 0 HD3 LYS A 44 23.052 -1.384 16.048 1.00 0.00 H new ATOM 0 HE2 LYS A 44 22.028 -3.437 14.027 1.00 0.00 H new ATOM 0 HE3 LYS A 44 22.313 -3.758 15.726 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 20.120 -3.231 15.779 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 20.756 -1.672 15.997 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 20.209 -2.159 14.465 1.00 0.00 H new ATOM 756 N LEU A 45 22.966 3.067 15.743 1.00 0.00 N ATOM 757 CA LEU A 45 22.827 4.121 16.733 1.00 0.00 C ATOM 758 C LEU A 45 21.390 4.133 17.260 1.00 0.00 C ATOM 759 O LEU A 45 20.750 5.182 17.302 1.00 0.00 O ATOM 760 CB LEU A 45 23.281 5.463 16.155 1.00 0.00 C ATOM 761 CG LEU A 45 24.758 5.561 15.768 1.00 0.00 C ATOM 762 CD1 LEU A 45 25.002 6.748 14.834 1.00 0.00 C ATOM 763 CD2 LEU A 45 25.648 5.618 17.012 1.00 0.00 C ATOM 0 H LEU A 45 23.839 2.542 15.799 1.00 0.00 H new ATOM 0 HA LEU A 45 23.479 3.931 17.586 1.00 0.00 H new ATOM 0 HB2 LEU A 45 22.679 5.678 15.272 1.00 0.00 H new ATOM 0 HB3 LEU A 45 23.065 6.243 16.885 1.00 0.00 H new ATOM 0 HG LEU A 45 25.028 4.659 15.220 1.00 0.00 H new ATOM 0 HD11 LEU A 45 26.060 6.795 14.574 1.00 0.00 H new ATOM 0 HD12 LEU A 45 24.410 6.625 13.927 1.00 0.00 H new ATOM 0 HD13 LEU A 45 24.710 7.671 15.335 1.00 0.00 H new ATOM 0 HD21 LEU A 45 26.693 5.687 16.709 1.00 0.00 H new ATOM 0 HD22 LEU A 45 25.384 6.492 17.608 1.00 0.00 H new ATOM 0 HD23 LEU A 45 25.502 4.716 17.606 1.00 0.00 H new ATOM 775 N VAL A 46 20.927 2.954 17.649 1.00 0.00 N ATOM 776 CA VAL A 46 19.578 2.816 18.171 1.00 0.00 C ATOM 777 C VAL A 46 19.471 3.567 19.500 1.00 0.00 C ATOM 778 O VAL A 46 19.439 2.950 20.564 1.00 0.00 O ATOM 779 CB VAL A 46 19.212 1.335 18.290 1.00 0.00 C ATOM 780 CG1 VAL A 46 19.400 0.615 16.953 1.00 0.00 C ATOM 781 CG2 VAL A 46 20.023 0.657 19.396 1.00 0.00 C ATOM 0 H VAL A 46 21.462 2.086 17.613 1.00 0.00 H new ATOM 0 HA VAL A 46 18.856 3.261 17.487 1.00 0.00 H new ATOM 0 HB VAL A 46 18.158 1.271 18.560 1.00 0.00 H new ATOM 0 HG11 VAL A 46 19.133 -0.436 17.065 1.00 0.00 H new ATOM 0 HG12 VAL A 46 18.760 1.074 16.200 1.00 0.00 H new ATOM 0 HG13 VAL A 46 20.441 0.694 16.641 1.00 0.00 H new ATOM 0 HG21 VAL A 46 19.744 -0.395 19.460 1.00 0.00 H new ATOM 0 HG22 VAL A 46 21.086 0.737 19.169 1.00 0.00 H new ATOM 0 HG23 VAL A 46 19.818 1.145 20.349 1.00 0.00 H new ATOM 791 N LYS A 47 19.419 4.886 19.395 1.00 0.00 N ATOM 792 CA LYS A 47 19.316 5.727 20.576 1.00 0.00 C ATOM 793 C LYS A 47 17.962 5.491 21.249 1.00 0.00 C ATOM 794 O LYS A 47 16.959 5.271 20.572 1.00 0.00 O ATOM 795 CB LYS A 47 19.576 7.191 20.215 1.00 0.00 C ATOM 796 CG LYS A 47 18.492 7.725 19.276 1.00 0.00 C ATOM 797 CD LYS A 47 18.927 7.607 17.814 1.00 0.00 C ATOM 798 CE LYS A 47 18.033 6.625 17.054 1.00 0.00 C ATOM 799 NZ LYS A 47 17.141 7.350 16.122 1.00 0.00 N ATOM 0 H LYS A 47 19.446 5.394 18.511 1.00 0.00 H new ATOM 0 HA LYS A 47 20.084 5.460 21.302 1.00 0.00 H new ATOM 0 HB2 LYS A 47 19.605 7.794 21.123 1.00 0.00 H new ATOM 0 HB3 LYS A 47 20.552 7.284 19.739 1.00 0.00 H new ATOM 0 HG2 LYS A 47 17.567 7.170 19.430 1.00 0.00 H new ATOM 0 HG3 LYS A 47 18.281 8.768 19.514 1.00 0.00 H new ATOM 0 HD2 LYS A 47 18.884 8.587 17.338 1.00 0.00 H new ATOM 0 HD3 LYS A 47 19.964 7.274 17.765 1.00 0.00 H new ATOM 0 HE2 LYS A 47 18.649 5.917 16.500 1.00 0.00 H new ATOM 0 HE3 LYS A 47 17.438 6.045 17.759 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 16.541 6.668 15.615 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 16.540 8.008 16.658 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 17.714 7.884 15.438 1.00 0.00 H new ATOM 812 N LYS A 48 17.978 5.545 22.572 1.00 0.00 N ATOM 813 CA LYS A 48 16.764 5.340 23.344 1.00 0.00 C ATOM 814 C LYS A 48 15.779 6.472 23.049 1.00 0.00 C ATOM 815 O LYS A 48 16.137 7.647 23.125 1.00 0.00 O ATOM 816 CB LYS A 48 17.094 5.184 24.830 1.00 0.00 C ATOM 817 CG LYS A 48 17.956 6.347 25.326 1.00 0.00 C ATOM 818 CD LYS A 48 18.015 6.373 26.854 1.00 0.00 C ATOM 819 CE LYS A 48 16.765 7.032 27.440 1.00 0.00 C ATOM 820 NZ LYS A 48 17.042 7.555 28.796 1.00 0.00 N ATOM 0 H LYS A 48 18.812 5.728 23.130 1.00 0.00 H new ATOM 0 HA LYS A 48 16.278 4.410 23.049 1.00 0.00 H new ATOM 0 HB2 LYS A 48 16.171 5.138 25.408 1.00 0.00 H new ATOM 0 HB3 LYS A 48 17.619 4.243 24.993 1.00 0.00 H new ATOM 0 HG2 LYS A 48 18.964 6.256 24.921 1.00 0.00 H new ATOM 0 HG3 LYS A 48 17.549 7.289 24.958 1.00 0.00 H new ATOM 0 HD2 LYS A 48 18.107 5.356 27.235 1.00 0.00 H new ATOM 0 HD3 LYS A 48 18.903 6.916 27.178 1.00 0.00 H new ATOM 0 HE2 LYS A 48 16.436 7.844 26.791 1.00 0.00 H new ATOM 0 HE3 LYS A 48 15.951 6.308 27.482 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 16.183 7.999 29.179 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 17.334 6.773 29.417 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 17.804 8.261 28.747 1.00 0.00 H new ATOM 833 N ILE A 49 14.558 6.080 22.718 1.00 0.00 N ATOM 834 CA ILE A 49 13.518 7.048 22.411 1.00 0.00 C ATOM 835 C ILE A 49 13.527 8.152 23.470 1.00 0.00 C ATOM 836 O ILE A 49 14.117 7.990 24.537 1.00 0.00 O ATOM 837 CB ILE A 49 12.165 6.351 22.259 1.00 0.00 C ATOM 838 CG1 ILE A 49 11.851 6.077 20.787 1.00 0.00 C ATOM 839 CG2 ILE A 49 11.056 7.153 22.943 1.00 0.00 C ATOM 840 CD1 ILE A 49 11.872 7.372 19.972 1.00 0.00 C ATOM 0 H ILE A 49 14.265 5.105 22.656 1.00 0.00 H new ATOM 0 HA ILE A 49 13.713 7.526 21.451 1.00 0.00 H new ATOM 0 HB ILE A 49 12.220 5.385 22.761 1.00 0.00 H new ATOM 0 HG12 ILE A 49 12.579 5.375 20.381 1.00 0.00 H new ATOM 0 HG13 ILE A 49 10.872 5.605 20.702 1.00 0.00 H new ATOM 0 HG21 ILE A 49 10.104 6.636 22.820 1.00 0.00 H new ATOM 0 HG22 ILE A 49 11.281 7.252 24.005 1.00 0.00 H new ATOM 0 HG23 ILE A 49 10.992 8.143 22.492 1.00 0.00 H new ATOM 0 HD11 ILE A 49 11.646 7.149 18.929 1.00 0.00 H new ATOM 0 HD12 ILE A 49 11.126 8.062 20.366 1.00 0.00 H new ATOM 0 HD13 ILE A 49 12.860 7.828 20.040 1.00 0.00 H new ATOM 852 N ASP A 50 12.864 9.251 23.139 1.00 0.00 N ATOM 853 CA ASP A 50 12.787 10.381 24.048 1.00 0.00 C ATOM 854 C ASP A 50 14.202 10.809 24.443 1.00 0.00 C ATOM 855 O ASP A 50 14.823 10.191 25.307 1.00 0.00 O ATOM 856 CB ASP A 50 12.031 10.010 25.326 1.00 0.00 C ATOM 857 CG ASP A 50 10.763 10.825 25.586 1.00 0.00 C ATOM 858 OD1 ASP A 50 10.560 11.897 24.997 1.00 0.00 O ATOM 859 OD2 ASP A 50 9.952 10.310 26.447 1.00 0.00 O ATOM 0 H ASP A 50 12.375 9.382 22.253 1.00 0.00 H new ATOM 0 HA ASP A 50 12.260 11.188 23.539 1.00 0.00 H new ATOM 0 HB2 ASP A 50 11.763 8.954 25.278 1.00 0.00 H new ATOM 0 HB3 ASP A 50 12.703 10.130 26.176 1.00 0.00 H new ATOM 865 N HIS A 51 14.670 11.864 23.792 1.00 0.00 N ATOM 866 CA HIS A 51 16.000 12.382 24.065 1.00 0.00 C ATOM 867 C HIS A 51 15.899 13.591 24.996 1.00 0.00 C ATOM 868 O HIS A 51 16.203 13.492 26.184 1.00 0.00 O ATOM 869 CB HIS A 51 16.738 12.696 22.762 1.00 0.00 C ATOM 870 CG HIS A 51 16.309 11.843 21.592 1.00 0.00 C ATOM 871 ND1 HIS A 51 16.539 10.480 21.534 1.00 0.00 N ATOM 872 CD2 HIS A 51 15.663 12.175 20.438 1.00 0.00 C ATOM 873 CE1 HIS A 51 16.049 10.021 20.391 1.00 0.00 C ATOM 874 NE2 HIS A 51 15.507 11.073 19.713 1.00 0.00 N ATOM 0 H HIS A 51 14.152 12.374 23.076 1.00 0.00 H new ATOM 0 HA HIS A 51 16.592 11.623 24.576 1.00 0.00 H new ATOM 0 HB2 HIS A 51 16.580 13.745 22.511 1.00 0.00 H new ATOM 0 HB3 HIS A 51 17.808 12.564 22.922 1.00 0.00 H new ATOM 0 HD2 HIS A 51 15.334 13.166 20.161 1.00 0.00 H new ATOM 0 HE1 HIS A 51 16.074 8.995 20.056 1.00 0.00 H new ATOM 0 HE2 HIS A 51 15.056 11.022 18.800 1.00 0.00 H new ATOM 882 N ALA A 52 15.471 14.706 24.421 1.00 0.00 N ATOM 883 CA ALA A 52 15.326 15.934 25.184 1.00 0.00 C ATOM 884 C ALA A 52 14.512 16.942 24.371 1.00 0.00 C ATOM 885 O ALA A 52 14.402 16.817 23.152 1.00 0.00 O ATOM 886 CB ALA A 52 16.710 16.468 25.559 1.00 0.00 C ATOM 0 H ALA A 52 15.220 14.784 23.435 1.00 0.00 H new ATOM 0 HA ALA A 52 14.786 15.748 26.112 1.00 0.00 H new ATOM 0 HB1 ALA A 52 16.602 17.389 26.131 1.00 0.00 H new ATOM 0 HB2 ALA A 52 17.235 15.726 26.161 1.00 0.00 H new ATOM 0 HB3 ALA A 52 17.280 16.669 24.652 1.00 0.00 H new ATOM 892 N LYS A 53 13.963 17.918 25.078 1.00 0.00 N ATOM 893 CA LYS A 53 13.162 18.948 24.437 1.00 0.00 C ATOM 894 C LYS A 53 13.657 20.325 24.884 1.00 0.00 C ATOM 895 O LYS A 53 12.864 21.166 25.304 1.00 0.00 O ATOM 896 CB LYS A 53 11.674 18.712 24.702 1.00 0.00 C ATOM 897 CG LYS A 53 11.361 18.818 26.196 1.00 0.00 C ATOM 898 CD LYS A 53 9.996 18.204 26.515 1.00 0.00 C ATOM 899 CE LYS A 53 8.883 19.245 26.385 1.00 0.00 C ATOM 900 NZ LYS A 53 8.550 19.475 24.962 1.00 0.00 N ATOM 0 H LYS A 53 14.057 18.018 26.089 1.00 0.00 H new ATOM 0 HA LYS A 53 13.279 18.904 23.354 1.00 0.00 H new ATOM 0 HB2 LYS A 53 11.082 19.442 24.150 1.00 0.00 H new ATOM 0 HB3 LYS A 53 11.387 17.726 24.335 1.00 0.00 H new ATOM 0 HG2 LYS A 53 12.136 18.310 26.770 1.00 0.00 H new ATOM 0 HG3 LYS A 53 11.373 19.865 26.500 1.00 0.00 H new ATOM 0 HD2 LYS A 53 9.801 17.371 25.839 1.00 0.00 H new ATOM 0 HD3 LYS A 53 10.003 17.798 27.527 1.00 0.00 H new ATOM 0 HE2 LYS A 53 7.997 18.907 26.922 1.00 0.00 H new ATOM 0 HE3 LYS A 53 9.197 20.181 26.847 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 7.544 19.724 24.877 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 9.132 20.253 24.591 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 8.740 18.610 24.417 1.00 0.00 H new ATOM 913 N VAL A 54 14.964 20.512 24.779 1.00 0.00 N ATOM 914 CA VAL A 54 15.573 21.772 25.168 1.00 0.00 C ATOM 915 C VAL A 54 15.763 22.646 23.927 1.00 0.00 C ATOM 916 O VAL A 54 16.885 23.028 23.597 1.00 0.00 O ATOM 917 CB VAL A 54 16.880 21.512 25.921 1.00 0.00 C ATOM 918 CG1 VAL A 54 16.611 20.833 27.266 1.00 0.00 C ATOM 919 CG2 VAL A 54 17.846 20.684 25.072 1.00 0.00 C ATOM 0 H VAL A 54 15.618 19.812 24.430 1.00 0.00 H new ATOM 0 HA VAL A 54 14.922 22.315 25.852 1.00 0.00 H new ATOM 0 HB VAL A 54 17.350 22.475 26.120 1.00 0.00 H new ATOM 0 HG11 VAL A 54 17.556 20.659 27.781 1.00 0.00 H new ATOM 0 HG12 VAL A 54 15.977 21.475 27.877 1.00 0.00 H new ATOM 0 HG13 VAL A 54 16.108 19.880 27.099 1.00 0.00 H new ATOM 0 HG21 VAL A 54 18.767 20.514 25.630 1.00 0.00 H new ATOM 0 HG22 VAL A 54 17.387 19.726 24.828 1.00 0.00 H new ATOM 0 HG23 VAL A 54 18.074 21.222 24.152 1.00 0.00 H new ATOM 929 N ARG A 55 14.649 22.938 23.271 1.00 0.00 N ATOM 930 CA ARG A 55 14.678 23.760 22.074 1.00 0.00 C ATOM 931 C ARG A 55 13.854 25.032 22.282 1.00 0.00 C ATOM 932 O ARG A 55 12.693 25.096 21.882 1.00 0.00 O ATOM 933 CB ARG A 55 14.127 22.996 20.868 1.00 0.00 C ATOM 934 CG ARG A 55 14.813 23.444 19.575 1.00 0.00 C ATOM 935 CD ARG A 55 16.255 22.937 19.516 1.00 0.00 C ATOM 936 NE ARG A 55 16.860 23.285 18.210 1.00 0.00 N ATOM 937 CZ ARG A 55 18.189 23.366 17.990 1.00 0.00 C ATOM 938 NH1 ARG A 55 19.066 23.126 18.989 1.00 0.00 N ATOM 939 NH2 ARG A 55 18.620 23.685 16.784 1.00 0.00 N ATOM 0 H ARG A 55 13.720 22.619 23.547 1.00 0.00 H new ATOM 0 HA ARG A 55 15.717 24.024 21.879 1.00 0.00 H new ATOM 0 HB2 ARG A 55 14.277 21.926 21.011 1.00 0.00 H new ATOM 0 HB3 ARG A 55 13.052 23.160 20.789 1.00 0.00 H new ATOM 0 HG2 ARG A 55 14.257 23.070 18.715 1.00 0.00 H new ATOM 0 HG3 ARG A 55 14.803 24.532 19.512 1.00 0.00 H new ATOM 0 HD2 ARG A 55 16.838 23.377 20.325 1.00 0.00 H new ATOM 0 HD3 ARG A 55 16.276 21.857 19.660 1.00 0.00 H new ATOM 0 HE ARG A 55 16.233 23.475 17.428 1.00 0.00 H new ATOM 0 HH11 ARG A 55 18.725 22.881 19.919 1.00 0.00 H new ATOM 0 HH12 ARG A 55 20.069 23.190 18.814 1.00 0.00 H new ATOM 0 HH21 ARG A 55 17.952 23.866 16.035 1.00 0.00 H new ATOM 0 HH22 ARG A 55 19.621 23.750 16.601 1.00 0.00 H new ATOM 952 N LYS A 56 14.487 26.013 22.909 1.00 0.00 N ATOM 953 CA LYS A 56 13.827 27.279 23.176 1.00 0.00 C ATOM 954 C LYS A 56 14.823 28.422 22.971 1.00 0.00 C ATOM 955 O LYS A 56 15.474 28.861 23.919 1.00 0.00 O ATOM 956 CB LYS A 56 13.183 27.266 24.564 1.00 0.00 C ATOM 957 CG LYS A 56 14.233 27.038 25.653 1.00 0.00 C ATOM 958 CD LYS A 56 14.148 28.119 26.733 1.00 0.00 C ATOM 959 CE LYS A 56 12.993 27.840 27.697 1.00 0.00 C ATOM 960 NZ LYS A 56 11.768 28.545 27.256 1.00 0.00 N ATOM 0 H LYS A 56 15.450 25.956 23.240 1.00 0.00 H new ATOM 0 HA LYS A 56 13.010 27.438 22.472 1.00 0.00 H new ATOM 0 HB2 LYS A 56 12.671 28.212 24.740 1.00 0.00 H new ATOM 0 HB3 LYS A 56 12.428 26.481 24.611 1.00 0.00 H new ATOM 0 HG2 LYS A 56 14.087 26.056 26.104 1.00 0.00 H new ATOM 0 HG3 LYS A 56 15.229 27.040 25.209 1.00 0.00 H new ATOM 0 HD2 LYS A 56 15.086 28.160 27.286 1.00 0.00 H new ATOM 0 HD3 LYS A 56 14.010 29.094 26.266 1.00 0.00 H new ATOM 0 HE2 LYS A 56 12.804 26.768 27.747 1.00 0.00 H new ATOM 0 HE3 LYS A 56 13.264 28.163 28.702 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 11.084 28.574 28.039 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 12.010 29.515 26.971 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 11.349 28.041 26.449 1.00 0.00 H new ATOM 973 N HIS A 57 14.912 28.871 21.728 1.00 0.00 N ATOM 974 CA HIS A 57 15.818 29.955 21.387 1.00 0.00 C ATOM 975 C HIS A 57 15.031 31.100 20.748 1.00 0.00 C ATOM 976 O HIS A 57 14.080 31.610 21.339 1.00 0.00 O ATOM 977 CB HIS A 57 16.957 29.451 20.498 1.00 0.00 C ATOM 978 CG HIS A 57 16.493 28.743 19.248 1.00 0.00 C ATOM 979 ND1 HIS A 57 15.729 27.589 19.279 1.00 0.00 N ATOM 980 CD2 HIS A 57 16.692 29.038 17.931 1.00 0.00 C ATOM 981 CE1 HIS A 57 15.486 27.215 18.031 1.00 0.00 C ATOM 982 NE2 HIS A 57 16.084 28.113 17.197 1.00 0.00 N ATOM 0 H HIS A 57 14.372 28.504 20.944 1.00 0.00 H new ATOM 0 HA HIS A 57 16.285 30.342 22.293 1.00 0.00 H new ATOM 0 HB2 HIS A 57 17.583 30.296 20.213 1.00 0.00 H new ATOM 0 HB3 HIS A 57 17.583 28.772 21.077 1.00 0.00 H new ATOM 0 HD2 HIS A 57 17.249 29.881 17.550 1.00 0.00 H new ATOM 0 HE1 HIS A 57 14.914 26.350 17.728 1.00 0.00 H new ATOM 0 HE2 HIS A 57 16.067 28.080 16.178 1.00 0.00 H new ATOM 990 N GLN A 58 15.456 31.472 19.549 1.00 0.00 N ATOM 991 CA GLN A 58 14.802 32.548 18.824 1.00 0.00 C ATOM 992 C GLN A 58 14.441 33.688 19.777 1.00 0.00 C ATOM 993 O GLN A 58 13.288 33.821 20.184 1.00 0.00 O ATOM 994 CB GLN A 58 13.563 32.038 18.085 1.00 0.00 C ATOM 995 CG GLN A 58 13.657 32.334 16.587 1.00 0.00 C ATOM 996 CD GLN A 58 12.888 31.292 15.773 1.00 0.00 C ATOM 997 OE1 GLN A 58 11.795 31.530 15.286 1.00 0.00 O ATOM 998 NE2 GLN A 58 13.518 30.127 15.652 1.00 0.00 N ATOM 0 H GLN A 58 16.245 31.047 19.062 1.00 0.00 H new ATOM 0 HA GLN A 58 15.498 32.931 18.078 1.00 0.00 H new ATOM 0 HB2 GLN A 58 13.458 30.964 18.241 1.00 0.00 H new ATOM 0 HB3 GLN A 58 12.670 32.509 18.497 1.00 0.00 H new ATOM 0 HG2 GLN A 58 13.257 33.327 16.383 1.00 0.00 H new ATOM 0 HG3 GLN A 58 14.703 32.342 16.279 1.00 0.00 H new ATOM 0 HE21 GLN A 58 14.432 29.994 16.085 1.00 0.00 H new ATOM 0 HE22 GLN A 58 13.087 29.366 15.126 1.00 0.00 H new ATOM 1007 N ARG A 59 15.449 34.483 20.107 1.00 0.00 N ATOM 1008 CA ARG A 59 15.252 35.608 21.005 1.00 0.00 C ATOM 1009 C ARG A 59 14.606 36.776 20.259 1.00 0.00 C ATOM 1010 O ARG A 59 14.547 36.776 19.030 1.00 0.00 O ATOM 1011 CB ARG A 59 16.581 36.069 21.609 1.00 0.00 C ATOM 1012 CG ARG A 59 17.164 35.000 22.534 1.00 0.00 C ATOM 1013 CD ARG A 59 18.634 35.285 22.844 1.00 0.00 C ATOM 1014 NE ARG A 59 19.491 34.237 22.246 1.00 0.00 N ATOM 1015 CZ ARG A 59 20.723 33.918 22.696 1.00 0.00 C ATOM 1016 NH1 ARG A 59 21.254 34.565 23.755 1.00 0.00 N ATOM 1017 NH2 ARG A 59 21.400 32.964 22.085 1.00 0.00 N ATOM 0 H ARG A 59 16.404 34.370 19.768 1.00 0.00 H new ATOM 0 HA ARG A 59 14.594 35.279 21.810 1.00 0.00 H new ATOM 0 HB2 ARG A 59 17.290 36.290 20.811 1.00 0.00 H new ATOM 0 HB3 ARG A 59 16.430 36.994 22.166 1.00 0.00 H new ATOM 0 HG2 ARG A 59 16.593 34.966 23.462 1.00 0.00 H new ATOM 0 HG3 ARG A 59 17.071 34.020 22.067 1.00 0.00 H new ATOM 0 HD2 ARG A 59 18.914 36.263 22.451 1.00 0.00 H new ATOM 0 HD3 ARG A 59 18.787 35.319 23.923 1.00 0.00 H new ATOM 0 HE ARG A 59 19.128 33.723 21.443 1.00 0.00 H new ATOM 0 HH11 ARG A 59 20.724 35.301 24.221 1.00 0.00 H new ATOM 0 HH12 ARG A 59 22.186 34.318 24.089 1.00 0.00 H new ATOM 0 HH21 ARG A 59 20.991 32.480 21.286 1.00 0.00 H new ATOM 0 HH22 ARG A 59 22.332 32.711 22.412 1.00 0.00 H new ATOM 1030 N LYS A 60 14.136 37.743 21.033 1.00 0.00 N ATOM 1031 CA LYS A 60 13.496 38.915 20.460 1.00 0.00 C ATOM 1032 C LYS A 60 13.584 40.076 21.453 1.00 0.00 C ATOM 1033 O LYS A 60 14.110 39.917 22.554 1.00 0.00 O ATOM 1034 CB LYS A 60 12.066 38.586 20.026 1.00 0.00 C ATOM 1035 CG LYS A 60 11.136 38.479 21.236 1.00 0.00 C ATOM 1036 CD LYS A 60 11.357 37.161 21.982 1.00 0.00 C ATOM 1037 CE LYS A 60 10.051 36.373 22.099 1.00 0.00 C ATOM 1038 NZ LYS A 60 10.188 35.290 23.099 1.00 0.00 N ATOM 0 H LYS A 60 14.186 37.739 22.052 1.00 0.00 H new ATOM 0 HA LYS A 60 14.016 39.228 19.555 1.00 0.00 H new ATOM 0 HB2 LYS A 60 11.701 39.359 19.349 1.00 0.00 H new ATOM 0 HB3 LYS A 60 12.057 37.647 19.472 1.00 0.00 H new ATOM 0 HG2 LYS A 60 11.313 39.317 21.910 1.00 0.00 H new ATOM 0 HG3 LYS A 60 10.098 38.546 20.909 1.00 0.00 H new ATOM 0 HD2 LYS A 60 12.102 36.562 21.457 1.00 0.00 H new ATOM 0 HD3 LYS A 60 11.754 37.364 22.977 1.00 0.00 H new ATOM 0 HE2 LYS A 60 9.240 37.042 22.387 1.00 0.00 H new ATOM 0 HE3 LYS A 60 9.786 35.950 21.130 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 9.293 34.765 23.167 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 10.948 34.643 22.808 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 10.419 35.701 24.026 1.00 0.00 H new ATOM 1051 N PHE A 61 13.062 41.217 21.029 1.00 0.00 N ATOM 1052 CA PHE A 61 13.075 42.404 21.867 1.00 0.00 C ATOM 1053 C PHE A 61 12.298 43.547 21.212 1.00 0.00 C ATOM 1054 O PHE A 61 12.497 43.843 20.034 1.00 0.00 O ATOM 1055 CB PHE A 61 14.538 42.823 22.026 1.00 0.00 C ATOM 1056 CG PHE A 61 15.235 43.163 20.706 1.00 0.00 C ATOM 1057 CD1 PHE A 61 15.637 42.166 19.873 1.00 0.00 C ATOM 1058 CD2 PHE A 61 15.452 44.461 20.367 1.00 0.00 C ATOM 1059 CE1 PHE A 61 16.283 42.481 18.649 1.00 0.00 C ATOM 1060 CE2 PHE A 61 16.099 44.777 19.143 1.00 0.00 C ATOM 1061 CZ PHE A 61 16.501 43.780 18.309 1.00 0.00 C ATOM 0 H PHE A 61 12.627 41.345 20.115 1.00 0.00 H new ATOM 0 HA PHE A 61 12.607 42.186 22.827 1.00 0.00 H new ATOM 0 HB2 PHE A 61 14.587 43.690 22.685 1.00 0.00 H new ATOM 0 HB3 PHE A 61 15.085 42.018 22.517 1.00 0.00 H new ATOM 0 HD1 PHE A 61 15.465 41.135 20.143 1.00 0.00 H new ATOM 0 HD2 PHE A 61 15.132 45.252 21.029 1.00 0.00 H new ATOM 0 HE1 PHE A 61 16.602 41.689 17.987 1.00 0.00 H new ATOM 0 HE2 PHE A 61 16.272 45.809 18.874 1.00 0.00 H new ATOM 0 HZ PHE A 61 16.993 44.020 17.378 1.00 0.00 H new ATOM 1071 N LEU A 62 11.429 44.159 22.003 1.00 0.00 N ATOM 1072 CA LEU A 62 10.621 45.264 21.514 1.00 0.00 C ATOM 1073 C LEU A 62 9.941 45.955 22.697 1.00 0.00 C ATOM 1074 O LEU A 62 9.969 45.448 23.817 1.00 0.00 O ATOM 1075 CB LEU A 62 9.644 44.779 20.441 1.00 0.00 C ATOM 1076 CG LEU A 62 8.316 44.214 20.949 1.00 0.00 C ATOM 1077 CD1 LEU A 62 7.200 45.255 20.841 1.00 0.00 C ATOM 1078 CD2 LEU A 62 7.960 42.915 20.223 1.00 0.00 C ATOM 0 H LEU A 62 11.267 43.911 22.979 1.00 0.00 H new ATOM 0 HA LEU A 62 11.250 46.010 21.027 1.00 0.00 H new ATOM 0 HB2 LEU A 62 9.429 45.611 19.771 1.00 0.00 H new ATOM 0 HB3 LEU A 62 10.139 44.011 19.847 1.00 0.00 H new ATOM 0 HG LEU A 62 8.429 43.972 22.006 1.00 0.00 H new ATOM 0 HD11 LEU A 62 6.267 44.828 21.209 1.00 0.00 H new ATOM 0 HD12 LEU A 62 7.459 46.129 21.438 1.00 0.00 H new ATOM 0 HD13 LEU A 62 7.078 45.551 19.799 1.00 0.00 H new ATOM 0 HD21 LEU A 62 7.012 42.534 20.603 1.00 0.00 H new ATOM 0 HD22 LEU A 62 7.872 43.108 19.154 1.00 0.00 H new ATOM 0 HD23 LEU A 62 8.743 42.176 20.395 1.00 0.00 H new ATOM 1090 N GLN A 63 9.347 47.103 22.408 1.00 0.00 N ATOM 1091 CA GLN A 63 8.661 47.870 23.435 1.00 0.00 C ATOM 1092 C GLN A 63 7.785 46.950 24.288 1.00 0.00 C ATOM 1093 O GLN A 63 7.576 45.789 23.941 1.00 0.00 O ATOM 1094 CB GLN A 63 7.832 48.997 22.815 1.00 0.00 C ATOM 1095 CG GLN A 63 6.619 48.439 22.068 1.00 0.00 C ATOM 1096 CD GLN A 63 5.987 49.507 21.172 1.00 0.00 C ATOM 1097 OE1 GLN A 63 5.723 50.624 21.586 1.00 0.00 O ATOM 1098 NE2 GLN A 63 5.760 49.102 19.926 1.00 0.00 N ATOM 0 H GLN A 63 9.326 47.521 21.478 1.00 0.00 H new ATOM 0 HA GLN A 63 9.410 48.328 24.081 1.00 0.00 H new ATOM 0 HB2 GLN A 63 7.499 49.681 23.596 1.00 0.00 H new ATOM 0 HB3 GLN A 63 8.452 49.574 22.129 1.00 0.00 H new ATOM 0 HG2 GLN A 63 6.922 47.584 21.463 1.00 0.00 H new ATOM 0 HG3 GLN A 63 5.881 48.077 22.784 1.00 0.00 H new ATOM 0 HE21 GLN A 63 6.006 48.153 19.646 1.00 0.00 H new ATOM 0 HE22 GLN A 63 5.340 49.741 19.251 1.00 0.00 H new ATOM 1107 N ALA A 64 7.295 47.505 25.387 1.00 0.00 N ATOM 1108 CA ALA A 64 6.447 46.748 26.292 1.00 0.00 C ATOM 1109 C ALA A 64 5.460 47.699 26.973 1.00 0.00 C ATOM 1110 O ALA A 64 4.914 47.381 28.028 1.00 0.00 O ATOM 1111 CB ALA A 64 7.318 45.994 27.298 1.00 0.00 C ATOM 0 H ALA A 64 7.469 48.469 25.671 1.00 0.00 H new ATOM 0 HA ALA A 64 5.866 46.006 25.744 1.00 0.00 H new ATOM 0 HB1 ALA A 64 6.682 45.426 27.977 1.00 0.00 H new ATOM 0 HB2 ALA A 64 7.981 45.312 26.766 1.00 0.00 H new ATOM 0 HB3 ALA A 64 7.913 46.706 27.869 1.00 0.00 H new ATOM 1117 N ILE A 65 5.262 48.847 26.341 1.00 0.00 N ATOM 1118 CA ILE A 65 4.350 49.846 26.873 1.00 0.00 C ATOM 1119 C ILE A 65 2.915 49.324 26.776 1.00 0.00 C ATOM 1120 O ILE A 65 2.000 49.903 27.359 1.00 0.00 O ATOM 1121 CB ILE A 65 4.564 51.191 26.176 1.00 0.00 C ATOM 1122 CG1 ILE A 65 3.694 51.303 24.922 1.00 0.00 C ATOM 1123 CG2 ILE A 65 6.045 51.420 25.868 1.00 0.00 C ATOM 1124 CD1 ILE A 65 3.902 52.651 24.229 1.00 0.00 C ATOM 0 H ILE A 65 5.717 49.107 25.466 1.00 0.00 H new ATOM 0 HA ILE A 65 4.553 50.024 27.929 1.00 0.00 H new ATOM 0 HB ILE A 65 4.251 51.982 26.857 1.00 0.00 H new ATOM 0 HG12 ILE A 65 3.937 50.494 24.233 1.00 0.00 H new ATOM 0 HG13 ILE A 65 2.644 51.187 25.192 1.00 0.00 H new ATOM 0 HG21 ILE A 65 6.169 52.383 25.373 1.00 0.00 H new ATOM 0 HG22 ILE A 65 6.615 51.414 26.797 1.00 0.00 H new ATOM 0 HG23 ILE A 65 6.408 50.627 25.214 1.00 0.00 H new ATOM 0 HD11 ILE A 65 3.272 52.705 23.341 1.00 0.00 H new ATOM 0 HD12 ILE A 65 3.635 53.457 24.913 1.00 0.00 H new ATOM 0 HD13 ILE A 65 4.948 52.753 23.939 1.00 0.00 H new ATOM 1136 N HIS A 66 2.764 48.236 26.035 1.00 0.00 N ATOM 1137 CA HIS A 66 1.456 47.630 25.854 1.00 0.00 C ATOM 1138 C HIS A 66 0.401 48.726 25.686 1.00 0.00 C ATOM 1139 O HIS A 66 0.274 49.311 24.611 1.00 0.00 O ATOM 1140 CB HIS A 66 1.138 46.672 27.003 1.00 0.00 C ATOM 1141 CG HIS A 66 1.902 45.371 26.948 1.00 0.00 C ATOM 1142 ND1 HIS A 66 1.956 44.581 25.812 1.00 0.00 N ATOM 1143 CD2 HIS A 66 2.642 44.731 27.898 1.00 0.00 C ATOM 1144 CE1 HIS A 66 2.697 43.516 26.079 1.00 0.00 C ATOM 1145 NE2 HIS A 66 3.121 43.610 27.372 1.00 0.00 N ATOM 0 H HIS A 66 3.526 47.759 25.553 1.00 0.00 H new ATOM 0 HA HIS A 66 1.452 47.029 24.945 1.00 0.00 H new ATOM 0 HB2 HIS A 66 1.356 47.170 27.948 1.00 0.00 H new ATOM 0 HB3 HIS A 66 0.070 46.455 26.996 1.00 0.00 H new ATOM 0 HD2 HIS A 66 2.810 45.077 28.907 1.00 0.00 H new ATOM 0 HE1 HIS A 66 2.925 42.714 25.393 1.00 0.00 H new ATOM 0 HE2 HIS A 66 3.709 42.931 27.855 1.00 0.00 H new ATOM 1153 N GLN A 67 -0.328 48.971 26.765 1.00 0.00 N ATOM 1154 CA GLN A 67 -1.368 49.986 26.750 1.00 0.00 C ATOM 1155 C GLN A 67 -0.878 51.257 27.448 1.00 0.00 C ATOM 1156 O GLN A 67 -0.147 51.185 28.434 1.00 0.00 O ATOM 1157 CB GLN A 67 -2.652 49.465 27.398 1.00 0.00 C ATOM 1158 CG GLN A 67 -3.685 49.080 26.337 1.00 0.00 C ATOM 1159 CD GLN A 67 -4.122 50.304 25.529 1.00 0.00 C ATOM 1160 OE1 GLN A 67 -4.260 51.402 26.042 1.00 0.00 O ATOM 1161 NE2 GLN A 67 -4.331 50.054 24.240 1.00 0.00 N ATOM 0 H GLN A 67 -0.219 48.484 27.655 1.00 0.00 H new ATOM 0 HA GLN A 67 -1.597 50.229 25.712 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -2.424 48.599 28.020 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -3.068 50.229 28.055 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -3.263 48.330 25.668 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -4.553 48.627 26.816 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -4.197 49.111 23.875 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -4.625 50.805 23.616 1.00 0.00 H new ATOM 1170 N LEU A 68 -1.302 52.390 26.908 1.00 0.00 N ATOM 1171 CA LEU A 68 -0.916 53.675 27.466 1.00 0.00 C ATOM 1172 C LEU A 68 -1.925 54.083 28.542 1.00 0.00 C ATOM 1173 O LEU A 68 -1.574 54.197 29.715 1.00 0.00 O ATOM 1174 CB LEU A 68 -0.749 54.713 26.355 1.00 0.00 C ATOM 1175 CG LEU A 68 0.413 54.480 25.388 1.00 0.00 C ATOM 1176 CD1 LEU A 68 0.295 55.384 24.160 1.00 0.00 C ATOM 1177 CD2 LEU A 68 1.759 54.649 26.097 1.00 0.00 C ATOM 0 H LEU A 68 -1.909 52.445 26.090 1.00 0.00 H new ATOM 0 HA LEU A 68 0.057 53.602 27.952 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -1.673 54.751 25.778 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -0.621 55.692 26.816 1.00 0.00 H new ATOM 0 HG LEU A 68 0.362 53.450 25.035 1.00 0.00 H new ATOM 0 HD11 LEU A 68 1.134 55.198 23.489 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -0.639 55.172 23.640 1.00 0.00 H new ATOM 0 HD13 LEU A 68 0.306 56.428 24.474 1.00 0.00 H new ATOM 0 HD21 LEU A 68 2.568 54.478 25.387 1.00 0.00 H new ATOM 0 HD22 LEU A 68 1.835 55.660 26.497 1.00 0.00 H new ATOM 0 HD23 LEU A 68 1.834 53.930 26.912 1.00 0.00 H new ATOM 1189 N ARG A 69 -3.158 54.291 28.104 1.00 0.00 N ATOM 1190 CA ARG A 69 -4.220 54.683 29.014 1.00 0.00 C ATOM 1191 C ARG A 69 -3.924 56.060 29.612 1.00 0.00 C ATOM 1192 O ARG A 69 -2.864 56.272 30.197 1.00 0.00 O ATOM 1193 CB ARG A 69 -4.378 53.666 30.147 1.00 0.00 C ATOM 1194 CG ARG A 69 -5.498 52.672 29.838 1.00 0.00 C ATOM 1195 CD ARG A 69 -4.928 51.304 29.456 1.00 0.00 C ATOM 1196 NE ARG A 69 -5.589 50.241 30.245 1.00 0.00 N ATOM 1197 CZ ARG A 69 -5.243 49.910 31.507 1.00 0.00 C ATOM 1198 NH1 ARG A 69 -4.238 50.557 32.135 1.00 0.00 N ATOM 1199 NH2 ARG A 69 -5.902 48.943 32.119 1.00 0.00 N ATOM 0 H ARG A 69 -3.445 54.195 27.130 1.00 0.00 H new ATOM 0 HA ARG A 69 -5.148 54.722 28.444 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -3.440 53.129 30.292 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -4.596 54.186 31.080 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -6.148 52.569 30.707 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -6.113 53.054 29.023 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -5.077 51.124 28.391 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -3.853 51.286 29.635 1.00 0.00 H new ATOM 0 HE ARG A 69 -6.354 49.726 29.808 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -3.733 51.303 31.656 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -3.983 50.300 33.089 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -6.660 48.459 31.638 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -5.653 48.681 33.073 1.00 0.00 H new ATOM 1212 N SER A 70 -4.882 56.960 29.444 1.00 0.00 N ATOM 1213 CA SER A 70 -4.738 58.311 29.960 1.00 0.00 C ATOM 1214 C SER A 70 -6.117 58.924 30.214 1.00 0.00 C ATOM 1215 O SER A 70 -6.870 59.175 29.275 1.00 0.00 O ATOM 1216 CB SER A 70 -3.937 59.187 28.994 1.00 0.00 C ATOM 1217 OG SER A 70 -2.641 58.654 28.739 1.00 0.00 O ATOM 0 H SER A 70 -5.761 56.780 28.958 1.00 0.00 H new ATOM 0 HA SER A 70 -4.191 58.261 30.901 1.00 0.00 H new ATOM 0 HB2 SER A 70 -4.481 59.282 28.054 1.00 0.00 H new ATOM 0 HB3 SER A 70 -3.841 60.190 29.409 1.00 0.00 H new ATOM 0 HG SER A 70 -2.162 59.241 28.117 1.00 0.00 H new ATOM 1223 N VAL A 71 -6.404 59.147 31.488 1.00 0.00 N ATOM 1224 CA VAL A 71 -7.678 59.726 31.877 1.00 0.00 C ATOM 1225 C VAL A 71 -7.989 60.921 30.973 1.00 0.00 C ATOM 1226 O VAL A 71 -9.152 61.268 30.774 1.00 0.00 O ATOM 1227 CB VAL A 71 -7.656 60.091 33.363 1.00 0.00 C ATOM 1228 CG1 VAL A 71 -6.703 61.259 33.626 1.00 0.00 C ATOM 1229 CG2 VAL A 71 -9.064 60.407 33.871 1.00 0.00 C ATOM 0 H VAL A 71 -5.776 58.937 32.264 1.00 0.00 H new ATOM 0 HA VAL A 71 -8.482 59.001 31.746 1.00 0.00 H new ATOM 0 HB VAL A 71 -7.287 59.227 33.915 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -6.706 61.499 34.689 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -5.694 60.982 33.319 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -7.029 62.130 33.057 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -9.020 60.663 34.930 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -9.473 61.248 33.311 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -9.704 59.535 33.735 1.00 0.00 H new ATOM 1239 N LYS A 72 -6.927 61.517 30.449 1.00 0.00 N ATOM 1240 CA LYS A 72 -7.072 62.665 29.571 1.00 0.00 C ATOM 1241 C LYS A 72 -8.224 63.540 30.068 1.00 0.00 C ATOM 1242 O LYS A 72 -8.411 63.702 31.273 1.00 0.00 O ATOM 1243 CB LYS A 72 -7.225 62.212 28.117 1.00 0.00 C ATOM 1244 CG LYS A 72 -8.523 61.425 27.923 1.00 0.00 C ATOM 1245 CD LYS A 72 -8.589 60.815 26.522 1.00 0.00 C ATOM 1246 CE LYS A 72 -10.028 60.457 26.147 1.00 0.00 C ATOM 1247 NZ LYS A 72 -10.399 61.083 24.858 1.00 0.00 N ATOM 0 H LYS A 72 -5.964 61.226 30.616 1.00 0.00 H new ATOM 0 HA LYS A 72 -6.172 63.279 29.596 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -7.220 63.081 27.459 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -6.374 61.593 27.833 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -8.589 60.635 28.671 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -9.378 62.083 28.078 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -8.185 61.520 25.795 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -7.966 59.922 26.481 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -10.133 59.374 26.076 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -10.708 60.792 26.930 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -11.379 60.830 24.618 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -10.318 62.117 24.938 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -9.761 60.743 24.111 1.00 0.00 H new ATOM 1260 N MET A 73 -8.967 64.082 29.114 1.00 0.00 N ATOM 1261 CA MET A 73 -10.097 64.936 29.439 1.00 0.00 C ATOM 1262 C MET A 73 -9.642 66.173 30.218 1.00 0.00 C ATOM 1263 O MET A 73 -8.816 66.071 31.123 1.00 0.00 O ATOM 1264 CB MET A 73 -11.108 64.150 30.275 1.00 0.00 C ATOM 1265 CG MET A 73 -11.752 63.034 29.449 1.00 0.00 C ATOM 1266 SD MET A 73 -13.331 62.588 30.152 1.00 0.00 S ATOM 1267 CE MET A 73 -13.272 60.816 29.949 1.00 0.00 C ATOM 0 H MET A 73 -8.808 63.946 28.116 1.00 0.00 H new ATOM 0 HA MET A 73 -10.560 65.265 28.508 1.00 0.00 H new ATOM 0 HB2 MET A 73 -10.611 63.722 31.146 1.00 0.00 H new ATOM 0 HB3 MET A 73 -11.880 64.824 30.647 1.00 0.00 H new ATOM 0 HG2 MET A 73 -11.883 63.363 28.418 1.00 0.00 H new ATOM 0 HG3 MET A 73 -11.096 62.164 29.425 1.00 0.00 H new ATOM 0 HE1 MET A 73 -14.189 60.374 30.339 1.00 0.00 H new ATOM 0 HE2 MET A 73 -13.174 60.574 28.891 1.00 0.00 H new ATOM 0 HE3 MET A 73 -12.416 60.416 30.493 1.00 0.00 H new ATOM 1277 N GLU A 74 -10.202 67.311 29.836 1.00 0.00 N ATOM 1278 CA GLU A 74 -9.865 68.566 30.487 1.00 0.00 C ATOM 1279 C GLU A 74 -10.371 68.567 31.931 1.00 0.00 C ATOM 1280 O GLU A 74 -11.562 68.381 32.176 1.00 0.00 O ATOM 1281 CB GLU A 74 -10.427 69.757 29.708 1.00 0.00 C ATOM 1282 CG GLU A 74 -9.466 70.189 28.599 1.00 0.00 C ATOM 1283 CD GLU A 74 -9.889 69.605 27.249 1.00 0.00 C ATOM 1284 OE1 GLU A 74 -11.059 69.735 26.857 1.00 0.00 O ATOM 1285 OE2 GLU A 74 -8.954 68.999 26.599 1.00 0.00 O ATOM 0 H GLU A 74 -10.887 67.391 29.084 1.00 0.00 H new ATOM 0 HA GLU A 74 -8.780 68.665 30.503 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -11.391 69.491 29.275 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -10.602 70.591 30.388 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -9.442 71.277 28.537 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -8.455 69.861 28.841 1.00 0.00 H new ATOM 1293 N GLN A 75 -9.440 68.780 32.850 1.00 0.00 N ATOM 1294 CA GLN A 75 -9.777 68.808 34.264 1.00 0.00 C ATOM 1295 C GLN A 75 -11.013 69.679 34.497 1.00 0.00 C ATOM 1296 O GLN A 75 -11.345 70.527 33.670 1.00 0.00 O ATOM 1297 CB GLN A 75 -8.594 69.300 35.099 1.00 0.00 C ATOM 1298 CG GLN A 75 -8.470 70.824 35.032 1.00 0.00 C ATOM 1299 CD GLN A 75 -7.360 71.326 35.957 1.00 0.00 C ATOM 1300 OE1 GLN A 75 -7.538 71.484 37.154 1.00 0.00 O ATOM 1301 NE2 GLN A 75 -6.208 71.566 35.339 1.00 0.00 N ATOM 0 H GLN A 75 -8.453 68.935 32.643 1.00 0.00 H new ATOM 0 HA GLN A 75 -10.007 67.792 34.584 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -8.721 68.987 36.135 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -7.674 68.841 34.738 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -8.260 71.130 34.007 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -9.418 71.282 35.314 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -6.127 71.413 34.334 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -5.405 71.904 35.870 1.00 0.00 H new ATOM 1310 N ARG A 76 -11.661 69.440 35.628 1.00 0.00 N ATOM 1311 CA ARG A 76 -12.853 70.192 35.981 1.00 0.00 C ATOM 1312 C ARG A 76 -13.188 69.992 37.461 1.00 0.00 C ATOM 1313 O ARG A 76 -14.292 69.568 37.799 1.00 0.00 O ATOM 1314 CB ARG A 76 -14.049 69.759 35.132 1.00 0.00 C ATOM 1315 CG ARG A 76 -14.277 68.249 35.234 1.00 0.00 C ATOM 1316 CD ARG A 76 -15.706 67.881 34.832 1.00 0.00 C ATOM 1317 NE ARG A 76 -15.862 66.410 34.806 1.00 0.00 N ATOM 1318 CZ ARG A 76 -17.053 65.774 34.823 1.00 0.00 C ATOM 1319 NH1 ARG A 76 -18.204 66.478 34.866 1.00 0.00 N ATOM 1320 NH2 ARG A 76 -17.075 64.455 34.797 1.00 0.00 N ATOM 0 H ARG A 76 -11.383 68.736 36.312 1.00 0.00 H new ATOM 0 HA ARG A 76 -12.649 71.246 35.790 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -14.943 70.288 35.461 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -13.880 70.035 34.091 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -13.569 67.727 34.591 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -14.086 67.917 36.254 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -16.414 68.318 35.536 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -15.935 68.297 33.851 1.00 0.00 H new ATOM 0 HE ARG A 76 -15.017 65.840 34.773 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -18.178 67.497 34.886 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -19.100 65.990 34.879 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -16.201 63.931 34.765 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -17.966 63.959 34.809 1.00 0.00 H new ATOM 1333 N LYS A 77 -12.215 70.308 38.303 1.00 0.00 N ATOM 1334 CA LYS A 77 -12.393 70.168 39.738 1.00 0.00 C ATOM 1335 C LYS A 77 -12.745 71.531 40.339 1.00 0.00 C ATOM 1336 O LYS A 77 -12.354 71.837 41.464 1.00 0.00 O ATOM 1337 CB LYS A 77 -11.160 69.518 40.370 1.00 0.00 C ATOM 1338 CG LYS A 77 -9.979 70.490 40.396 1.00 0.00 C ATOM 1339 CD LYS A 77 -8.738 69.830 40.999 1.00 0.00 C ATOM 1340 CE LYS A 77 -8.811 69.819 42.527 1.00 0.00 C ATOM 1341 NZ LYS A 77 -9.053 68.447 43.025 1.00 0.00 N ATOM 0 H LYS A 77 -11.301 70.660 38.019 1.00 0.00 H new ATOM 0 HA LYS A 77 -13.225 69.498 39.955 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -11.394 69.197 41.385 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -10.888 68.624 39.808 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -9.759 70.828 39.383 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -10.244 71.374 40.977 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -8.648 68.809 40.628 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -7.845 70.365 40.678 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -7.881 70.205 42.944 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -9.609 70.480 42.863 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -9.100 68.458 44.064 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -9.952 68.092 42.642 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -8.277 67.825 42.720 1.00 0.00 H new ATOM 1354 N LEU A 78 -13.480 72.312 39.561 1.00 0.00 N ATOM 1355 CA LEU A 78 -13.889 73.635 40.003 1.00 0.00 C ATOM 1356 C LEU A 78 -14.197 73.595 41.501 1.00 0.00 C ATOM 1357 O LEU A 78 -14.545 72.546 42.039 1.00 0.00 O ATOM 1358 CB LEU A 78 -15.051 74.148 39.150 1.00 0.00 C ATOM 1359 CG LEU A 78 -14.675 75.080 37.996 1.00 0.00 C ATOM 1360 CD1 LEU A 78 -15.052 74.463 36.648 1.00 0.00 C ATOM 1361 CD2 LEU A 78 -15.296 76.466 38.185 1.00 0.00 C ATOM 0 H LEU A 78 -13.803 72.055 38.628 1.00 0.00 H new ATOM 0 HA LEU A 78 -13.079 74.351 39.863 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -15.581 73.289 38.739 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -15.750 74.672 39.801 1.00 0.00 H new ATOM 0 HG LEU A 78 -13.593 75.209 38.000 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -14.774 75.146 35.845 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -14.524 73.518 36.520 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -16.127 74.285 36.617 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -15.013 77.108 37.351 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -16.382 76.376 38.222 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -14.936 76.902 39.117 1.00 0.00 H new ATOM 1373 N ASN A 79 -14.057 74.752 42.132 1.00 0.00 N ATOM 1374 CA ASN A 79 -14.316 74.862 43.557 1.00 0.00 C ATOM 1375 C ASN A 79 -15.669 75.543 43.774 1.00 0.00 C ATOM 1376 O ASN A 79 -16.097 75.731 44.912 1.00 0.00 O ATOM 1377 CB ASN A 79 -13.244 75.709 44.247 1.00 0.00 C ATOM 1378 CG ASN A 79 -12.029 74.859 44.620 1.00 0.00 C ATOM 1379 OD1 ASN A 79 -11.177 74.555 43.801 1.00 0.00 O ATOM 1380 ND2 ASN A 79 -11.996 74.493 45.898 1.00 0.00 N ATOM 0 H ASN A 79 -13.768 75.621 41.682 1.00 0.00 H new ATOM 0 HA ASN A 79 -14.310 73.857 43.980 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -12.936 76.520 43.587 1.00 0.00 H new ATOM 0 HB3 ASN A 79 -13.660 76.168 45.144 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -11.225 73.923 46.246 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -12.742 74.782 46.531 1.00 0.00 H new ATOM 1387 N ASP A 80 -16.304 75.893 42.666 1.00 0.00 N ATOM 1388 CA ASP A 80 -17.599 76.548 42.720 1.00 0.00 C ATOM 1389 C ASP A 80 -18.344 76.308 41.405 1.00 0.00 C ATOM 1390 O ASP A 80 -18.178 77.061 40.447 1.00 0.00 O ATOM 1391 CB ASP A 80 -17.445 78.059 42.907 1.00 0.00 C ATOM 1392 CG ASP A 80 -18.592 78.738 43.658 1.00 0.00 C ATOM 1393 OD1 ASP A 80 -19.532 78.076 44.122 1.00 0.00 O ATOM 1394 OD2 ASP A 80 -18.492 80.020 43.760 1.00 0.00 O ATOM 0 H ASP A 80 -15.945 75.735 41.724 1.00 0.00 H new ATOM 0 HA ASP A 80 -18.150 76.134 43.564 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -16.516 78.251 43.443 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -17.348 78.523 41.926 1.00 0.00 H new ATOM 1400 N GLN A 81 -19.148 75.255 41.402 1.00 0.00 N ATOM 1401 CA GLN A 81 -19.918 74.906 40.220 1.00 0.00 C ATOM 1402 C GLN A 81 -21.360 75.396 40.362 1.00 0.00 C ATOM 1403 O GLN A 81 -22.226 74.661 40.834 1.00 0.00 O ATOM 1404 CB GLN A 81 -19.874 73.398 39.963 1.00 0.00 C ATOM 1405 CG GLN A 81 -18.537 72.986 39.346 1.00 0.00 C ATOM 1406 CD GLN A 81 -18.468 71.470 39.149 1.00 0.00 C ATOM 1407 OE1 GLN A 81 -18.432 70.697 40.092 1.00 0.00 O ATOM 1408 NE2 GLN A 81 -18.451 71.090 37.874 1.00 0.00 N ATOM 0 H GLN A 81 -19.283 74.632 42.199 1.00 0.00 H new ATOM 0 HA GLN A 81 -19.470 75.402 39.359 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -20.027 72.861 40.899 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -20.689 73.115 39.296 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -18.405 73.487 38.387 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -17.720 73.310 39.990 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -18.484 71.790 37.133 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -18.405 70.099 37.638 1.00 0.00 H new ATOM 1417 N ALA A 82 -21.574 76.636 39.946 1.00 0.00 N ATOM 1418 CA ALA A 82 -22.896 77.233 40.021 1.00 0.00 C ATOM 1419 C ALA A 82 -23.309 77.724 38.633 1.00 0.00 C ATOM 1420 O ALA A 82 -23.476 78.924 38.419 1.00 0.00 O ATOM 1421 CB ALA A 82 -22.891 78.357 41.059 1.00 0.00 C ATOM 0 H ALA A 82 -20.853 77.243 39.556 1.00 0.00 H new ATOM 0 HA ALA A 82 -23.632 76.496 40.342 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -23.883 78.805 41.115 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -22.621 77.951 42.034 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -22.166 79.117 40.769 1.00 0.00 H new ATOM 1427 N ASN A 83 -23.463 76.772 37.724 1.00 0.00 N ATOM 1428 CA ASN A 83 -23.853 77.092 36.362 1.00 0.00 C ATOM 1429 C ASN A 83 -25.339 76.779 36.175 1.00 0.00 C ATOM 1430 O ASN A 83 -25.694 75.707 35.688 1.00 0.00 O ATOM 1431 CB ASN A 83 -23.063 76.258 35.352 1.00 0.00 C ATOM 1432 CG ASN A 83 -23.178 74.765 35.664 1.00 0.00 C ATOM 1433 OD1 ASN A 83 -23.730 74.356 36.673 1.00 0.00 O ATOM 1434 ND2 ASN A 83 -22.628 73.976 34.746 1.00 0.00 N ATOM 0 H ASN A 83 -23.324 75.778 37.905 1.00 0.00 H new ATOM 0 HA ASN A 83 -23.650 78.149 36.193 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -23.434 76.452 34.346 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -22.015 76.557 35.369 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -22.652 72.963 34.863 1.00 0.00 H new ATOM 0 HD22 ASN A 83 -22.182 74.384 33.924 1.00 0.00 H new ATOM 1441 N THR A 84 -26.167 77.735 36.571 1.00 0.00 N ATOM 1442 CA THR A 84 -27.606 77.575 36.453 1.00 0.00 C ATOM 1443 C THR A 84 -28.050 77.798 35.006 1.00 0.00 C ATOM 1444 O THR A 84 -28.911 77.080 34.499 1.00 0.00 O ATOM 1445 CB THR A 84 -28.271 78.529 37.447 1.00 0.00 C ATOM 1446 OG1 THR A 84 -28.072 77.906 38.713 1.00 0.00 O ATOM 1447 CG2 THR A 84 -29.792 78.572 37.288 1.00 0.00 C ATOM 0 H THR A 84 -25.868 78.623 36.974 1.00 0.00 H new ATOM 0 HA THR A 84 -27.913 76.559 36.701 1.00 0.00 H new ATOM 0 HB THR A 84 -27.863 79.531 37.316 1.00 0.00 H new ATOM 0 HG1 THR A 84 -28.471 78.459 39.416 1.00 0.00 H new ATOM 0 HG21 THR A 84 -30.215 79.264 38.017 1.00 0.00 H new ATOM 0 HG22 THR A 84 -30.043 78.907 36.282 1.00 0.00 H new ATOM 0 HG23 THR A 84 -30.203 77.576 37.452 1.00 0.00 H new ATOM 1455 N LEU A 85 -27.444 78.797 34.382 1.00 0.00 N ATOM 1456 CA LEU A 85 -27.766 79.124 33.003 1.00 0.00 C ATOM 1457 C LEU A 85 -26.485 79.106 32.166 1.00 0.00 C ATOM 1458 O LEU A 85 -26.057 78.050 31.703 1.00 0.00 O ATOM 1459 CB LEU A 85 -28.529 80.448 32.931 1.00 0.00 C ATOM 1460 CG LEU A 85 -28.060 81.546 33.888 1.00 0.00 C ATOM 1461 CD1 LEU A 85 -27.980 82.897 33.175 1.00 0.00 C ATOM 1462 CD2 LEU A 85 -28.948 81.606 35.132 1.00 0.00 C ATOM 0 H LEU A 85 -26.731 79.391 34.806 1.00 0.00 H new ATOM 0 HA LEU A 85 -28.434 78.374 32.580 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -28.461 80.829 31.912 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -29.582 80.248 33.127 1.00 0.00 H new ATOM 0 HG LEU A 85 -27.053 81.299 34.224 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -27.644 83.660 33.877 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -27.274 82.830 32.347 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -28.965 83.165 32.792 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -28.592 82.395 35.795 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -29.976 81.817 34.836 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -28.910 80.649 35.653 1.00 0.00 H new ATOM 1474 N VAL A 86 -25.910 80.287 31.998 1.00 0.00 N ATOM 1475 CA VAL A 86 -24.687 80.421 31.225 1.00 0.00 C ATOM 1476 C VAL A 86 -23.971 81.711 31.630 1.00 0.00 C ATOM 1477 O VAL A 86 -23.818 82.621 30.817 1.00 0.00 O ATOM 1478 CB VAL A 86 -25.003 80.357 29.729 1.00 0.00 C ATOM 1479 CG1 VAL A 86 -25.822 81.573 29.290 1.00 0.00 C ATOM 1480 CG2 VAL A 86 -23.722 80.230 28.902 1.00 0.00 C ATOM 0 H VAL A 86 -26.268 81.160 32.384 1.00 0.00 H new ATOM 0 HA VAL A 86 -24.010 79.593 31.436 1.00 0.00 H new ATOM 0 HB VAL A 86 -25.605 79.466 29.551 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -26.033 81.503 28.223 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -26.760 81.599 29.845 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -25.257 82.483 29.489 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -23.976 80.187 27.843 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -23.082 81.093 29.087 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -23.194 79.320 29.186 1.00 0.00 H new ATOM 1490 N ASP A 87 -23.550 81.747 32.886 1.00 0.00 N ATOM 1491 CA ASP A 87 -22.854 82.910 33.408 1.00 0.00 C ATOM 1492 C ASP A 87 -21.360 82.786 33.100 1.00 0.00 C ATOM 1493 O ASP A 87 -20.590 82.302 33.928 1.00 0.00 O ATOM 1494 CB ASP A 87 -23.017 83.013 34.926 1.00 0.00 C ATOM 1495 CG ASP A 87 -22.948 81.682 35.676 1.00 0.00 C ATOM 1496 OD1 ASP A 87 -23.766 81.408 36.567 1.00 0.00 O ATOM 1497 OD2 ASP A 87 -21.993 80.897 35.307 1.00 0.00 O ATOM 0 H ASP A 87 -23.678 80.989 33.557 1.00 0.00 H new ATOM 0 HA ASP A 87 -23.279 83.797 32.938 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -22.242 83.673 35.315 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -23.975 83.485 35.142 1.00 0.00 H new ATOM 1503 N LEU A 88 -20.996 83.232 31.907 1.00 0.00 N ATOM 1504 CA LEU A 88 -19.608 83.177 31.480 1.00 0.00 C ATOM 1505 C LEU A 88 -18.899 84.466 31.898 1.00 0.00 C ATOM 1506 O LEU A 88 -17.811 84.767 31.409 1.00 0.00 O ATOM 1507 CB LEU A 88 -19.521 82.886 29.980 1.00 0.00 C ATOM 1508 CG LEU A 88 -20.092 83.962 29.054 1.00 0.00 C ATOM 1509 CD1 LEU A 88 -19.042 84.430 28.044 1.00 0.00 C ATOM 1510 CD2 LEU A 88 -21.369 83.473 28.367 1.00 0.00 C ATOM 0 H LEU A 88 -21.638 83.633 31.223 1.00 0.00 H new ATOM 0 HA LEU A 88 -19.090 82.354 31.972 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -18.474 82.730 29.720 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -20.042 81.950 29.781 1.00 0.00 H new ATOM 0 HG LEU A 88 -20.363 84.826 29.661 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -19.474 85.195 27.398 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -18.186 84.845 28.575 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -18.718 83.584 27.438 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -21.754 84.257 27.715 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -21.147 82.585 27.775 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -22.117 83.228 29.121 1.00 0.00 H new ATOM 1522 N ALA A 89 -19.544 85.193 32.799 1.00 0.00 N ATOM 1523 CA ALA A 89 -18.988 86.443 33.289 1.00 0.00 C ATOM 1524 C ALA A 89 -19.247 87.548 32.264 1.00 0.00 C ATOM 1525 O ALA A 89 -18.395 87.832 31.422 1.00 0.00 O ATOM 1526 CB ALA A 89 -17.497 86.258 33.583 1.00 0.00 C ATOM 0 H ALA A 89 -20.446 84.940 33.202 1.00 0.00 H new ATOM 0 HA ALA A 89 -19.470 86.738 34.221 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -17.080 87.195 33.951 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -17.369 85.483 34.338 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -16.980 85.964 32.670 1.00 0.00 H new ATOM 1532 N LYS A 90 -20.427 88.142 32.367 1.00 0.00 N ATOM 1533 CA LYS A 90 -20.809 89.210 31.459 1.00 0.00 C ATOM 1534 C LYS A 90 -21.810 90.133 32.157 1.00 0.00 C ATOM 1535 O LYS A 90 -21.674 91.355 32.105 1.00 0.00 O ATOM 1536 CB LYS A 90 -21.323 88.633 30.139 1.00 0.00 C ATOM 1537 CG LYS A 90 -22.076 87.322 30.370 1.00 0.00 C ATOM 1538 CD LYS A 90 -23.344 87.260 29.515 1.00 0.00 C ATOM 1539 CE LYS A 90 -23.015 86.860 28.075 1.00 0.00 C ATOM 1540 NZ LYS A 90 -24.076 85.988 27.523 1.00 0.00 N ATOM 0 H LYS A 90 -21.131 87.904 33.066 1.00 0.00 H new ATOM 0 HA LYS A 90 -19.942 89.817 31.199 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -21.981 89.354 29.655 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -20.486 88.461 29.463 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -21.429 86.479 30.128 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -22.339 87.230 31.424 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -24.042 86.542 29.945 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -23.840 88.231 29.522 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -22.912 87.753 27.458 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -22.057 86.340 28.046 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -23.837 85.726 26.545 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -24.155 85.128 28.102 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -24.983 86.496 27.533 1.00 0.00 H new ATOM 1553 N THR A 91 -22.793 89.514 32.794 1.00 0.00 N ATOM 1554 CA THR A 91 -23.816 90.265 33.501 1.00 0.00 C ATOM 1555 C THR A 91 -23.677 90.063 35.011 1.00 0.00 C ATOM 1556 O THR A 91 -24.561 89.494 35.649 1.00 0.00 O ATOM 1557 CB THR A 91 -25.180 89.837 32.954 1.00 0.00 C ATOM 1558 OG1 THR A 91 -25.203 88.425 33.145 1.00 0.00 O ATOM 1559 CG2 THR A 91 -25.282 90.010 31.437 1.00 0.00 C ATOM 0 H THR A 91 -22.903 88.501 32.835 1.00 0.00 H new ATOM 0 HA THR A 91 -23.705 91.337 33.336 1.00 0.00 H new ATOM 0 HB THR A 91 -25.965 90.418 33.439 1.00 0.00 H new ATOM 0 HG1 THR A 91 -25.070 88.221 34.094 1.00 0.00 H new ATOM 0 HG21 THR A 91 -26.269 89.692 31.100 1.00 0.00 H new ATOM 0 HG22 THR A 91 -25.131 91.058 31.179 1.00 0.00 H new ATOM 0 HG23 THR A 91 -24.519 89.403 30.949 1.00 0.00 H new ATOM 1567 N GLN A 92 -22.560 90.542 35.539 1.00 0.00 N ATOM 1568 CA GLN A 92 -22.294 90.422 36.963 1.00 0.00 C ATOM 1569 C GLN A 92 -21.826 91.763 37.531 1.00 0.00 C ATOM 1570 O GLN A 92 -22.502 92.356 38.370 1.00 0.00 O ATOM 1571 CB GLN A 92 -21.267 89.321 37.237 1.00 0.00 C ATOM 1572 CG GLN A 92 -21.945 88.062 37.781 1.00 0.00 C ATOM 1573 CD GLN A 92 -21.049 87.353 38.799 1.00 0.00 C ATOM 1574 OE1 GLN A 92 -20.303 86.443 38.481 1.00 0.00 O ATOM 1575 NE2 GLN A 92 -21.165 87.821 40.039 1.00 0.00 N ATOM 0 H GLN A 92 -21.829 91.014 35.007 1.00 0.00 H new ATOM 0 HA GLN A 92 -23.221 90.142 37.464 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -20.731 89.082 36.318 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -20.528 89.679 37.953 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -22.893 88.328 38.249 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -22.175 87.384 36.959 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -21.810 88.586 40.237 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -20.609 87.415 40.792 1.00 0.00 H new TER 1584 GLN A 92