USER MOD reduce.3.24.130724 H: found=0, std=0, add=852, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 847 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 63 THR OG1 : rot -59:sc= 0.716 USER MOD Set 1.2: A 74 TYR OH : rot -162:sc= 0.81 USER MOD Set 2.1: A 55 LYS NZ :NH3+ -156:sc= 1.54 (180deg=0.173) USER MOD Set 2.2: A 67 TYR OH : rot 30:sc= 0.978 USER MOD Set 3.1: A 19 THR OG1 : rot -131:sc= -0.684 USER MOD Set 3.2: A 27 LYS NZ :NH3+ 150:sc= 0.0897 (180deg=0) USER MOD Single : A 1 GLY N :NH3+ 127:sc= 0.33 (180deg=0.0136) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 GLN : amide:sc= -0.0115 X(o=-0.011,f=0) USER MOD Single : A 13 LYS NZ :NH3+ -121:sc= 0.0245 (180deg=0) USER MOD Single : A 14 CYS SG : rot 180:sc=-0.000575 USER MOD Single : A 16 GLN : amide:sc= 0 K(o=0,f=-1.5) USER MOD Single : A 17 CYS SG : rot 180:sc= -0.754 USER MOD Single : A 18 HIS : no HD1:sc= -2.39! C(o=-2.4!,f=-3.5!) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 HIS : no HD1:sc= -0.0171 X(o=-0.017,f=-0.018) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 31 ASN : amide:sc= -2.37 K(o=-2.4,f=-6!) USER MOD Single : A 33 HIS : no HD1:sc= -1.34 X(o=-1.3,f=-1.1) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 THR OG1 : rot 113:sc= 0.619 USER MOD Single : A 42 GLN : amide:sc= 0.453 K(o=0.45,f=-0.27) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 52 ASN : amide:sc= -0.732 K(o=-0.73,f=-3!) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ -109:sc= 0.727 (180deg=-2.13!) USER MOD Single : A 65 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 70 ASN : amide:sc= -0.12 K(o=-0.12,f=-0.64) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 THR OG1 : rot 5:sc= -0.0208 USER MOD Single : A 79 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.151) USER MOD Single : A 80 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0.0191 USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 LYS NZ :NH3+ 174:sc= 1.2 (180deg=0.901) USER MOD Single : A 100 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0195) USER MOD Single : A 102 THR OG1 : rot -65:sc= 1.26 USER MOD Single : A 103 ASN : amide:sc= -0.0337 K(o=-0.034,f=-1.1) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -5.513 -4.541 -15.251 1.00 10.00 N ATOM 2 CA GLY A 1 -4.112 -4.194 -15.123 1.00 10.00 C ATOM 3 C GLY A 1 -3.409 -5.535 -15.292 1.00 10.00 C ATOM 4 O GLY A 1 -4.041 -6.569 -15.080 1.00 10.00 O ATOM 0 H1 GLY A 1 -6.037 -4.177 -14.430 1.00 10.00 H new ATOM 0 H2 GLY A 1 -5.897 -4.120 -16.121 1.00 10.00 H new ATOM 0 H3 GLY A 1 -5.612 -5.575 -15.294 1.00 10.00 H new ATOM 0 HA2 GLY A 1 -3.803 -3.478 -15.884 1.00 10.00 H new ATOM 0 HA3 GLY A 1 -3.895 -3.744 -14.154 1.00 10.00 H new ATOM 10 N ASP A 2 -2.214 -5.532 -15.831 1.00 10.00 N ATOM 11 CA ASP A 2 -1.461 -6.746 -16.077 1.00 10.00 C ATOM 12 C ASP A 2 -1.002 -7.352 -14.754 1.00 10.00 C ATOM 13 O ASP A 2 -0.197 -6.752 -14.045 1.00 10.00 O ATOM 14 CB ASP A 2 -0.231 -6.488 -16.945 1.00 10.00 C ATOM 15 CG ASP A 2 0.345 -7.819 -17.405 1.00 10.00 C ATOM 16 OD1 ASP A 2 -0.453 -8.750 -17.639 1.00 10.00 O ATOM 17 OD2 ASP A 2 1.586 -7.919 -17.433 1.00 10.00 O ATOM 0 H ASP A 2 -1.729 -4.681 -16.115 1.00 10.00 H new ATOM 0 HA ASP A 2 -2.122 -7.433 -16.605 1.00 10.00 H new ATOM 0 HB2 ASP A 2 -0.501 -5.878 -17.807 1.00 10.00 H new ATOM 0 HB3 ASP A 2 0.516 -5.930 -16.381 1.00 10.00 H new ATOM 22 N VAL A 3 -1.485 -8.545 -14.409 1.00 10.00 N ATOM 23 CA VAL A 3 -1.025 -9.231 -13.210 1.00 10.00 C ATOM 24 C VAL A 3 0.469 -9.545 -13.325 1.00 10.00 C ATOM 25 O VAL A 3 1.194 -9.418 -12.340 1.00 10.00 O ATOM 26 CB VAL A 3 -1.885 -10.485 -12.956 1.00 10.00 C ATOM 27 CG1 VAL A 3 -1.433 -11.289 -11.728 1.00 10.00 C ATOM 28 CG2 VAL A 3 -3.357 -10.080 -12.773 1.00 10.00 C ATOM 0 H VAL A 3 -2.191 -9.052 -14.942 1.00 10.00 H new ATOM 0 HA VAL A 3 -1.146 -8.583 -12.342 1.00 10.00 H new ATOM 0 HB VAL A 3 -1.763 -11.126 -13.829 1.00 10.00 H new ATOM 0 HG11 VAL A 3 -2.079 -12.158 -11.604 1.00 10.00 H new ATOM 0 HG12 VAL A 3 -0.403 -11.619 -11.868 1.00 10.00 H new ATOM 0 HG13 VAL A 3 -1.496 -10.661 -10.839 1.00 10.00 H new ATOM 0 HG21 VAL A 3 -3.960 -10.970 -12.594 1.00 10.00 H new ATOM 0 HG22 VAL A 3 -3.445 -9.405 -11.922 1.00 10.00 H new ATOM 0 HG23 VAL A 3 -3.711 -9.577 -13.673 1.00 10.00 H new ATOM 38 N GLU A 4 0.943 -9.938 -14.512 1.00 10.00 N ATOM 39 CA GLU A 4 2.343 -10.285 -14.685 1.00 10.00 C ATOM 40 C GLU A 4 3.213 -9.068 -14.409 1.00 10.00 C ATOM 41 O GLU A 4 4.009 -9.068 -13.470 1.00 10.00 O ATOM 42 CB GLU A 4 2.608 -10.844 -16.086 1.00 10.00 C ATOM 43 CG GLU A 4 2.359 -12.353 -16.177 1.00 10.00 C ATOM 44 CD GLU A 4 3.521 -13.065 -16.858 1.00 10.00 C ATOM 45 OE1 GLU A 4 4.559 -13.209 -16.173 1.00 10.00 O ATOM 46 OE2 GLU A 4 3.358 -13.438 -18.038 1.00 10.00 O ATOM 0 H GLU A 4 0.377 -10.021 -15.356 1.00 10.00 H new ATOM 0 HA GLU A 4 2.597 -11.068 -13.971 1.00 10.00 H new ATOM 0 HB2 GLU A 4 1.969 -10.330 -16.805 1.00 10.00 H new ATOM 0 HB3 GLU A 4 3.639 -10.632 -16.368 1.00 10.00 H new ATOM 0 HG2 GLU A 4 2.216 -12.761 -15.177 1.00 10.00 H new ATOM 0 HG3 GLU A 4 1.440 -12.539 -16.732 1.00 10.00 H new ATOM 53 N LYS A 5 3.066 -8.015 -15.209 1.00 10.00 N ATOM 54 CA LYS A 5 3.850 -6.819 -15.019 1.00 10.00 C ATOM 55 C LYS A 5 3.618 -6.283 -13.613 1.00 10.00 C ATOM 56 O LYS A 5 4.588 -5.966 -12.939 1.00 10.00 O ATOM 57 CB LYS A 5 3.601 -5.787 -16.114 1.00 10.00 C ATOM 58 CG LYS A 5 4.258 -6.180 -17.447 1.00 10.00 C ATOM 59 CD LYS A 5 4.849 -4.960 -18.177 1.00 10.00 C ATOM 60 CE LYS A 5 6.384 -4.878 -18.047 1.00 10.00 C ATOM 61 NZ LYS A 5 6.853 -3.529 -17.672 1.00 10.00 N ATOM 0 H LYS A 5 2.411 -7.975 -15.990 1.00 10.00 H new ATOM 0 HA LYS A 5 4.908 -7.065 -15.110 1.00 10.00 H new ATOM 0 HB2 LYS A 5 2.527 -5.669 -16.262 1.00 10.00 H new ATOM 0 HB3 LYS A 5 3.987 -4.819 -15.793 1.00 10.00 H new ATOM 0 HG2 LYS A 5 5.046 -6.910 -17.262 1.00 10.00 H new ATOM 0 HG3 LYS A 5 3.520 -6.664 -18.087 1.00 10.00 H new ATOM 0 HD2 LYS A 5 4.579 -5.007 -19.232 1.00 10.00 H new ATOM 0 HD3 LYS A 5 4.405 -4.050 -17.774 1.00 10.00 H new ATOM 0 HE2 LYS A 5 6.720 -5.596 -17.299 1.00 10.00 H new ATOM 0 HE3 LYS A 5 6.841 -5.167 -18.994 1.00 10.00 H new ATOM 0 HZ1 LYS A 5 7.890 -3.530 -17.598 1.00 10.00 H new ATOM 0 HZ2 LYS A 5 6.558 -2.845 -18.398 1.00 10.00 H new ATOM 0 HZ3 LYS A 5 6.441 -3.261 -16.755 1.00 10.00 H new ATOM 75 N GLY A 6 2.374 -6.262 -13.134 1.00 10.00 N ATOM 76 CA GLY A 6 2.043 -5.902 -11.767 1.00 10.00 C ATOM 77 C GLY A 6 2.910 -6.619 -10.728 1.00 10.00 C ATOM 78 O GLY A 6 3.430 -5.989 -9.802 1.00 10.00 O ATOM 0 H GLY A 6 1.559 -6.500 -13.699 1.00 10.00 H new ATOM 0 HA2 GLY A 6 2.156 -4.825 -11.644 1.00 10.00 H new ATOM 0 HA3 GLY A 6 0.995 -6.136 -11.580 1.00 10.00 H new ATOM 82 N LYS A 7 3.070 -7.939 -10.887 1.00 10.00 N ATOM 83 CA LYS A 7 3.872 -8.782 -10.020 1.00 10.00 C ATOM 84 C LYS A 7 5.280 -8.218 -9.998 1.00 10.00 C ATOM 85 O LYS A 7 5.880 -8.081 -8.936 1.00 10.00 O ATOM 86 CB LYS A 7 3.818 -10.236 -10.512 1.00 10.00 C ATOM 87 CG LYS A 7 4.545 -11.186 -9.560 1.00 10.00 C ATOM 88 CD LYS A 7 4.715 -12.575 -10.189 1.00 10.00 C ATOM 89 CE LYS A 7 6.063 -13.130 -9.722 1.00 10.00 C ATOM 90 NZ LYS A 7 6.288 -14.523 -10.165 1.00 10.00 N ATOM 0 H LYS A 7 2.628 -8.456 -11.647 1.00 10.00 H new ATOM 0 HA LYS A 7 3.488 -8.789 -9.000 1.00 10.00 H new ATOM 0 HB2 LYS A 7 2.778 -10.547 -10.612 1.00 10.00 H new ATOM 0 HB3 LYS A 7 4.267 -10.301 -11.503 1.00 10.00 H new ATOM 0 HG2 LYS A 7 5.523 -10.775 -9.308 1.00 10.00 H new ATOM 0 HG3 LYS A 7 3.985 -11.271 -8.629 1.00 10.00 H new ATOM 0 HD2 LYS A 7 3.903 -13.235 -9.885 1.00 10.00 H new ATOM 0 HD3 LYS A 7 4.683 -12.510 -11.277 1.00 10.00 H new ATOM 0 HE2 LYS A 7 6.864 -12.497 -10.104 1.00 10.00 H new ATOM 0 HE3 LYS A 7 6.113 -13.086 -8.634 1.00 10.00 H new ATOM 0 HZ1 LYS A 7 7.214 -14.851 -9.823 1.00 10.00 H new ATOM 0 HZ2 LYS A 7 5.540 -15.135 -9.780 1.00 10.00 H new ATOM 0 HZ3 LYS A 7 6.268 -14.564 -11.204 1.00 10.00 H new ATOM 104 N LYS A 8 5.817 -7.891 -11.172 1.00 10.00 N ATOM 105 CA LYS A 8 7.172 -7.389 -11.235 1.00 10.00 C ATOM 106 C LYS A 8 7.256 -5.980 -10.650 1.00 10.00 C ATOM 107 O LYS A 8 8.123 -5.721 -9.826 1.00 10.00 O ATOM 108 CB LYS A 8 7.767 -7.502 -12.644 1.00 10.00 C ATOM 109 CG LYS A 8 7.373 -8.797 -13.373 1.00 10.00 C ATOM 110 CD LYS A 8 7.570 -10.093 -12.566 1.00 10.00 C ATOM 111 CE LYS A 8 9.035 -10.544 -12.650 1.00 10.00 C ATOM 112 NZ LYS A 8 9.328 -11.689 -11.767 1.00 10.00 N ATOM 0 H LYS A 8 5.340 -7.965 -12.070 1.00 10.00 H new ATOM 0 HA LYS A 8 7.799 -8.025 -10.610 1.00 10.00 H new ATOM 0 HB2 LYS A 8 7.442 -6.647 -13.237 1.00 10.00 H new ATOM 0 HB3 LYS A 8 8.854 -7.448 -12.577 1.00 10.00 H new ATOM 0 HG2 LYS A 8 6.325 -8.726 -13.664 1.00 10.00 H new ATOM 0 HG3 LYS A 8 7.955 -8.869 -14.292 1.00 10.00 H new ATOM 0 HD2 LYS A 8 7.290 -9.930 -11.525 1.00 10.00 H new ATOM 0 HD3 LYS A 8 6.917 -10.875 -12.953 1.00 10.00 H new ATOM 0 HE2 LYS A 8 9.269 -10.815 -13.680 1.00 10.00 H new ATOM 0 HE3 LYS A 8 9.684 -9.710 -12.384 1.00 10.00 H new ATOM 0 HZ1 LYS A 8 10.329 -11.953 -11.862 1.00 10.00 H new ATOM 0 HZ2 LYS A 8 9.131 -11.426 -10.780 1.00 10.00 H new ATOM 0 HZ3 LYS A 8 8.730 -12.496 -12.035 1.00 10.00 H new ATOM 126 N ILE A 9 6.351 -5.077 -11.033 1.00 10.00 N ATOM 127 CA ILE A 9 6.285 -3.716 -10.541 1.00 10.00 C ATOM 128 C ILE A 9 6.326 -3.732 -9.019 1.00 10.00 C ATOM 129 O ILE A 9 7.218 -3.130 -8.437 1.00 10.00 O ATOM 130 CB ILE A 9 5.039 -3.012 -11.108 1.00 10.00 C ATOM 131 CG1 ILE A 9 5.199 -2.785 -12.622 1.00 10.00 C ATOM 132 CG2 ILE A 9 4.806 -1.654 -10.440 1.00 10.00 C ATOM 133 CD1 ILE A 9 3.903 -2.283 -13.263 1.00 10.00 C ATOM 0 H ILE A 9 5.624 -5.288 -11.717 1.00 10.00 H new ATOM 0 HA ILE A 9 7.146 -3.141 -10.882 1.00 10.00 H new ATOM 0 HB ILE A 9 4.185 -3.659 -10.907 1.00 10.00 H new ATOM 0 HG12 ILE A 9 5.995 -2.062 -12.799 1.00 10.00 H new ATOM 0 HG13 ILE A 9 5.503 -3.717 -13.099 1.00 10.00 H new ATOM 0 HG21 ILE A 9 3.918 -1.187 -10.866 1.00 10.00 H new ATOM 0 HG22 ILE A 9 4.663 -1.795 -9.369 1.00 10.00 H new ATOM 0 HG23 ILE A 9 5.670 -1.012 -10.609 1.00 10.00 H new ATOM 0 HD11 ILE A 9 4.059 -2.136 -14.332 1.00 10.00 H new ATOM 0 HD12 ILE A 9 3.113 -3.018 -13.110 1.00 10.00 H new ATOM 0 HD13 ILE A 9 3.613 -1.337 -12.805 1.00 10.00 H new ATOM 145 N PHE A 10 5.414 -4.449 -8.366 1.00 10.00 N ATOM 146 CA PHE A 10 5.425 -4.582 -6.913 1.00 10.00 C ATOM 147 C PHE A 10 6.842 -4.850 -6.366 1.00 10.00 C ATOM 148 O PHE A 10 7.279 -4.222 -5.396 1.00 10.00 O ATOM 149 CB PHE A 10 4.435 -5.686 -6.541 1.00 10.00 C ATOM 150 CG PHE A 10 4.397 -6.005 -5.067 1.00 10.00 C ATOM 151 CD1 PHE A 10 3.548 -5.284 -4.210 1.00 10.00 C ATOM 152 CD2 PHE A 10 5.212 -7.029 -4.553 1.00 10.00 C ATOM 153 CE1 PHE A 10 3.457 -5.640 -2.855 1.00 10.00 C ATOM 154 CE2 PHE A 10 5.141 -7.368 -3.195 1.00 10.00 C ATOM 155 CZ PHE A 10 4.246 -6.689 -2.356 1.00 10.00 C ATOM 0 H PHE A 10 4.653 -4.950 -8.825 1.00 10.00 H new ATOM 0 HA PHE A 10 5.118 -3.644 -6.450 1.00 10.00 H new ATOM 0 HB2 PHE A 10 3.437 -5.389 -6.864 1.00 10.00 H new ATOM 0 HB3 PHE A 10 4.692 -6.591 -7.092 1.00 10.00 H new ATOM 0 HD1 PHE A 10 2.967 -4.458 -4.593 1.00 10.00 H new ATOM 0 HD2 PHE A 10 5.893 -7.555 -5.205 1.00 10.00 H new ATOM 0 HE1 PHE A 10 2.783 -5.109 -2.199 1.00 10.00 H new ATOM 0 HE2 PHE A 10 5.773 -8.148 -2.797 1.00 10.00 H new ATOM 0 HZ PHE A 10 4.163 -6.975 -1.318 1.00 10.00 H new ATOM 165 N VAL A 11 7.578 -5.745 -7.035 1.00 10.00 N ATOM 166 CA VAL A 11 8.928 -6.158 -6.670 1.00 10.00 C ATOM 167 C VAL A 11 9.996 -5.140 -7.105 1.00 10.00 C ATOM 168 O VAL A 11 11.083 -5.087 -6.538 1.00 10.00 O ATOM 169 CB VAL A 11 9.201 -7.563 -7.239 1.00 10.00 C ATOM 170 CG1 VAL A 11 10.610 -8.078 -6.915 1.00 10.00 C ATOM 171 CG2 VAL A 11 8.189 -8.553 -6.659 1.00 10.00 C ATOM 0 H VAL A 11 7.234 -6.214 -7.873 1.00 10.00 H new ATOM 0 HA VAL A 11 8.993 -6.198 -5.583 1.00 10.00 H new ATOM 0 HB VAL A 11 9.111 -7.483 -8.322 1.00 10.00 H new ATOM 0 HG11 VAL A 11 10.741 -9.072 -7.343 1.00 10.00 H new ATOM 0 HG12 VAL A 11 11.351 -7.400 -7.338 1.00 10.00 H new ATOM 0 HG13 VAL A 11 10.739 -8.128 -5.834 1.00 10.00 H new ATOM 0 HG21 VAL A 11 8.381 -9.548 -7.061 1.00 10.00 H new ATOM 0 HG22 VAL A 11 8.284 -8.576 -5.573 1.00 10.00 H new ATOM 0 HG23 VAL A 11 7.180 -8.242 -6.929 1.00 10.00 H new ATOM 181 N GLN A 12 9.715 -4.347 -8.135 1.00 10.00 N ATOM 182 CA GLN A 12 10.627 -3.358 -8.694 1.00 10.00 C ATOM 183 C GLN A 12 10.395 -1.978 -8.082 1.00 10.00 C ATOM 184 O GLN A 12 11.186 -1.065 -8.305 1.00 10.00 O ATOM 185 CB GLN A 12 10.429 -3.326 -10.209 1.00 10.00 C ATOM 186 CG GLN A 12 10.862 -4.662 -10.835 1.00 10.00 C ATOM 187 CD GLN A 12 12.367 -4.723 -11.061 1.00 10.00 C ATOM 188 OE1 GLN A 12 12.853 -4.344 -12.121 1.00 10.00 O ATOM 189 NE2 GLN A 12 13.119 -5.204 -10.076 1.00 10.00 N ATOM 0 H GLN A 12 8.817 -4.377 -8.618 1.00 10.00 H new ATOM 0 HA GLN A 12 11.655 -3.636 -8.460 1.00 10.00 H new ATOM 0 HB2 GLN A 12 9.382 -3.131 -10.441 1.00 10.00 H new ATOM 0 HB3 GLN A 12 11.009 -2.510 -10.641 1.00 10.00 H new ATOM 0 HG2 GLN A 12 10.559 -5.483 -10.185 1.00 10.00 H new ATOM 0 HG3 GLN A 12 10.346 -4.802 -11.785 1.00 10.00 H new ATOM 0 HE21 GLN A 12 12.684 -5.511 -9.206 1.00 10.00 H new ATOM 0 HE22 GLN A 12 14.131 -5.266 -10.190 1.00 10.00 H new ATOM 198 N LYS A 13 9.292 -1.816 -7.351 1.00 10.00 N ATOM 199 CA LYS A 13 8.904 -0.576 -6.716 1.00 10.00 C ATOM 200 C LYS A 13 9.042 -0.676 -5.203 1.00 10.00 C ATOM 201 O LYS A 13 9.645 0.206 -4.594 1.00 10.00 O ATOM 202 CB LYS A 13 7.460 -0.243 -7.095 1.00 10.00 C ATOM 203 CG LYS A 13 7.261 -0.022 -8.597 1.00 10.00 C ATOM 204 CD LYS A 13 8.215 1.058 -9.104 1.00 10.00 C ATOM 205 CE LYS A 13 7.728 1.667 -10.418 1.00 10.00 C ATOM 206 NZ LYS A 13 8.493 2.886 -10.737 1.00 10.00 N ATOM 0 H LYS A 13 8.629 -2.574 -7.185 1.00 10.00 H new ATOM 0 HA LYS A 13 9.564 0.220 -7.062 1.00 10.00 H new ATOM 0 HB2 LYS A 13 6.810 -1.053 -6.765 1.00 10.00 H new ATOM 0 HB3 LYS A 13 7.149 0.654 -6.559 1.00 10.00 H new ATOM 0 HG2 LYS A 13 7.436 -0.954 -9.135 1.00 10.00 H new ATOM 0 HG3 LYS A 13 6.230 0.271 -8.795 1.00 10.00 H new ATOM 0 HD2 LYS A 13 8.311 1.842 -8.353 1.00 10.00 H new ATOM 0 HD3 LYS A 13 9.207 0.630 -9.246 1.00 10.00 H new ATOM 0 HE2 LYS A 13 7.836 0.941 -11.224 1.00 10.00 H new ATOM 0 HE3 LYS A 13 6.667 1.905 -10.344 1.00 10.00 H new ATOM 0 HZ1 LYS A 13 7.843 3.694 -10.813 1.00 10.00 H new ATOM 0 HZ2 LYS A 13 9.186 3.068 -9.983 1.00 10.00 H new ATOM 0 HZ3 LYS A 13 8.991 2.757 -11.641 1.00 10.00 H new ATOM 220 N CYS A 14 8.440 -1.706 -4.597 1.00 10.00 N ATOM 221 CA CYS A 14 8.303 -1.790 -3.152 1.00 10.00 C ATOM 222 C CYS A 14 9.138 -2.975 -2.631 1.00 10.00 C ATOM 223 O CYS A 14 10.192 -2.736 -2.053 1.00 10.00 O ATOM 224 CB CYS A 14 6.836 -1.777 -2.734 1.00 10.00 C ATOM 225 SG CYS A 14 5.652 -1.234 -4.041 1.00 10.00 S ATOM 0 H CYS A 14 8.038 -2.498 -5.099 1.00 10.00 H new ATOM 0 HA CYS A 14 8.714 -0.903 -2.670 1.00 10.00 H new ATOM 0 HB2 CYS A 14 6.559 -2.780 -2.409 1.00 10.00 H new ATOM 0 HB3 CYS A 14 6.726 -1.120 -1.871 1.00 10.00 H new ATOM 0 HG CYS A 14 4.441 -1.267 -3.570 1.00 10.00 H new ATOM 230 N ALA A 15 8.700 -4.227 -2.854 1.00 10.00 N ATOM 231 CA ALA A 15 9.288 -5.512 -2.409 1.00 10.00 C ATOM 232 C ALA A 15 9.920 -5.550 -1.014 1.00 10.00 C ATOM 233 O ALA A 15 9.437 -6.209 -0.092 1.00 10.00 O ATOM 234 CB ALA A 15 10.318 -6.051 -3.405 1.00 10.00 C ATOM 0 H ALA A 15 7.851 -4.384 -3.398 1.00 10.00 H new ATOM 0 HA ALA A 15 8.401 -6.144 -2.357 1.00 10.00 H new ATOM 0 HB1 ALA A 15 10.722 -6.994 -3.036 1.00 10.00 H new ATOM 0 HB2 ALA A 15 9.840 -6.214 -4.371 1.00 10.00 H new ATOM 0 HB3 ALA A 15 11.127 -5.329 -3.518 1.00 10.00 H new ATOM 240 N GLN A 16 11.041 -4.856 -0.836 1.00 10.00 N ATOM 241 CA GLN A 16 11.778 -4.747 0.410 1.00 10.00 C ATOM 242 C GLN A 16 11.043 -3.780 1.353 1.00 10.00 C ATOM 243 O GLN A 16 11.640 -2.946 2.025 1.00 10.00 O ATOM 244 CB GLN A 16 13.233 -4.356 0.074 1.00 10.00 C ATOM 245 CG GLN A 16 14.212 -5.508 0.338 1.00 10.00 C ATOM 246 CD GLN A 16 14.628 -5.590 1.805 1.00 10.00 C ATOM 247 OE1 GLN A 16 13.862 -5.245 2.700 1.00 10.00 O ATOM 248 NE2 GLN A 16 15.847 -6.055 2.068 1.00 10.00 N ATOM 0 H GLN A 16 11.477 -4.332 -1.595 1.00 10.00 H new ATOM 0 HA GLN A 16 11.828 -5.692 0.952 1.00 10.00 H new ATOM 0 HB2 GLN A 16 13.296 -4.059 -0.973 1.00 10.00 H new ATOM 0 HB3 GLN A 16 13.523 -3.490 0.669 1.00 10.00 H new ATOM 0 HG2 GLN A 16 13.750 -6.450 0.040 1.00 10.00 H new ATOM 0 HG3 GLN A 16 15.099 -5.378 -0.282 1.00 10.00 H new ATOM 0 HE21 GLN A 16 16.462 -6.334 1.304 1.00 10.00 H new ATOM 0 HE22 GLN A 16 16.166 -6.132 3.034 1.00 10.00 H new ATOM 257 N CYS A 17 9.719 -3.945 1.434 1.00 10.00 N ATOM 258 CA CYS A 17 8.838 -3.317 2.392 1.00 10.00 C ATOM 259 C CYS A 17 7.516 -4.079 2.387 1.00 10.00 C ATOM 260 O CYS A 17 7.097 -4.531 3.441 1.00 10.00 O ATOM 261 CB CYS A 17 8.666 -1.838 2.144 1.00 10.00 C ATOM 262 SG CYS A 17 8.634 -1.028 3.773 1.00 10.00 S ATOM 0 H CYS A 17 9.217 -4.557 0.791 1.00 10.00 H new ATOM 0 HA CYS A 17 9.282 -3.372 3.386 1.00 10.00 H new ATOM 0 HB2 CYS A 17 9.484 -1.451 1.536 1.00 10.00 H new ATOM 0 HB3 CYS A 17 7.743 -1.643 1.598 1.00 10.00 H new ATOM 0 HG CYS A 17 8.489 0.254 3.617 1.00 10.00 H new ATOM 267 N HIS A 18 6.892 -4.314 1.226 1.00 10.00 N ATOM 268 CA HIS A 18 5.665 -5.095 1.150 1.00 10.00 C ATOM 269 C HIS A 18 5.909 -6.475 0.599 1.00 10.00 C ATOM 270 O HIS A 18 6.737 -6.654 -0.286 1.00 10.00 O ATOM 271 CB HIS A 18 4.635 -4.393 0.277 1.00 10.00 C ATOM 272 CG HIS A 18 4.058 -3.230 1.004 1.00 10.00 C ATOM 273 ND1 HIS A 18 3.692 -3.240 2.322 1.00 10.00 N ATOM 274 CD2 HIS A 18 3.947 -1.958 0.540 1.00 10.00 C ATOM 275 CE1 HIS A 18 3.341 -1.991 2.641 1.00 10.00 C ATOM 276 NE2 HIS A 18 3.493 -1.161 1.596 1.00 10.00 N ATOM 0 H HIS A 18 7.224 -3.969 0.325 1.00 10.00 H new ATOM 0 HA HIS A 18 5.289 -5.188 2.169 1.00 10.00 H new ATOM 0 HB2 HIS A 18 5.100 -4.058 -0.650 1.00 10.00 H new ATOM 0 HB3 HIS A 18 3.843 -5.090 0.003 1.00 10.00 H new ATOM 0 HD2 HIS A 18 4.169 -1.623 -0.462 1.00 10.00 H new ATOM 0 HE1 HIS A 18 2.982 -1.688 3.613 1.00 10.00 H new ATOM 0 HE2 HIS A 18 3.314 -0.157 1.577 1.00 10.00 H new ATOM 284 N THR A 19 5.132 -7.429 1.109 1.00 10.00 N ATOM 285 CA THR A 19 5.265 -8.819 0.737 1.00 10.00 C ATOM 286 C THR A 19 3.959 -9.409 0.225 1.00 10.00 C ATOM 287 O THR A 19 3.982 -10.144 -0.747 1.00 10.00 O ATOM 288 CB THR A 19 5.859 -9.581 1.913 1.00 10.00 C ATOM 289 OG1 THR A 19 7.066 -8.939 2.291 1.00 10.00 O ATOM 290 CG2 THR A 19 6.106 -11.033 1.521 1.00 10.00 C ATOM 0 H THR A 19 4.395 -7.251 1.791 1.00 10.00 H new ATOM 0 HA THR A 19 5.947 -8.909 -0.108 1.00 10.00 H new ATOM 0 HB THR A 19 5.170 -9.582 2.758 1.00 10.00 H new ATOM 0 HG1 THR A 19 7.778 -9.606 2.378 1.00 10.00 H new ATOM 0 HG21 THR A 19 6.531 -11.571 2.368 1.00 10.00 H new ATOM 0 HG22 THR A 19 5.163 -11.497 1.232 1.00 10.00 H new ATOM 0 HG23 THR A 19 6.801 -11.070 0.682 1.00 10.00 H new ATOM 298 N VAL A 20 2.844 -9.119 0.897 1.00 10.00 N ATOM 299 CA VAL A 20 1.476 -9.481 0.533 1.00 10.00 C ATOM 300 C VAL A 20 1.166 -10.974 0.680 1.00 10.00 C ATOM 301 O VAL A 20 0.005 -11.366 0.606 1.00 10.00 O ATOM 302 CB VAL A 20 0.993 -8.840 -0.792 1.00 10.00 C ATOM 303 CG1 VAL A 20 1.082 -7.315 -0.732 1.00 10.00 C ATOM 304 CG2 VAL A 20 1.641 -9.279 -2.105 1.00 10.00 C ATOM 0 H VAL A 20 2.876 -8.589 1.768 1.00 10.00 H new ATOM 0 HA VAL A 20 0.848 -9.015 1.292 1.00 10.00 H new ATOM 0 HB VAL A 20 -0.027 -9.221 -0.838 1.00 10.00 H new ATOM 0 HG11 VAL A 20 0.737 -6.893 -1.676 1.00 10.00 H new ATOM 0 HG12 VAL A 20 0.457 -6.946 0.081 1.00 10.00 H new ATOM 0 HG13 VAL A 20 2.116 -7.017 -0.558 1.00 10.00 H new ATOM 0 HG21 VAL A 20 1.188 -8.735 -2.934 1.00 10.00 H new ATOM 0 HG22 VAL A 20 2.710 -9.067 -2.072 1.00 10.00 H new ATOM 0 HG23 VAL A 20 1.488 -10.349 -2.247 1.00 10.00 H new ATOM 314 N GLU A 21 2.180 -11.790 0.989 1.00 10.00 N ATOM 315 CA GLU A 21 2.091 -13.241 0.952 1.00 10.00 C ATOM 316 C GLU A 21 2.080 -13.843 2.362 1.00 10.00 C ATOM 317 O GLU A 21 2.491 -14.983 2.564 1.00 10.00 O ATOM 318 CB GLU A 21 3.276 -13.778 0.134 1.00 10.00 C ATOM 319 CG GLU A 21 3.425 -13.073 -1.230 1.00 10.00 C ATOM 320 CD GLU A 21 3.339 -13.989 -2.448 1.00 10.00 C ATOM 321 OE1 GLU A 21 3.933 -15.086 -2.372 1.00 10.00 O ATOM 322 OE2 GLU A 21 2.737 -13.544 -3.454 1.00 10.00 O ATOM 0 H GLU A 21 3.097 -11.448 1.276 1.00 10.00 H new ATOM 0 HA GLU A 21 1.152 -13.532 0.482 1.00 10.00 H new ATOM 0 HB2 GLU A 21 4.195 -13.651 0.706 1.00 10.00 H new ATOM 0 HB3 GLU A 21 3.146 -14.848 -0.027 1.00 10.00 H new ATOM 0 HG2 GLU A 21 2.650 -12.311 -1.313 1.00 10.00 H new ATOM 0 HG3 GLU A 21 4.385 -12.556 -1.251 1.00 10.00 H new ATOM 329 N LYS A 22 1.692 -13.040 3.358 1.00 10.00 N ATOM 330 CA LYS A 22 1.799 -13.303 4.792 1.00 10.00 C ATOM 331 C LYS A 22 3.120 -13.950 5.249 1.00 10.00 C ATOM 332 O LYS A 22 3.184 -14.564 6.310 1.00 10.00 O ATOM 333 CB LYS A 22 0.526 -13.953 5.347 1.00 10.00 C ATOM 334 CG LYS A 22 0.191 -15.383 4.894 1.00 10.00 C ATOM 335 CD LYS A 22 0.874 -16.426 5.793 1.00 10.00 C ATOM 336 CE LYS A 22 0.024 -17.693 5.988 1.00 10.00 C ATOM 337 NZ LYS A 22 0.220 -18.682 4.908 1.00 10.00 N ATOM 0 H LYS A 22 1.268 -12.132 3.169 1.00 10.00 H new ATOM 0 HA LYS A 22 1.866 -12.324 5.267 1.00 10.00 H new ATOM 0 HB2 LYS A 22 0.599 -13.955 6.435 1.00 10.00 H new ATOM 0 HB3 LYS A 22 -0.317 -13.313 5.085 1.00 10.00 H new ATOM 0 HG2 LYS A 22 -0.889 -15.531 4.917 1.00 10.00 H new ATOM 0 HG3 LYS A 22 0.510 -15.524 3.861 1.00 10.00 H new ATOM 0 HD2 LYS A 22 1.834 -16.702 5.357 1.00 10.00 H new ATOM 0 HD3 LYS A 22 1.082 -15.980 6.766 1.00 10.00 H new ATOM 0 HE2 LYS A 22 0.276 -18.151 6.945 1.00 10.00 H new ATOM 0 HE3 LYS A 22 -1.029 -17.416 6.035 1.00 10.00 H new ATOM 0 HZ1 LYS A 22 -0.375 -19.515 5.088 1.00 10.00 H new ATOM 0 HZ2 LYS A 22 -0.045 -18.258 3.996 1.00 10.00 H new ATOM 0 HZ3 LYS A 22 1.219 -18.970 4.878 1.00 10.00 H new ATOM 351 N GLY A 23 4.191 -13.751 4.477 1.00 10.00 N ATOM 352 CA GLY A 23 5.488 -14.403 4.632 1.00 10.00 C ATOM 353 C GLY A 23 6.611 -13.391 4.844 1.00 10.00 C ATOM 354 O GLY A 23 7.673 -13.730 5.362 1.00 10.00 O ATOM 0 H GLY A 23 4.174 -13.101 3.692 1.00 10.00 H new ATOM 0 HA2 GLY A 23 5.451 -15.088 5.479 1.00 10.00 H new ATOM 0 HA3 GLY A 23 5.701 -15.002 3.747 1.00 10.00 H new ATOM 358 N GLY A 24 6.367 -12.125 4.497 1.00 10.00 N ATOM 359 CA GLY A 24 7.308 -11.040 4.718 1.00 10.00 C ATOM 360 C GLY A 24 7.501 -10.669 6.181 1.00 10.00 C ATOM 361 O GLY A 24 8.293 -9.775 6.477 1.00 10.00 O ATOM 0 H GLY A 24 5.499 -11.828 4.050 1.00 10.00 H new ATOM 0 HA2 GLY A 24 8.273 -11.320 4.295 1.00 10.00 H new ATOM 0 HA3 GLY A 24 6.965 -10.160 4.174 1.00 10.00 H new ATOM 365 N LYS A 25 6.787 -11.344 7.081 1.00 10.00 N ATOM 366 CA LYS A 25 6.859 -11.149 8.513 1.00 10.00 C ATOM 367 C LYS A 25 6.192 -9.807 8.840 1.00 10.00 C ATOM 368 O LYS A 25 5.128 -9.509 8.305 1.00 10.00 O ATOM 369 CB LYS A 25 8.310 -11.295 9.022 1.00 10.00 C ATOM 370 CG LYS A 25 9.070 -12.502 8.432 1.00 10.00 C ATOM 371 CD LYS A 25 10.351 -12.054 7.707 1.00 10.00 C ATOM 372 CE LYS A 25 11.326 -13.204 7.409 1.00 10.00 C ATOM 373 NZ LYS A 25 12.366 -13.354 8.452 1.00 10.00 N ATOM 0 H LYS A 25 6.120 -12.067 6.814 1.00 10.00 H new ATOM 0 HA LYS A 25 6.313 -11.925 9.050 1.00 10.00 H new ATOM 0 HB2 LYS A 25 8.859 -10.384 8.786 1.00 10.00 H new ATOM 0 HB3 LYS A 25 8.295 -11.385 10.108 1.00 10.00 H new ATOM 0 HG2 LYS A 25 9.326 -13.199 9.230 1.00 10.00 H new ATOM 0 HG3 LYS A 25 8.424 -13.037 7.736 1.00 10.00 H new ATOM 0 HD2 LYS A 25 10.077 -11.570 6.770 1.00 10.00 H new ATOM 0 HD3 LYS A 25 10.860 -11.306 8.315 1.00 10.00 H new ATOM 0 HE2 LYS A 25 10.767 -14.136 7.322 1.00 10.00 H new ATOM 0 HE3 LYS A 25 11.805 -13.029 6.446 1.00 10.00 H new ATOM 0 HZ1 LYS A 25 12.997 -14.143 8.203 1.00 10.00 H new ATOM 0 HZ2 LYS A 25 12.919 -12.476 8.519 1.00 10.00 H new ATOM 0 HZ3 LYS A 25 11.914 -13.549 9.368 1.00 10.00 H new ATOM 387 N HIS A 26 6.802 -8.997 9.703 1.00 10.00 N ATOM 388 CA HIS A 26 6.246 -7.724 10.144 1.00 10.00 C ATOM 389 C HIS A 26 7.026 -6.596 9.465 1.00 10.00 C ATOM 390 O HIS A 26 6.487 -5.888 8.619 1.00 10.00 O ATOM 391 CB HIS A 26 6.243 -7.646 11.687 1.00 10.00 C ATOM 392 CG HIS A 26 6.713 -8.902 12.392 1.00 10.00 C ATOM 393 ND1 HIS A 26 8.007 -9.179 12.781 1.00 10.00 N ATOM 394 CD2 HIS A 26 5.971 -10.036 12.600 1.00 10.00 C ATOM 395 CE1 HIS A 26 8.035 -10.451 13.218 1.00 10.00 C ATOM 396 NE2 HIS A 26 6.823 -11.016 13.115 1.00 10.00 N ATOM 0 H HIS A 26 7.708 -9.211 10.120 1.00 10.00 H new ATOM 0 HA HIS A 26 5.202 -7.623 9.848 1.00 10.00 H new ATOM 0 HB2 HIS A 26 6.878 -6.815 11.995 1.00 10.00 H new ATOM 0 HB3 HIS A 26 5.232 -7.416 12.022 1.00 10.00 H new ATOM 0 HD2 HIS A 26 4.916 -10.151 12.401 1.00 10.00 H new ATOM 0 HE1 HIS A 26 8.914 -10.949 13.600 1.00 10.00 H new ATOM 0 HE2 HIS A 26 6.573 -11.973 13.364 1.00 10.00 H new ATOM 404 N LYS A 27 8.320 -6.493 9.792 1.00 10.00 N ATOM 405 CA LYS A 27 9.260 -5.510 9.255 1.00 10.00 C ATOM 406 C LYS A 27 8.652 -4.091 9.153 1.00 10.00 C ATOM 407 O LYS A 27 7.897 -3.715 10.048 1.00 10.00 O ATOM 408 CB LYS A 27 9.992 -6.061 8.025 1.00 10.00 C ATOM 409 CG LYS A 27 9.030 -6.420 6.900 1.00 10.00 C ATOM 410 CD LYS A 27 9.799 -6.830 5.638 1.00 10.00 C ATOM 411 CE LYS A 27 8.789 -7.029 4.503 1.00 10.00 C ATOM 412 NZ LYS A 27 9.403 -7.017 3.155 1.00 10.00 N ATOM 0 H LYS A 27 8.756 -7.121 10.467 1.00 10.00 H new ATOM 0 HA LYS A 27 10.062 -5.346 9.974 1.00 10.00 H new ATOM 0 HB2 LYS A 27 10.707 -5.321 7.667 1.00 10.00 H new ATOM 0 HB3 LYS A 27 10.563 -6.945 8.309 1.00 10.00 H new ATOM 0 HG2 LYS A 27 8.380 -7.236 7.217 1.00 10.00 H new ATOM 0 HG3 LYS A 27 8.387 -5.568 6.679 1.00 10.00 H new ATOM 0 HD2 LYS A 27 10.525 -6.063 5.370 1.00 10.00 H new ATOM 0 HD3 LYS A 27 10.357 -7.749 5.815 1.00 10.00 H new ATOM 0 HE2 LYS A 27 8.272 -7.978 4.650 1.00 10.00 H new ATOM 0 HE3 LYS A 27 8.035 -6.244 4.557 1.00 10.00 H new ATOM 0 HZ1 LYS A 27 8.849 -7.622 2.516 1.00 10.00 H new ATOM 0 HZ2 LYS A 27 9.414 -6.044 2.787 1.00 10.00 H new ATOM 0 HZ3 LYS A 27 10.377 -7.376 3.214 1.00 10.00 H new ATOM 426 N THR A 28 8.966 -3.292 8.114 1.00 10.00 N ATOM 427 CA THR A 28 8.261 -2.022 7.904 1.00 10.00 C ATOM 428 C THR A 28 6.880 -2.255 7.270 1.00 10.00 C ATOM 429 O THR A 28 5.876 -1.988 7.920 1.00 10.00 O ATOM 430 CB THR A 28 9.132 -0.887 7.308 1.00 10.00 C ATOM 431 OG1 THR A 28 10.224 -0.629 8.164 1.00 10.00 O ATOM 432 CG2 THR A 28 8.335 0.400 7.168 1.00 10.00 C ATOM 0 H THR A 28 9.687 -3.501 7.424 1.00 10.00 H new ATOM 0 HA THR A 28 8.045 -1.596 8.884 1.00 10.00 H new ATOM 0 HB THR A 28 9.474 -1.212 6.325 1.00 10.00 H new ATOM 0 HG1 THR A 28 10.775 0.088 7.785 1.00 10.00 H new ATOM 0 HG21 THR A 28 8.972 1.178 6.747 1.00 10.00 H new ATOM 0 HG22 THR A 28 7.484 0.231 6.508 1.00 10.00 H new ATOM 0 HG23 THR A 28 7.977 0.715 8.148 1.00 10.00 H new ATOM 440 N GLY A 29 6.771 -2.721 6.022 1.00 10.00 N ATOM 441 CA GLY A 29 5.460 -2.820 5.383 1.00 10.00 C ATOM 442 C GLY A 29 4.652 -3.991 5.955 1.00 10.00 C ATOM 443 O GLY A 29 5.087 -5.139 5.845 1.00 10.00 O ATOM 0 H GLY A 29 7.556 -3.028 5.447 1.00 10.00 H new ATOM 0 HA2 GLY A 29 4.910 -1.890 5.528 1.00 10.00 H new ATOM 0 HA3 GLY A 29 5.585 -2.952 4.308 1.00 10.00 H new ATOM 447 N PRO A 30 3.474 -3.743 6.550 1.00 10.00 N ATOM 448 CA PRO A 30 2.843 -4.721 7.412 1.00 10.00 C ATOM 449 C PRO A 30 2.069 -5.775 6.647 1.00 10.00 C ATOM 450 O PRO A 30 0.842 -5.746 6.661 1.00 10.00 O ATOM 451 CB PRO A 30 1.936 -3.898 8.322 1.00 10.00 C ATOM 452 CG PRO A 30 1.532 -2.699 7.479 1.00 10.00 C ATOM 453 CD PRO A 30 2.809 -2.453 6.682 1.00 10.00 C ATOM 0 HA PRO A 30 3.584 -5.295 7.969 1.00 10.00 H new ATOM 0 HB2 PRO A 30 1.065 -4.472 8.638 1.00 10.00 H new ATOM 0 HB3 PRO A 30 2.458 -3.588 9.227 1.00 10.00 H new ATOM 0 HG2 PRO A 30 0.680 -2.917 6.835 1.00 10.00 H new ATOM 0 HG3 PRO A 30 1.257 -1.840 8.091 1.00 10.00 H new ATOM 0 HD2 PRO A 30 2.579 -2.034 5.702 1.00 10.00 H new ATOM 0 HD3 PRO A 30 3.452 -1.736 7.193 1.00 10.00 H new ATOM 461 N ASN A 31 2.811 -6.712 6.039 1.00 10.00 N ATOM 462 CA ASN A 31 2.316 -7.930 5.404 1.00 10.00 C ATOM 463 C ASN A 31 0.918 -7.689 4.847 1.00 10.00 C ATOM 464 O ASN A 31 -0.071 -8.064 5.471 1.00 10.00 O ATOM 465 CB ASN A 31 2.351 -9.113 6.398 1.00 10.00 C ATOM 466 CG ASN A 31 3.369 -10.206 6.075 1.00 10.00 C ATOM 467 OD1 ASN A 31 4.159 -10.132 5.134 1.00 10.00 O ATOM 468 ND2 ASN A 31 3.299 -11.292 6.838 1.00 10.00 N ATOM 0 H ASN A 31 3.826 -6.631 5.977 1.00 10.00 H new ATOM 0 HA ASN A 31 2.966 -8.195 4.570 1.00 10.00 H new ATOM 0 HB2 ASN A 31 2.564 -8.724 7.394 1.00 10.00 H new ATOM 0 HB3 ASN A 31 1.359 -9.563 6.437 1.00 10.00 H new ATOM 0 HD21 ASN A 31 3.908 -12.088 6.649 1.00 10.00 H new ATOM 0 HD22 ASN A 31 2.636 -11.329 7.612 1.00 10.00 H new ATOM 475 N LEU A 32 0.860 -7.014 3.693 1.00 10.00 N ATOM 476 CA LEU A 32 -0.352 -6.514 3.047 1.00 10.00 C ATOM 477 C LEU A 32 -1.205 -7.654 2.454 1.00 10.00 C ATOM 478 O LEU A 32 -1.687 -7.606 1.326 1.00 10.00 O ATOM 479 CB LEU A 32 0.073 -5.444 2.019 1.00 10.00 C ATOM 480 CG LEU A 32 -0.070 -4.028 2.556 1.00 10.00 C ATOM 481 CD1 LEU A 32 0.795 -3.707 3.774 1.00 10.00 C ATOM 482 CD2 LEU A 32 0.107 -3.023 1.411 1.00 10.00 C ATOM 0 H LEU A 32 1.701 -6.792 3.160 1.00 10.00 H new ATOM 0 HA LEU A 32 -1.014 -6.048 3.777 1.00 10.00 H new ATOM 0 HB2 LEU A 32 1.110 -5.616 1.729 1.00 10.00 H new ATOM 0 HB3 LEU A 32 -0.532 -5.550 1.118 1.00 10.00 H new ATOM 0 HG LEU A 32 -1.082 -3.942 2.951 1.00 10.00 H new ATOM 0 HD11 LEU A 32 0.622 -2.676 4.081 1.00 10.00 H new ATOM 0 HD12 LEU A 32 0.534 -4.378 4.592 1.00 10.00 H new ATOM 0 HD13 LEU A 32 1.846 -3.838 3.518 1.00 10.00 H new ATOM 0 HD21 LEU A 32 0.004 -2.009 1.798 1.00 10.00 H new ATOM 0 HD22 LEU A 32 1.096 -3.145 0.970 1.00 10.00 H new ATOM 0 HD23 LEU A 32 -0.654 -3.200 0.651 1.00 10.00 H new ATOM 494 N HIS A 33 -1.408 -8.688 3.258 1.00 10.00 N ATOM 495 CA HIS A 33 -2.107 -9.911 2.985 1.00 10.00 C ATOM 496 C HIS A 33 -3.569 -9.627 3.311 1.00 10.00 C ATOM 497 O HIS A 33 -3.958 -9.578 4.476 1.00 10.00 O ATOM 498 CB HIS A 33 -1.498 -10.975 3.900 1.00 10.00 C ATOM 499 CG HIS A 33 -2.247 -12.273 3.832 1.00 10.00 C ATOM 500 ND1 HIS A 33 -2.331 -13.125 2.755 1.00 10.00 N ATOM 501 CD2 HIS A 33 -2.917 -12.839 4.878 1.00 10.00 C ATOM 502 CE1 HIS A 33 -3.058 -14.186 3.153 1.00 10.00 C ATOM 503 NE2 HIS A 33 -3.419 -14.067 4.444 1.00 10.00 N ATOM 0 H HIS A 33 -1.046 -8.678 4.211 1.00 10.00 H new ATOM 0 HA HIS A 33 -2.031 -10.263 1.956 1.00 10.00 H new ATOM 0 HB2 HIS A 33 -0.458 -11.142 3.619 1.00 10.00 H new ATOM 0 HB3 HIS A 33 -1.496 -10.611 4.927 1.00 10.00 H new ATOM 0 HD2 HIS A 33 -3.037 -12.414 5.863 1.00 10.00 H new ATOM 0 HE1 HIS A 33 -3.317 -15.022 2.520 1.00 10.00 H new ATOM 0 HE2 HIS A 33 -3.953 -14.739 4.995 1.00 10.00 H new ATOM 511 N GLY A 34 -4.357 -9.360 2.275 1.00 10.00 N ATOM 512 CA GLY A 34 -5.743 -8.953 2.399 1.00 10.00 C ATOM 513 C GLY A 34 -5.870 -7.474 2.765 1.00 10.00 C ATOM 514 O GLY A 34 -6.808 -7.083 3.455 1.00 10.00 O ATOM 0 H GLY A 34 -4.039 -9.423 1.308 1.00 10.00 H new ATOM 0 HA2 GLY A 34 -6.262 -9.141 1.459 1.00 10.00 H new ATOM 0 HA3 GLY A 34 -6.233 -9.559 3.161 1.00 10.00 H new ATOM 518 N LEU A 35 -4.958 -6.640 2.245 1.00 10.00 N ATOM 519 CA LEU A 35 -5.159 -5.197 2.119 1.00 10.00 C ATOM 520 C LEU A 35 -6.568 -4.938 1.573 1.00 10.00 C ATOM 521 O LEU A 35 -7.345 -4.176 2.144 1.00 10.00 O ATOM 522 CB LEU A 35 -4.087 -4.668 1.154 1.00 10.00 C ATOM 523 CG LEU A 35 -4.233 -3.219 0.664 1.00 10.00 C ATOM 524 CD1 LEU A 35 -3.992 -2.194 1.770 1.00 10.00 C ATOM 525 CD2 LEU A 35 -3.231 -2.978 -0.468 1.00 10.00 C ATOM 0 H LEU A 35 -4.052 -6.956 1.898 1.00 10.00 H new ATOM 0 HA LEU A 35 -5.069 -4.690 3.080 1.00 10.00 H new ATOM 0 HB2 LEU A 35 -3.117 -4.763 1.642 1.00 10.00 H new ATOM 0 HB3 LEU A 35 -4.069 -5.319 0.280 1.00 10.00 H new ATOM 0 HG LEU A 35 -5.259 -3.090 0.320 1.00 10.00 H new ATOM 0 HD11 LEU A 35 -4.108 -1.188 1.366 1.00 10.00 H new ATOM 0 HD12 LEU A 35 -4.713 -2.348 2.573 1.00 10.00 H new ATOM 0 HD13 LEU A 35 -2.982 -2.313 2.162 1.00 10.00 H new ATOM 0 HD21 LEU A 35 -3.325 -1.952 -0.825 1.00 10.00 H new ATOM 0 HD22 LEU A 35 -2.219 -3.143 -0.099 1.00 10.00 H new ATOM 0 HD23 LEU A 35 -3.435 -3.667 -1.287 1.00 10.00 H new ATOM 537 N PHE A 36 -6.888 -5.605 0.461 1.00 10.00 N ATOM 538 CA PHE A 36 -8.193 -5.529 -0.164 1.00 10.00 C ATOM 539 C PHE A 36 -9.203 -6.280 0.700 1.00 10.00 C ATOM 540 O PHE A 36 -9.133 -7.502 0.797 1.00 10.00 O ATOM 541 CB PHE A 36 -8.153 -6.096 -1.592 1.00 10.00 C ATOM 542 CG PHE A 36 -7.403 -5.234 -2.594 1.00 10.00 C ATOM 543 CD1 PHE A 36 -6.005 -5.113 -2.513 1.00 10.00 C ATOM 544 CD2 PHE A 36 -8.101 -4.538 -3.601 1.00 10.00 C ATOM 545 CE1 PHE A 36 -5.331 -4.208 -3.345 1.00 10.00 C ATOM 546 CE2 PHE A 36 -7.415 -3.660 -4.460 1.00 10.00 C ATOM 547 CZ PHE A 36 -6.036 -3.457 -4.294 1.00 10.00 C ATOM 0 H PHE A 36 -6.235 -6.217 -0.029 1.00 10.00 H new ATOM 0 HA PHE A 36 -8.496 -4.485 -0.242 1.00 10.00 H new ATOM 0 HB2 PHE A 36 -7.691 -7.083 -1.564 1.00 10.00 H new ATOM 0 HB3 PHE A 36 -9.176 -6.232 -1.944 1.00 10.00 H new ATOM 0 HD1 PHE A 36 -5.450 -5.717 -1.810 1.00 10.00 H new ATOM 0 HD2 PHE A 36 -9.166 -4.679 -3.714 1.00 10.00 H new ATOM 0 HE1 PHE A 36 -4.261 -4.089 -3.254 1.00 10.00 H new ATOM 0 HE2 PHE A 36 -7.948 -3.144 -5.245 1.00 10.00 H new ATOM 0 HZ PHE A 36 -5.520 -2.724 -4.896 1.00 10.00 H new ATOM 557 N GLY A 37 -10.146 -5.546 1.296 1.00 10.00 N ATOM 558 CA GLY A 37 -11.234 -6.105 2.091 1.00 10.00 C ATOM 559 C GLY A 37 -11.066 -5.823 3.583 1.00 10.00 C ATOM 560 O GLY A 37 -11.550 -6.589 4.415 1.00 10.00 O ATOM 0 H GLY A 37 -10.172 -4.528 1.236 1.00 10.00 H new ATOM 0 HA2 GLY A 37 -12.182 -5.689 1.749 1.00 10.00 H new ATOM 0 HA3 GLY A 37 -11.282 -7.182 1.930 1.00 10.00 H new ATOM 564 N ARG A 38 -10.419 -4.710 3.935 1.00 10.00 N ATOM 565 CA ARG A 38 -10.291 -4.255 5.307 1.00 10.00 C ATOM 566 C ARG A 38 -10.085 -2.741 5.268 1.00 10.00 C ATOM 567 O ARG A 38 -9.649 -2.199 4.252 1.00 10.00 O ATOM 568 CB ARG A 38 -9.148 -5.026 5.987 1.00 10.00 C ATOM 569 CG ARG A 38 -9.114 -4.846 7.511 1.00 10.00 C ATOM 570 CD ARG A 38 -8.219 -5.918 8.150 1.00 10.00 C ATOM 571 NE ARG A 38 -8.894 -7.225 8.227 1.00 10.00 N ATOM 572 CZ ARG A 38 -8.321 -8.355 8.677 1.00 10.00 C ATOM 573 NH1 ARG A 38 -7.010 -8.377 8.942 1.00 10.00 N ATOM 574 NH2 ARG A 38 -9.061 -9.454 8.868 1.00 10.00 N ATOM 0 H ARG A 38 -9.965 -4.095 3.259 1.00 10.00 H new ATOM 0 HA ARG A 38 -11.182 -4.453 5.903 1.00 10.00 H new ATOM 0 HB2 ARG A 38 -9.247 -6.087 5.756 1.00 10.00 H new ATOM 0 HB3 ARG A 38 -8.197 -4.696 5.568 1.00 10.00 H new ATOM 0 HG2 ARG A 38 -8.739 -3.853 7.759 1.00 10.00 H new ATOM 0 HG3 ARG A 38 -10.124 -4.916 7.916 1.00 10.00 H new ATOM 0 HD2 ARG A 38 -7.301 -6.017 7.570 1.00 10.00 H new ATOM 0 HD3 ARG A 38 -7.930 -5.599 9.152 1.00 10.00 H new ATOM 0 HE ARG A 38 -9.864 -7.276 7.917 1.00 10.00 H new ATOM 0 HH11 ARG A 38 -6.447 -7.538 8.803 1.00 10.00 H new ATOM 0 HH12 ARG A 38 -6.573 -9.233 9.284 1.00 10.00 H new ATOM 0 HH21 ARG A 38 -10.062 -9.435 8.672 1.00 10.00 H new ATOM 0 HH22 ARG A 38 -8.624 -10.310 9.209 1.00 10.00 H new ATOM 588 N LYS A 39 -10.476 -2.056 6.344 1.00 10.00 N ATOM 589 CA LYS A 39 -10.285 -0.621 6.499 1.00 10.00 C ATOM 590 C LYS A 39 -8.846 -0.329 6.930 1.00 10.00 C ATOM 591 O LYS A 39 -8.047 -1.243 7.128 1.00 10.00 O ATOM 592 CB LYS A 39 -11.308 -0.101 7.517 1.00 10.00 C ATOM 593 CG LYS A 39 -12.694 -0.009 6.862 1.00 10.00 C ATOM 594 CD LYS A 39 -13.851 -0.308 7.830 1.00 10.00 C ATOM 595 CE LYS A 39 -14.605 -1.569 7.371 1.00 10.00 C ATOM 596 NZ LYS A 39 -15.839 -1.806 8.148 1.00 10.00 N ATOM 0 H LYS A 39 -10.940 -2.492 7.141 1.00 10.00 H new ATOM 0 HA LYS A 39 -10.446 -0.106 5.552 1.00 10.00 H new ATOM 0 HB2 LYS A 39 -11.347 -0.766 8.379 1.00 10.00 H new ATOM 0 HB3 LYS A 39 -11.003 0.879 7.884 1.00 10.00 H new ATOM 0 HG2 LYS A 39 -12.826 0.991 6.448 1.00 10.00 H new ATOM 0 HG3 LYS A 39 -12.740 -0.708 6.027 1.00 10.00 H new ATOM 0 HD2 LYS A 39 -13.465 -0.452 8.839 1.00 10.00 H new ATOM 0 HD3 LYS A 39 -14.534 0.541 7.868 1.00 10.00 H new ATOM 0 HE2 LYS A 39 -14.858 -1.473 6.315 1.00 10.00 H new ATOM 0 HE3 LYS A 39 -13.949 -2.435 7.464 1.00 10.00 H new ATOM 0 HZ1 LYS A 39 -16.309 -2.666 7.800 1.00 10.00 H new ATOM 0 HZ2 LYS A 39 -15.599 -1.925 9.153 1.00 10.00 H new ATOM 0 HZ3 LYS A 39 -16.479 -0.994 8.039 1.00 10.00 H new ATOM 610 N THR A 40 -8.517 0.954 7.070 1.00 10.00 N ATOM 611 CA THR A 40 -7.220 1.398 7.536 1.00 10.00 C ATOM 612 C THR A 40 -7.060 1.177 9.043 1.00 10.00 C ATOM 613 O THR A 40 -7.940 0.630 9.705 1.00 10.00 O ATOM 614 CB THR A 40 -7.050 2.871 7.163 1.00 10.00 C ATOM 615 OG1 THR A 40 -7.977 3.698 7.823 1.00 10.00 O ATOM 616 CG2 THR A 40 -7.138 3.091 5.667 1.00 10.00 C ATOM 0 H THR A 40 -9.158 1.719 6.858 1.00 10.00 H new ATOM 0 HA THR A 40 -6.439 0.809 7.056 1.00 10.00 H new ATOM 0 HB THR A 40 -6.050 3.149 7.495 1.00 10.00 H new ATOM 0 HG1 THR A 40 -7.504 4.282 8.452 1.00 10.00 H new ATOM 0 HG21 THR A 40 -7.012 4.151 5.447 1.00 10.00 H new ATOM 0 HG22 THR A 40 -6.354 2.521 5.169 1.00 10.00 H new ATOM 0 HG23 THR A 40 -8.112 2.759 5.307 1.00 10.00 H new ATOM 624 N GLY A 41 -5.914 1.613 9.579 1.00 10.00 N ATOM 625 CA GLY A 41 -5.519 1.420 10.970 1.00 10.00 C ATOM 626 C GLY A 41 -5.782 0.001 11.472 1.00 10.00 C ATOM 627 O GLY A 41 -6.262 -0.192 12.589 1.00 10.00 O ATOM 0 H GLY A 41 -5.218 2.125 9.036 1.00 10.00 H new ATOM 0 HA2 GLY A 41 -4.458 1.646 11.076 1.00 10.00 H new ATOM 0 HA3 GLY A 41 -6.060 2.128 11.598 1.00 10.00 H new ATOM 631 N GLN A 42 -5.482 -0.987 10.629 1.00 10.00 N ATOM 632 CA GLN A 42 -5.707 -2.395 10.893 1.00 10.00 C ATOM 633 C GLN A 42 -4.550 -3.173 10.287 1.00 10.00 C ATOM 634 O GLN A 42 -4.614 -3.609 9.140 1.00 10.00 O ATOM 635 CB GLN A 42 -7.052 -2.844 10.305 1.00 10.00 C ATOM 636 CG GLN A 42 -8.264 -2.453 11.158 1.00 10.00 C ATOM 637 CD GLN A 42 -8.226 -3.120 12.529 1.00 10.00 C ATOM 638 OE1 GLN A 42 -8.668 -4.254 12.682 1.00 10.00 O ATOM 639 NE2 GLN A 42 -7.679 -2.437 13.530 1.00 10.00 N ATOM 0 H GLN A 42 -5.062 -0.816 9.715 1.00 10.00 H new ATOM 0 HA GLN A 42 -5.752 -2.581 11.966 1.00 10.00 H new ATOM 0 HB2 GLN A 42 -7.165 -2.412 9.311 1.00 10.00 H new ATOM 0 HB3 GLN A 42 -7.040 -3.927 10.182 1.00 10.00 H new ATOM 0 HG2 GLN A 42 -8.289 -1.370 11.280 1.00 10.00 H new ATOM 0 HG3 GLN A 42 -9.180 -2.737 10.640 1.00 10.00 H new ATOM 0 HE21 GLN A 42 -7.321 -1.496 13.369 1.00 10.00 H new ATOM 0 HE22 GLN A 42 -7.618 -2.854 14.459 1.00 10.00 H new ATOM 648 N ALA A 43 -3.490 -3.326 11.077 1.00 10.00 N ATOM 649 CA ALA A 43 -2.310 -4.093 10.726 1.00 10.00 C ATOM 650 C ALA A 43 -2.285 -5.363 11.582 1.00 10.00 C ATOM 651 O ALA A 43 -2.899 -5.389 12.651 1.00 10.00 O ATOM 652 CB ALA A 43 -1.070 -3.226 10.961 1.00 10.00 C ATOM 0 H ALA A 43 -3.432 -2.905 12.004 1.00 10.00 H new ATOM 0 HA ALA A 43 -2.324 -4.386 9.676 1.00 10.00 H new ATOM 0 HB1 ALA A 43 -0.176 -3.792 10.701 1.00 10.00 H new ATOM 0 HB2 ALA A 43 -1.128 -2.332 10.340 1.00 10.00 H new ATOM 0 HB3 ALA A 43 -1.023 -2.936 12.011 1.00 10.00 H new ATOM 658 N PRO A 44 -1.572 -6.413 11.151 1.00 10.00 N ATOM 659 CA PRO A 44 -1.425 -7.637 11.913 1.00 10.00 C ATOM 660 C PRO A 44 -0.452 -7.388 13.072 1.00 10.00 C ATOM 661 O PRO A 44 0.702 -7.809 13.033 1.00 10.00 O ATOM 662 CB PRO A 44 -0.924 -8.671 10.898 1.00 10.00 C ATOM 663 CG PRO A 44 -0.152 -7.848 9.863 1.00 10.00 C ATOM 664 CD PRO A 44 -0.786 -6.458 9.932 1.00 10.00 C ATOM 0 HA PRO A 44 -2.346 -7.993 12.376 1.00 10.00 H new ATOM 0 HB2 PRO A 44 -0.283 -9.415 11.372 1.00 10.00 H new ATOM 0 HB3 PRO A 44 -1.752 -9.210 10.439 1.00 10.00 H new ATOM 0 HG2 PRO A 44 0.912 -7.812 10.098 1.00 10.00 H new ATOM 0 HG3 PRO A 44 -0.244 -8.277 8.865 1.00 10.00 H new ATOM 0 HD2 PRO A 44 -0.019 -5.684 9.938 1.00 10.00 H new ATOM 0 HD3 PRO A 44 -1.415 -6.277 9.060 1.00 10.00 H new ATOM 672 N GLY A 45 -0.899 -6.650 14.093 1.00 10.00 N ATOM 673 CA GLY A 45 -0.152 -6.402 15.325 1.00 10.00 C ATOM 674 C GLY A 45 0.972 -5.372 15.172 1.00 10.00 C ATOM 675 O GLY A 45 1.226 -4.614 16.104 1.00 10.00 O ATOM 0 H GLY A 45 -1.813 -6.198 14.083 1.00 10.00 H new ATOM 0 HA2 GLY A 45 -0.843 -6.059 16.095 1.00 10.00 H new ATOM 0 HA3 GLY A 45 0.275 -7.342 15.675 1.00 10.00 H new ATOM 679 N PHE A 46 1.643 -5.353 14.013 1.00 10.00 N ATOM 680 CA PHE A 46 2.616 -4.338 13.615 1.00 10.00 C ATOM 681 C PHE A 46 2.210 -2.936 14.111 1.00 10.00 C ATOM 682 O PHE A 46 1.044 -2.559 14.006 1.00 10.00 O ATOM 683 CB PHE A 46 2.733 -4.335 12.084 1.00 10.00 C ATOM 684 CG PHE A 46 3.246 -3.033 11.497 1.00 10.00 C ATOM 685 CD1 PHE A 46 2.336 -2.008 11.168 1.00 10.00 C ATOM 686 CD2 PHE A 46 4.619 -2.844 11.261 1.00 10.00 C ATOM 687 CE1 PHE A 46 2.787 -0.835 10.546 1.00 10.00 C ATOM 688 CE2 PHE A 46 5.079 -1.610 10.774 1.00 10.00 C ATOM 689 CZ PHE A 46 4.165 -0.606 10.415 1.00 10.00 C ATOM 0 H PHE A 46 1.515 -6.074 13.303 1.00 10.00 H new ATOM 0 HA PHE A 46 3.577 -4.582 14.069 1.00 10.00 H new ATOM 0 HB2 PHE A 46 3.399 -5.143 11.781 1.00 10.00 H new ATOM 0 HB3 PHE A 46 1.754 -4.551 11.657 1.00 10.00 H new ATOM 0 HD1 PHE A 46 1.287 -2.127 11.396 1.00 10.00 H new ATOM 0 HD2 PHE A 46 5.317 -3.645 11.454 1.00 10.00 H new ATOM 0 HE1 PHE A 46 2.078 -0.112 10.170 1.00 10.00 H new ATOM 0 HE2 PHE A 46 6.140 -1.432 10.675 1.00 10.00 H new ATOM 0 HZ PHE A 46 4.522 0.341 10.039 1.00 10.00 H new ATOM 699 N THR A 47 3.172 -2.146 14.595 1.00 10.00 N ATOM 700 CA THR A 47 2.950 -0.777 15.042 1.00 10.00 C ATOM 701 C THR A 47 2.710 0.168 13.857 1.00 10.00 C ATOM 702 O THR A 47 3.660 0.626 13.225 1.00 10.00 O ATOM 703 CB THR A 47 4.156 -0.341 15.885 1.00 10.00 C ATOM 704 OG1 THR A 47 4.296 -1.242 16.965 1.00 10.00 O ATOM 705 CG2 THR A 47 4.014 1.093 16.411 1.00 10.00 C ATOM 0 H THR A 47 4.142 -2.449 14.687 1.00 10.00 H new ATOM 0 HA THR A 47 2.048 -0.731 15.653 1.00 10.00 H new ATOM 0 HB THR A 47 5.042 -0.356 15.251 1.00 10.00 H new ATOM 0 HG1 THR A 47 5.064 -0.978 17.513 1.00 10.00 H new ATOM 0 HG21 THR A 47 4.893 1.353 17.001 1.00 10.00 H new ATOM 0 HG22 THR A 47 3.924 1.782 15.571 1.00 10.00 H new ATOM 0 HG23 THR A 47 3.124 1.165 17.036 1.00 10.00 H new ATOM 713 N TYR A 48 1.441 0.494 13.593 1.00 10.00 N ATOM 714 CA TYR A 48 1.021 1.434 12.565 1.00 10.00 C ATOM 715 C TYR A 48 0.898 2.831 13.160 1.00 10.00 C ATOM 716 O TYR A 48 0.569 2.985 14.334 1.00 10.00 O ATOM 717 CB TYR A 48 -0.310 0.981 11.944 1.00 10.00 C ATOM 718 CG TYR A 48 -1.441 0.756 12.936 1.00 10.00 C ATOM 719 CD1 TYR A 48 -1.575 -0.492 13.571 1.00 10.00 C ATOM 720 CD2 TYR A 48 -2.313 1.806 13.282 1.00 10.00 C ATOM 721 CE1 TYR A 48 -2.535 -0.681 14.577 1.00 10.00 C ATOM 722 CE2 TYR A 48 -3.288 1.611 14.276 1.00 10.00 C ATOM 723 CZ TYR A 48 -3.379 0.379 14.945 1.00 10.00 C ATOM 724 OH TYR A 48 -4.261 0.228 15.973 1.00 10.00 O ATOM 0 H TYR A 48 0.657 0.095 14.109 1.00 10.00 H new ATOM 0 HA TYR A 48 1.771 1.461 11.775 1.00 10.00 H new ATOM 0 HB2 TYR A 48 -0.628 1.729 11.218 1.00 10.00 H new ATOM 0 HB3 TYR A 48 -0.140 0.055 11.394 1.00 10.00 H new ATOM 0 HD1 TYR A 48 -0.934 -1.312 13.282 1.00 10.00 H new ATOM 0 HD2 TYR A 48 -2.233 2.761 12.784 1.00 10.00 H new ATOM 0 HE1 TYR A 48 -2.624 -1.639 15.067 1.00 10.00 H new ATOM 0 HE2 TYR A 48 -3.969 2.411 14.526 1.00 10.00 H new ATOM 0 HH TYR A 48 -4.766 1.059 16.095 1.00 10.00 H new ATOM 734 N THR A 49 1.145 3.849 12.335 1.00 10.00 N ATOM 735 CA THR A 49 0.941 5.231 12.730 1.00 10.00 C ATOM 736 C THR A 49 -0.557 5.525 12.836 1.00 10.00 C ATOM 737 O THR A 49 -1.332 5.092 11.978 1.00 10.00 O ATOM 738 CB THR A 49 1.645 6.185 11.746 1.00 10.00 C ATOM 739 OG1 THR A 49 1.365 7.526 12.099 1.00 10.00 O ATOM 740 CG2 THR A 49 1.244 5.984 10.278 1.00 10.00 C ATOM 0 H THR A 49 1.490 3.734 11.382 1.00 10.00 H new ATOM 0 HA THR A 49 1.386 5.395 13.711 1.00 10.00 H new ATOM 0 HB THR A 49 2.708 5.956 11.825 1.00 10.00 H new ATOM 0 HG1 THR A 49 1.815 8.130 11.472 1.00 10.00 H new ATOM 0 HG21 THR A 49 1.785 6.695 9.653 1.00 10.00 H new ATOM 0 HG22 THR A 49 1.491 4.968 9.969 1.00 10.00 H new ATOM 0 HG23 THR A 49 0.172 6.146 10.168 1.00 10.00 H new ATOM 748 N ASP A 50 -0.953 6.300 13.852 1.00 10.00 N ATOM 749 CA ASP A 50 -2.302 6.825 14.007 1.00 10.00 C ATOM 750 C ASP A 50 -2.834 7.379 12.694 1.00 10.00 C ATOM 751 O ASP A 50 -3.980 7.103 12.370 1.00 10.00 O ATOM 752 CB ASP A 50 -2.357 7.884 15.111 1.00 10.00 C ATOM 753 CG ASP A 50 -2.502 7.223 16.472 1.00 10.00 C ATOM 754 OD1 ASP A 50 -1.493 6.634 16.914 1.00 10.00 O ATOM 755 OD2 ASP A 50 -3.625 7.289 17.017 1.00 10.00 O ATOM 0 H ASP A 50 -0.324 6.583 14.604 1.00 10.00 H new ATOM 0 HA ASP A 50 -2.946 5.997 14.303 1.00 10.00 H new ATOM 0 HB2 ASP A 50 -1.451 8.490 15.088 1.00 10.00 H new ATOM 0 HB3 ASP A 50 -3.195 8.558 14.936 1.00 10.00 H new ATOM 760 N ALA A 51 -2.014 8.100 11.916 1.00 10.00 N ATOM 761 CA ALA A 51 -2.373 8.586 10.580 1.00 10.00 C ATOM 762 C ALA A 51 -3.136 7.536 9.762 1.00 10.00 C ATOM 763 O ALA A 51 -4.106 7.867 9.082 1.00 10.00 O ATOM 764 CB ALA A 51 -1.115 9.039 9.831 1.00 10.00 C ATOM 0 H ALA A 51 -1.071 8.364 12.202 1.00 10.00 H new ATOM 0 HA ALA A 51 -3.043 9.436 10.711 1.00 10.00 H new ATOM 0 HB1 ALA A 51 -1.391 9.398 8.840 1.00 10.00 H new ATOM 0 HB2 ALA A 51 -0.630 9.842 10.386 1.00 10.00 H new ATOM 0 HB3 ALA A 51 -0.427 8.199 9.734 1.00 10.00 H new ATOM 770 N ASN A 52 -2.719 6.267 9.818 1.00 10.00 N ATOM 771 CA ASN A 52 -3.389 5.205 9.081 1.00 10.00 C ATOM 772 C ASN A 52 -4.830 5.046 9.585 1.00 10.00 C ATOM 773 O ASN A 52 -5.783 5.027 8.810 1.00 10.00 O ATOM 774 CB ASN A 52 -2.585 3.898 9.197 1.00 10.00 C ATOM 775 CG ASN A 52 -3.005 2.862 8.156 1.00 10.00 C ATOM 776 OD1 ASN A 52 -3.693 3.173 7.193 1.00 10.00 O ATOM 777 ND2 ASN A 52 -2.631 1.601 8.349 1.00 10.00 N ATOM 0 H ASN A 52 -1.919 5.956 10.369 1.00 10.00 H new ATOM 0 HA ASN A 52 -3.440 5.465 8.024 1.00 10.00 H new ATOM 0 HB2 ASN A 52 -1.523 4.116 9.081 1.00 10.00 H new ATOM 0 HB3 ASN A 52 -2.717 3.481 10.195 1.00 10.00 H new ATOM 0 HD21 ASN A 52 -2.918 0.877 7.690 1.00 10.00 H new ATOM 0 HD22 ASN A 52 -2.057 1.357 9.156 1.00 10.00 H new ATOM 784 N LYS A 53 -5.017 4.963 10.901 1.00 10.00 N ATOM 785 CA LYS A 53 -6.341 4.827 11.496 1.00 10.00 C ATOM 786 C LYS A 53 -7.171 6.093 11.272 1.00 10.00 C ATOM 787 O LYS A 53 -8.366 6.013 11.001 1.00 10.00 O ATOM 788 CB LYS A 53 -6.179 4.489 12.984 1.00 10.00 C ATOM 789 CG LYS A 53 -7.435 3.845 13.588 1.00 10.00 C ATOM 790 CD LYS A 53 -7.172 3.532 15.073 1.00 10.00 C ATOM 791 CE LYS A 53 -8.206 4.175 16.007 1.00 10.00 C ATOM 792 NZ LYS A 53 -9.460 3.398 16.081 1.00 10.00 N ATOM 0 H LYS A 53 -4.257 4.988 11.581 1.00 10.00 H new ATOM 0 HA LYS A 53 -6.887 4.016 11.015 1.00 10.00 H new ATOM 0 HB2 LYS A 53 -5.334 3.812 13.108 1.00 10.00 H new ATOM 0 HB3 LYS A 53 -5.942 5.399 13.535 1.00 10.00 H new ATOM 0 HG2 LYS A 53 -8.287 4.517 13.490 1.00 10.00 H new ATOM 0 HG3 LYS A 53 -7.686 2.931 13.049 1.00 10.00 H new ATOM 0 HD2 LYS A 53 -7.179 2.452 15.219 1.00 10.00 H new ATOM 0 HD3 LYS A 53 -6.176 3.884 15.343 1.00 10.00 H new ATOM 0 HE2 LYS A 53 -7.780 4.268 17.006 1.00 10.00 H new ATOM 0 HE3 LYS A 53 -8.427 5.184 15.659 1.00 10.00 H new ATOM 0 HZ1 LYS A 53 -10.125 3.873 16.724 1.00 10.00 H new ATOM 0 HZ2 LYS A 53 -9.883 3.330 15.133 1.00 10.00 H new ATOM 0 HZ3 LYS A 53 -9.256 2.443 16.438 1.00 10.00 H new ATOM 806 N ASN A 54 -6.519 7.251 11.362 1.00 10.00 N ATOM 807 CA ASN A 54 -7.097 8.567 11.146 1.00 10.00 C ATOM 808 C ASN A 54 -7.677 8.663 9.742 1.00 10.00 C ATOM 809 O ASN A 54 -8.671 9.349 9.526 1.00 10.00 O ATOM 810 CB ASN A 54 -6.023 9.649 11.342 1.00 10.00 C ATOM 811 CG ASN A 54 -6.599 10.889 12.009 1.00 10.00 C ATOM 812 OD1 ASN A 54 -6.760 11.932 11.387 1.00 10.00 O ATOM 813 ND2 ASN A 54 -6.892 10.783 13.303 1.00 10.00 N ATOM 0 H ASN A 54 -5.528 7.294 11.599 1.00 10.00 H new ATOM 0 HA ASN A 54 -7.898 8.722 11.869 1.00 10.00 H new ATOM 0 HB2 ASN A 54 -5.210 9.251 11.950 1.00 10.00 H new ATOM 0 HB3 ASN A 54 -5.596 9.919 10.376 1.00 10.00 H new ATOM 0 HD21 ASN A 54 -7.264 11.587 13.809 1.00 10.00 H new ATOM 0 HD22 ASN A 54 -6.745 9.898 13.788 1.00 10.00 H new ATOM 820 N LYS A 55 -7.039 7.973 8.791 1.00 10.00 N ATOM 821 CA LYS A 55 -7.457 7.968 7.403 1.00 10.00 C ATOM 822 C LYS A 55 -8.902 7.480 7.299 1.00 10.00 C ATOM 823 O LYS A 55 -9.733 8.120 6.664 1.00 10.00 O ATOM 824 CB LYS A 55 -6.476 7.097 6.614 1.00 10.00 C ATOM 825 CG LYS A 55 -6.261 7.623 5.194 1.00 10.00 C ATOM 826 CD LYS A 55 -4.988 6.996 4.612 1.00 10.00 C ATOM 827 CE LYS A 55 -3.704 7.699 5.119 1.00 10.00 C ATOM 828 NZ LYS A 55 -2.534 6.794 5.287 1.00 10.00 N ATOM 0 H LYS A 55 -6.214 7.402 8.973 1.00 10.00 H new ATOM 0 HA LYS A 55 -7.439 8.972 6.979 1.00 10.00 H new ATOM 0 HB2 LYS A 55 -5.520 7.062 7.137 1.00 10.00 H new ATOM 0 HB3 LYS A 55 -6.853 6.075 6.569 1.00 10.00 H new ATOM 0 HG2 LYS A 55 -7.120 7.379 4.569 1.00 10.00 H new ATOM 0 HG3 LYS A 55 -6.174 8.709 5.205 1.00 10.00 H new ATOM 0 HD2 LYS A 55 -4.951 5.940 4.878 1.00 10.00 H new ATOM 0 HD3 LYS A 55 -5.024 7.049 3.524 1.00 10.00 H new ATOM 0 HE2 LYS A 55 -3.438 8.491 4.420 1.00 10.00 H new ATOM 0 HE3 LYS A 55 -3.919 8.177 6.075 1.00 10.00 H new ATOM 0 HZ1 LYS A 55 -1.875 7.204 5.979 1.00 10.00 H new ATOM 0 HZ2 LYS A 55 -2.859 5.866 5.626 1.00 10.00 H new ATOM 0 HZ3 LYS A 55 -2.050 6.679 4.374 1.00 10.00 H new ATOM 842 N GLY A 56 -9.191 6.353 7.953 1.00 10.00 N ATOM 843 CA GLY A 56 -10.530 5.807 8.083 1.00 10.00 C ATOM 844 C GLY A 56 -11.180 5.547 6.727 1.00 10.00 C ATOM 845 O GLY A 56 -12.314 5.956 6.490 1.00 10.00 O ATOM 0 H GLY A 56 -8.479 5.787 8.415 1.00 10.00 H new ATOM 0 HA2 GLY A 56 -10.488 4.876 8.648 1.00 10.00 H new ATOM 0 HA3 GLY A 56 -11.149 6.499 8.654 1.00 10.00 H new ATOM 849 N ILE A 57 -10.462 4.845 5.847 1.00 10.00 N ATOM 850 CA ILE A 57 -10.912 4.523 4.496 1.00 10.00 C ATOM 851 C ILE A 57 -10.731 3.030 4.232 1.00 10.00 C ATOM 852 O ILE A 57 -10.437 2.272 5.158 1.00 10.00 O ATOM 853 CB ILE A 57 -10.205 5.433 3.467 1.00 10.00 C ATOM 854 CG1 ILE A 57 -8.680 5.320 3.542 1.00 10.00 C ATOM 855 CG2 ILE A 57 -10.675 6.883 3.613 1.00 10.00 C ATOM 856 CD1 ILE A 57 -7.999 6.207 2.496 1.00 10.00 C ATOM 0 H ILE A 57 -9.534 4.479 6.060 1.00 10.00 H new ATOM 0 HA ILE A 57 -11.978 4.726 4.392 1.00 10.00 H new ATOM 0 HB ILE A 57 -10.489 5.085 2.474 1.00 10.00 H new ATOM 0 HG12 ILE A 57 -8.342 5.605 4.538 1.00 10.00 H new ATOM 0 HG13 ILE A 57 -8.383 4.282 3.389 1.00 10.00 H new ATOM 0 HG21 ILE A 57 -10.165 7.507 2.879 1.00 10.00 H new ATOM 0 HG22 ILE A 57 -11.751 6.935 3.448 1.00 10.00 H new ATOM 0 HG23 ILE A 57 -10.444 7.241 4.616 1.00 10.00 H new ATOM 0 HD11 ILE A 57 -6.917 6.102 2.578 1.00 10.00 H new ATOM 0 HD12 ILE A 57 -8.318 5.904 1.499 1.00 10.00 H new ATOM 0 HD13 ILE A 57 -8.276 7.248 2.665 1.00 10.00 H new ATOM 868 N THR A 58 -10.950 2.608 2.985 1.00 10.00 N ATOM 869 CA THR A 58 -10.833 1.232 2.536 1.00 10.00 C ATOM 870 C THR A 58 -9.714 1.131 1.501 1.00 10.00 C ATOM 871 O THR A 58 -9.095 2.131 1.142 1.00 10.00 O ATOM 872 CB THR A 58 -12.184 0.785 1.950 1.00 10.00 C ATOM 873 OG1 THR A 58 -12.526 1.563 0.817 1.00 10.00 O ATOM 874 CG2 THR A 58 -13.309 0.923 2.981 1.00 10.00 C ATOM 0 H THR A 58 -11.224 3.245 2.237 1.00 10.00 H new ATOM 0 HA THR A 58 -10.582 0.575 3.369 1.00 10.00 H new ATOM 0 HB THR A 58 -12.074 -0.261 1.665 1.00 10.00 H new ATOM 0 HG1 THR A 58 -13.387 1.260 0.460 1.00 10.00 H new ATOM 0 HG21 THR A 58 -14.251 0.600 2.537 1.00 10.00 H new ATOM 0 HG22 THR A 58 -13.085 0.303 3.849 1.00 10.00 H new ATOM 0 HG23 THR A 58 -13.393 1.965 3.291 1.00 10.00 H new ATOM 882 N TRP A 59 -9.503 -0.076 0.979 1.00 10.00 N ATOM 883 CA TRP A 59 -8.545 -0.360 -0.069 1.00 10.00 C ATOM 884 C TRP A 59 -9.255 -1.264 -1.065 1.00 10.00 C ATOM 885 O TRP A 59 -9.534 -2.420 -0.763 1.00 10.00 O ATOM 886 CB TRP A 59 -7.326 -1.031 0.557 1.00 10.00 C ATOM 887 CG TRP A 59 -6.719 -0.203 1.638 1.00 10.00 C ATOM 888 CD1 TRP A 59 -6.912 -0.370 2.963 1.00 10.00 C ATOM 889 CD2 TRP A 59 -5.953 1.023 1.489 1.00 10.00 C ATOM 890 NE1 TRP A 59 -6.284 0.653 3.640 1.00 10.00 N ATOM 891 CE2 TRP A 59 -5.728 1.582 2.777 1.00 10.00 C ATOM 892 CE3 TRP A 59 -5.453 1.735 0.383 1.00 10.00 C ATOM 893 CZ2 TRP A 59 -5.065 2.811 2.944 1.00 10.00 C ATOM 894 CZ3 TRP A 59 -4.720 2.922 0.546 1.00 10.00 C ATOM 895 CH2 TRP A 59 -4.567 3.481 1.821 1.00 10.00 C ATOM 0 H TRP A 59 -10.013 -0.903 1.288 1.00 10.00 H new ATOM 0 HA TRP A 59 -8.193 0.536 -0.581 1.00 10.00 H new ATOM 0 HB2 TRP A 59 -7.616 -2.000 0.963 1.00 10.00 H new ATOM 0 HB3 TRP A 59 -6.581 -1.219 -0.216 1.00 10.00 H new ATOM 0 HD1 TRP A 59 -7.469 -1.175 3.419 1.00 10.00 H new ATOM 0 HE1 TRP A 59 -6.235 0.718 4.657 1.00 10.00 H new ATOM 0 HE3 TRP A 59 -5.637 1.360 -0.613 1.00 10.00 H new ATOM 0 HZ2 TRP A 59 -4.941 3.234 3.930 1.00 10.00 H new ATOM 0 HZ3 TRP A 59 -4.274 3.404 -0.312 1.00 10.00 H new ATOM 0 HH2 TRP A 59 -4.064 4.430 1.938 1.00 10.00 H new ATOM 906 N LYS A 60 -9.617 -0.712 -2.220 1.00 10.00 N ATOM 907 CA LYS A 60 -10.277 -1.455 -3.281 1.00 10.00 C ATOM 908 C LYS A 60 -9.938 -0.797 -4.610 1.00 10.00 C ATOM 909 O LYS A 60 -10.831 -0.419 -5.356 1.00 10.00 O ATOM 910 CB LYS A 60 -11.791 -1.514 -3.039 1.00 10.00 C ATOM 911 CG LYS A 60 -12.441 -0.120 -2.961 1.00 10.00 C ATOM 912 CD LYS A 60 -13.600 0.063 -3.960 1.00 10.00 C ATOM 913 CE LYS A 60 -14.857 0.608 -3.264 1.00 10.00 C ATOM 914 NZ LYS A 60 -15.722 1.360 -4.194 1.00 10.00 N ATOM 0 H LYS A 60 -9.458 0.270 -2.444 1.00 10.00 H new ATOM 0 HA LYS A 60 -9.924 -2.486 -3.297 1.00 10.00 H new ATOM 0 HB2 LYS A 60 -12.260 -2.083 -3.841 1.00 10.00 H new ATOM 0 HB3 LYS A 60 -11.985 -2.052 -2.111 1.00 10.00 H new ATOM 0 HG2 LYS A 60 -12.812 0.045 -1.949 1.00 10.00 H new ATOM 0 HG3 LYS A 60 -11.682 0.639 -3.151 1.00 10.00 H new ATOM 0 HD2 LYS A 60 -13.295 0.747 -4.752 1.00 10.00 H new ATOM 0 HD3 LYS A 60 -13.829 -0.892 -4.433 1.00 10.00 H new ATOM 0 HE2 LYS A 60 -15.421 -0.220 -2.834 1.00 10.00 H new ATOM 0 HE3 LYS A 60 -14.562 1.256 -2.439 1.00 10.00 H new ATOM 0 HZ1 LYS A 60 -15.677 2.374 -3.967 1.00 10.00 H new ATOM 0 HZ2 LYS A 60 -15.396 1.209 -5.170 1.00 10.00 H new ATOM 0 HZ3 LYS A 60 -16.703 1.027 -4.101 1.00 10.00 H new ATOM 928 N GLU A 61 -8.644 -0.575 -4.836 1.00 10.00 N ATOM 929 CA GLU A 61 -8.094 0.156 -5.967 1.00 10.00 C ATOM 930 C GLU A 61 -8.402 1.650 -5.927 1.00 10.00 C ATOM 931 O GLU A 61 -7.470 2.420 -6.052 1.00 10.00 O ATOM 932 CB GLU A 61 -8.370 -0.517 -7.318 1.00 10.00 C ATOM 933 CG GLU A 61 -9.578 -0.052 -8.145 1.00 10.00 C ATOM 934 CD GLU A 61 -10.136 -1.222 -8.937 1.00 10.00 C ATOM 935 OE1 GLU A 61 -10.705 -2.125 -8.286 1.00 10.00 O ATOM 936 OE2 GLU A 61 -9.903 -1.299 -10.158 1.00 10.00 O ATOM 0 H GLU A 61 -7.921 -0.917 -4.204 1.00 10.00 H new ATOM 0 HA GLU A 61 -7.011 0.102 -5.858 1.00 10.00 H new ATOM 0 HB2 GLU A 61 -7.480 -0.394 -7.936 1.00 10.00 H new ATOM 0 HB3 GLU A 61 -8.486 -1.585 -7.136 1.00 10.00 H new ATOM 0 HG2 GLU A 61 -10.347 0.354 -7.487 1.00 10.00 H new ATOM 0 HG3 GLU A 61 -9.281 0.749 -8.822 1.00 10.00 H new ATOM 943 N GLU A 62 -9.651 2.070 -5.711 1.00 10.00 N ATOM 944 CA GLU A 62 -10.068 3.473 -5.683 1.00 10.00 C ATOM 945 C GLU A 62 -9.112 4.342 -4.864 1.00 10.00 C ATOM 946 O GLU A 62 -8.402 5.189 -5.400 1.00 10.00 O ATOM 947 CB GLU A 62 -11.493 3.546 -5.095 1.00 10.00 C ATOM 948 CG GLU A 62 -12.577 3.811 -6.144 1.00 10.00 C ATOM 949 CD GLU A 62 -13.911 3.270 -5.659 1.00 10.00 C ATOM 950 OE1 GLU A 62 -14.319 3.613 -4.528 1.00 10.00 O ATOM 951 OE2 GLU A 62 -14.491 2.375 -6.308 1.00 10.00 O ATOM 0 H GLU A 62 -10.422 1.424 -5.546 1.00 10.00 H new ATOM 0 HA GLU A 62 -10.053 3.862 -6.701 1.00 10.00 H new ATOM 0 HB2 GLU A 62 -11.715 2.609 -4.585 1.00 10.00 H new ATOM 0 HB3 GLU A 62 -11.527 4.334 -4.343 1.00 10.00 H new ATOM 0 HG2 GLU A 62 -12.657 4.881 -6.335 1.00 10.00 H new ATOM 0 HG3 GLU A 62 -12.305 3.339 -7.088 1.00 10.00 H new ATOM 958 N THR A 63 -9.091 4.140 -3.547 1.00 10.00 N ATOM 959 CA THR A 63 -8.252 4.960 -2.690 1.00 10.00 C ATOM 960 C THR A 63 -6.780 4.790 -3.075 1.00 10.00 C ATOM 961 O THR A 63 -6.047 5.771 -3.095 1.00 10.00 O ATOM 962 CB THR A 63 -8.569 4.694 -1.206 1.00 10.00 C ATOM 963 OG1 THR A 63 -9.328 5.774 -0.704 1.00 10.00 O ATOM 964 CG2 THR A 63 -7.323 4.481 -0.351 1.00 10.00 C ATOM 0 H THR A 63 -9.637 3.428 -3.062 1.00 10.00 H new ATOM 0 HA THR A 63 -8.474 6.016 -2.842 1.00 10.00 H new ATOM 0 HB THR A 63 -9.134 3.764 -1.151 1.00 10.00 H new ATOM 0 HG1 THR A 63 -8.817 6.605 -0.799 1.00 10.00 H new ATOM 0 HG21 THR A 63 -7.618 4.299 0.682 1.00 10.00 H new ATOM 0 HG22 THR A 63 -6.767 3.622 -0.726 1.00 10.00 H new ATOM 0 HG23 THR A 63 -6.694 5.370 -0.398 1.00 10.00 H new ATOM 972 N LEU A 64 -6.356 3.560 -3.384 1.00 10.00 N ATOM 973 CA LEU A 64 -4.984 3.209 -3.745 1.00 10.00 C ATOM 974 C LEU A 64 -4.513 4.002 -4.972 1.00 10.00 C ATOM 975 O LEU A 64 -3.411 4.546 -4.983 1.00 10.00 O ATOM 976 CB LEU A 64 -4.910 1.686 -3.984 1.00 10.00 C ATOM 977 CG LEU A 64 -4.094 0.907 -2.943 1.00 10.00 C ATOM 978 CD1 LEU A 64 -4.822 -0.376 -2.525 1.00 10.00 C ATOM 979 CD2 LEU A 64 -2.696 0.554 -3.469 1.00 10.00 C ATOM 0 H LEU A 64 -6.983 2.755 -3.389 1.00 10.00 H new ATOM 0 HA LEU A 64 -4.311 3.474 -2.930 1.00 10.00 H new ATOM 0 HB2 LEU A 64 -5.924 1.286 -4.003 1.00 10.00 H new ATOM 0 HB3 LEU A 64 -4.479 1.508 -4.969 1.00 10.00 H new ATOM 0 HG LEU A 64 -3.983 1.556 -2.074 1.00 10.00 H new ATOM 0 HD11 LEU A 64 -4.223 -0.910 -1.787 1.00 10.00 H new ATOM 0 HD12 LEU A 64 -5.789 -0.121 -2.092 1.00 10.00 H new ATOM 0 HD13 LEU A 64 -4.972 -1.011 -3.399 1.00 10.00 H new ATOM 0 HD21 LEU A 64 -2.148 0.003 -2.705 1.00 10.00 H new ATOM 0 HD22 LEU A 64 -2.789 -0.062 -4.364 1.00 10.00 H new ATOM 0 HD23 LEU A 64 -2.157 1.470 -3.713 1.00 10.00 H new ATOM 991 N MET A 65 -5.359 4.080 -5.997 1.00 10.00 N ATOM 992 CA MET A 65 -5.160 4.820 -7.227 1.00 10.00 C ATOM 993 C MET A 65 -4.836 6.278 -6.922 1.00 10.00 C ATOM 994 O MET A 65 -3.992 6.850 -7.602 1.00 10.00 O ATOM 995 CB MET A 65 -6.408 4.666 -8.121 1.00 10.00 C ATOM 996 CG MET A 65 -6.352 3.394 -8.984 1.00 10.00 C ATOM 997 SD MET A 65 -6.544 3.643 -10.770 1.00 10.00 S ATOM 998 CE MET A 65 -8.282 4.131 -10.851 1.00 10.00 C ATOM 0 H MET A 65 -6.256 3.595 -5.983 1.00 10.00 H new ATOM 0 HA MET A 65 -4.307 4.418 -7.773 1.00 10.00 H new ATOM 0 HB2 MET A 65 -7.300 4.639 -7.495 1.00 10.00 H new ATOM 0 HB3 MET A 65 -6.499 5.538 -8.768 1.00 10.00 H new ATOM 0 HG2 MET A 65 -5.398 2.899 -8.806 1.00 10.00 H new ATOM 0 HG3 MET A 65 -7.133 2.713 -8.645 1.00 10.00 H new ATOM 0 HE1 MET A 65 -8.559 4.321 -11.888 1.00 10.00 H new ATOM 0 HE2 MET A 65 -8.904 3.330 -10.451 1.00 10.00 H new ATOM 0 HE3 MET A 65 -8.433 5.036 -10.263 1.00 10.00 H new ATOM 1008 N GLU A 66 -5.446 6.859 -5.886 1.00 10.00 N ATOM 1009 CA GLU A 66 -5.099 8.200 -5.445 1.00 10.00 C ATOM 1010 C GLU A 66 -3.825 8.144 -4.608 1.00 10.00 C ATOM 1011 O GLU A 66 -2.872 8.867 -4.861 1.00 10.00 O ATOM 1012 CB GLU A 66 -6.265 8.811 -4.654 1.00 10.00 C ATOM 1013 CG GLU A 66 -7.229 9.607 -5.551 1.00 10.00 C ATOM 1014 CD GLU A 66 -7.363 11.044 -5.057 1.00 10.00 C ATOM 1015 OE1 GLU A 66 -7.793 11.199 -3.893 1.00 10.00 O ATOM 1016 OE2 GLU A 66 -6.998 11.957 -5.827 1.00 10.00 O ATOM 0 H GLU A 66 -6.184 6.415 -5.340 1.00 10.00 H new ATOM 0 HA GLU A 66 -4.914 8.838 -6.309 1.00 10.00 H new ATOM 0 HB2 GLU A 66 -6.815 8.016 -4.150 1.00 10.00 H new ATOM 0 HB3 GLU A 66 -5.870 9.467 -3.878 1.00 10.00 H new ATOM 0 HG2 GLU A 66 -6.865 9.603 -6.578 1.00 10.00 H new ATOM 0 HG3 GLU A 66 -8.208 9.127 -5.558 1.00 10.00 H new ATOM 1023 N TYR A 67 -3.797 7.278 -3.600 1.00 10.00 N ATOM 1024 CA TYR A 67 -2.765 7.237 -2.583 1.00 10.00 C ATOM 1025 C TYR A 67 -1.396 7.067 -3.204 1.00 10.00 C ATOM 1026 O TYR A 67 -0.492 7.866 -2.983 1.00 10.00 O ATOM 1027 CB TYR A 67 -3.055 6.087 -1.623 1.00 10.00 C ATOM 1028 CG TYR A 67 -2.342 6.251 -0.304 1.00 10.00 C ATOM 1029 CD1 TYR A 67 -0.940 6.140 -0.196 1.00 10.00 C ATOM 1030 CD2 TYR A 67 -3.101 6.585 0.822 1.00 10.00 C ATOM 1031 CE1 TYR A 67 -0.313 6.334 1.046 1.00 10.00 C ATOM 1032 CE2 TYR A 67 -2.487 6.635 2.073 1.00 10.00 C ATOM 1033 CZ TYR A 67 -1.102 6.476 2.198 1.00 10.00 C ATOM 1034 OH TYR A 67 -0.574 6.330 3.446 1.00 10.00 O ATOM 0 H TYR A 67 -4.516 6.566 -3.469 1.00 10.00 H new ATOM 0 HA TYR A 67 -2.768 8.181 -2.039 1.00 10.00 H new ATOM 0 HB2 TYR A 67 -4.129 6.024 -1.448 1.00 10.00 H new ATOM 0 HB3 TYR A 67 -2.752 5.147 -2.083 1.00 10.00 H new ATOM 0 HD1 TYR A 67 -0.348 5.906 -1.069 1.00 10.00 H new ATOM 0 HD2 TYR A 67 -4.154 6.802 0.724 1.00 10.00 H new ATOM 0 HE1 TYR A 67 0.764 6.373 1.114 1.00 10.00 H new ATOM 0 HE2 TYR A 67 -3.087 6.798 2.956 1.00 10.00 H new ATOM 0 HH TYR A 67 0.369 6.598 3.436 1.00 10.00 H new ATOM 1044 N LEU A 68 -1.235 6.019 -4.002 1.00 10.00 N ATOM 1045 CA LEU A 68 0.021 5.772 -4.672 1.00 10.00 C ATOM 1046 C LEU A 68 0.341 6.921 -5.632 1.00 10.00 C ATOM 1047 O LEU A 68 1.502 7.107 -5.998 1.00 10.00 O ATOM 1048 CB LEU A 68 -0.032 4.422 -5.398 1.00 10.00 C ATOM 1049 CG LEU A 68 -0.404 3.223 -4.513 1.00 10.00 C ATOM 1050 CD1 LEU A 68 -0.236 1.946 -5.346 1.00 10.00 C ATOM 1051 CD2 LEU A 68 0.405 3.156 -3.212 1.00 10.00 C ATOM 0 H LEU A 68 -1.962 5.331 -4.197 1.00 10.00 H new ATOM 0 HA LEU A 68 0.824 5.724 -3.936 1.00 10.00 H new ATOM 0 HB2 LEU A 68 -0.754 4.492 -6.211 1.00 10.00 H new ATOM 0 HB3 LEU A 68 0.941 4.232 -5.851 1.00 10.00 H new ATOM 0 HG LEU A 68 -1.440 3.336 -4.194 1.00 10.00 H new ATOM 0 HD11 LEU A 68 -0.495 1.079 -4.739 1.00 10.00 H new ATOM 0 HD12 LEU A 68 -0.893 1.989 -6.215 1.00 10.00 H new ATOM 0 HD13 LEU A 68 0.799 1.861 -5.677 1.00 10.00 H new ATOM 0 HD21 LEU A 68 0.093 2.286 -2.634 1.00 10.00 H new ATOM 0 HD22 LEU A 68 1.466 3.074 -3.447 1.00 10.00 H new ATOM 0 HD23 LEU A 68 0.232 4.060 -2.629 1.00 10.00 H new ATOM 1063 N GLU A 69 -0.673 7.646 -6.119 1.00 10.00 N ATOM 1064 CA GLU A 69 -0.520 8.807 -6.988 1.00 10.00 C ATOM 1065 C GLU A 69 -0.374 10.099 -6.180 1.00 10.00 C ATOM 1066 O GLU A 69 -0.222 11.172 -6.752 1.00 10.00 O ATOM 1067 CB GLU A 69 -1.681 8.818 -7.998 1.00 10.00 C ATOM 1068 CG GLU A 69 -1.363 9.489 -9.344 1.00 10.00 C ATOM 1069 CD GLU A 69 -1.925 10.898 -9.483 1.00 10.00 C ATOM 1070 OE1 GLU A 69 -3.128 11.063 -9.196 1.00 10.00 O ATOM 1071 OE2 GLU A 69 -1.146 11.763 -9.937 1.00 10.00 O ATOM 0 H GLU A 69 -1.648 7.431 -5.910 1.00 10.00 H new ATOM 0 HA GLU A 69 0.408 8.740 -7.556 1.00 10.00 H new ATOM 0 HB2 GLU A 69 -1.990 7.790 -8.185 1.00 10.00 H new ATOM 0 HB3 GLU A 69 -2.531 9.329 -7.546 1.00 10.00 H new ATOM 0 HG2 GLU A 69 -0.281 9.526 -9.473 1.00 10.00 H new ATOM 0 HG3 GLU A 69 -1.759 8.870 -10.149 1.00 10.00 H new ATOM 1078 N ASN A 70 -0.360 10.007 -4.848 1.00 10.00 N ATOM 1079 CA ASN A 70 -0.304 11.165 -3.978 1.00 10.00 C ATOM 1080 C ASN A 70 -0.081 10.717 -2.524 1.00 10.00 C ATOM 1081 O ASN A 70 -0.912 10.955 -1.645 1.00 10.00 O ATOM 1082 CB ASN A 70 -1.596 11.980 -4.181 1.00 10.00 C ATOM 1083 CG ASN A 70 -1.366 13.318 -4.875 1.00 10.00 C ATOM 1084 OD1 ASN A 70 -0.401 14.022 -4.585 1.00 10.00 O ATOM 1085 ND2 ASN A 70 -2.277 13.711 -5.760 1.00 10.00 N ATOM 0 H ASN A 70 -0.388 9.118 -4.348 1.00 10.00 H new ATOM 0 HA ASN A 70 0.539 11.811 -4.224 1.00 10.00 H new ATOM 0 HB2 ASN A 70 -2.300 11.391 -4.769 1.00 10.00 H new ATOM 0 HB3 ASN A 70 -2.061 12.157 -3.211 1.00 10.00 H new ATOM 0 HD21 ASN A 70 -2.185 14.618 -6.218 1.00 10.00 H new ATOM 0 HD22 ASN A 70 -3.068 13.106 -5.981 1.00 10.00 H new ATOM 1092 N PRO A 71 1.082 10.116 -2.218 1.00 10.00 N ATOM 1093 CA PRO A 71 1.396 9.668 -0.870 1.00 10.00 C ATOM 1094 C PRO A 71 1.732 10.842 0.065 1.00 10.00 C ATOM 1095 O PRO A 71 2.096 10.617 1.217 1.00 10.00 O ATOM 1096 CB PRO A 71 2.560 8.681 -1.030 1.00 10.00 C ATOM 1097 CG PRO A 71 3.215 9.030 -2.369 1.00 10.00 C ATOM 1098 CD PRO A 71 2.154 9.806 -3.148 1.00 10.00 C ATOM 0 HA PRO A 71 0.541 9.187 -0.395 1.00 10.00 H new ATOM 0 HB2 PRO A 71 3.271 8.777 -0.209 1.00 10.00 H new ATOM 0 HB3 PRO A 71 2.204 7.651 -1.025 1.00 10.00 H new ATOM 0 HG2 PRO A 71 4.113 9.630 -2.223 1.00 10.00 H new ATOM 0 HG3 PRO A 71 3.517 8.130 -2.905 1.00 10.00 H new ATOM 0 HD2 PRO A 71 2.576 10.719 -3.568 1.00 10.00 H new ATOM 0 HD3 PRO A 71 1.780 9.214 -3.983 1.00 10.00 H new ATOM 1106 N LYS A 72 1.639 12.088 -0.421 1.00 10.00 N ATOM 1107 CA LYS A 72 1.875 13.314 0.327 1.00 10.00 C ATOM 1108 C LYS A 72 0.715 14.274 0.053 1.00 10.00 C ATOM 1109 O LYS A 72 0.936 15.423 -0.323 1.00 10.00 O ATOM 1110 CB LYS A 72 3.215 13.949 -0.089 1.00 10.00 C ATOM 1111 CG LYS A 72 4.428 13.043 0.143 1.00 10.00 C ATOM 1112 CD LYS A 72 4.588 11.987 -0.963 1.00 10.00 C ATOM 1113 CE LYS A 72 5.941 12.040 -1.686 1.00 10.00 C ATOM 1114 NZ LYS A 72 6.122 13.276 -2.471 1.00 10.00 N ATOM 0 H LYS A 72 1.385 12.268 -1.392 1.00 10.00 H new ATOM 0 HA LYS A 72 1.930 13.096 1.393 1.00 10.00 H new ATOM 0 HB2 LYS A 72 3.168 14.214 -1.145 1.00 10.00 H new ATOM 0 HB3 LYS A 72 3.355 14.876 0.466 1.00 10.00 H new ATOM 0 HG2 LYS A 72 5.330 13.653 0.193 1.00 10.00 H new ATOM 0 HG3 LYS A 72 4.327 12.544 1.107 1.00 10.00 H new ATOM 0 HD2 LYS A 72 4.459 10.996 -0.527 1.00 10.00 H new ATOM 0 HD3 LYS A 72 3.791 12.119 -1.695 1.00 10.00 H new ATOM 0 HE2 LYS A 72 6.743 11.960 -0.952 1.00 10.00 H new ATOM 0 HE3 LYS A 72 6.028 11.179 -2.348 1.00 10.00 H new ATOM 0 HZ1 LYS A 72 7.051 13.258 -2.937 1.00 10.00 H new ATOM 0 HZ2 LYS A 72 5.375 13.342 -3.191 1.00 10.00 H new ATOM 0 HZ3 LYS A 72 6.068 14.100 -1.839 1.00 10.00 H new ATOM 1128 N LYS A 73 -0.522 13.791 0.204 1.00 10.00 N ATOM 1129 CA LYS A 73 -1.715 14.585 -0.073 1.00 10.00 C ATOM 1130 C LYS A 73 -2.820 14.247 0.925 1.00 10.00 C ATOM 1131 O LYS A 73 -3.363 15.150 1.555 1.00 10.00 O ATOM 1132 CB LYS A 73 -2.143 14.389 -1.537 1.00 10.00 C ATOM 1133 CG LYS A 73 -2.626 15.687 -2.203 1.00 10.00 C ATOM 1134 CD LYS A 73 -4.086 15.990 -1.842 1.00 10.00 C ATOM 1135 CE LYS A 73 -4.485 17.401 -2.293 1.00 10.00 C ATOM 1136 NZ LYS A 73 -5.819 17.780 -1.780 1.00 10.00 N ATOM 0 H LYS A 73 -0.720 12.842 0.521 1.00 10.00 H new ATOM 0 HA LYS A 73 -1.496 15.645 0.056 1.00 10.00 H new ATOM 0 HB2 LYS A 73 -1.303 13.987 -2.104 1.00 10.00 H new ATOM 0 HB3 LYS A 73 -2.940 13.647 -1.580 1.00 10.00 H new ATOM 0 HG2 LYS A 73 -1.992 16.517 -1.890 1.00 10.00 H new ATOM 0 HG3 LYS A 73 -2.527 15.601 -3.285 1.00 10.00 H new ATOM 0 HD2 LYS A 73 -4.740 15.256 -2.313 1.00 10.00 H new ATOM 0 HD3 LYS A 73 -4.225 15.896 -0.765 1.00 10.00 H new ATOM 0 HE2 LYS A 73 -3.743 18.119 -1.943 1.00 10.00 H new ATOM 0 HE3 LYS A 73 -4.486 17.449 -3.382 1.00 10.00 H new ATOM 0 HZ1 LYS A 73 -6.056 18.739 -2.104 1.00 10.00 H new ATOM 0 HZ2 LYS A 73 -6.531 17.109 -2.134 1.00 10.00 H new ATOM 0 HZ3 LYS A 73 -5.810 17.758 -0.740 1.00 10.00 H new ATOM 1150 N TYR A 74 -3.135 12.955 1.084 1.00 10.00 N ATOM 1151 CA TYR A 74 -4.093 12.487 2.083 1.00 10.00 C ATOM 1152 C TYR A 74 -3.815 13.099 3.457 1.00 10.00 C ATOM 1153 O TYR A 74 -4.724 13.608 4.108 1.00 10.00 O ATOM 1154 CB TYR A 74 -4.056 10.954 2.176 1.00 10.00 C ATOM 1155 CG TYR A 74 -4.992 10.246 1.219 1.00 10.00 C ATOM 1156 CD1 TYR A 74 -6.375 10.233 1.482 1.00 10.00 C ATOM 1157 CD2 TYR A 74 -4.491 9.564 0.097 1.00 10.00 C ATOM 1158 CE1 TYR A 74 -7.244 9.483 0.670 1.00 10.00 C ATOM 1159 CE2 TYR A 74 -5.370 8.849 -0.735 1.00 10.00 C ATOM 1160 CZ TYR A 74 -6.738 8.773 -0.431 1.00 10.00 C ATOM 1161 OH TYR A 74 -7.550 7.946 -1.152 1.00 10.00 O ATOM 0 H TYR A 74 -2.730 12.207 0.521 1.00 10.00 H new ATOM 0 HA TYR A 74 -5.086 12.807 1.766 1.00 10.00 H new ATOM 0 HB2 TYR A 74 -3.038 10.615 1.986 1.00 10.00 H new ATOM 0 HB3 TYR A 74 -4.306 10.658 3.195 1.00 10.00 H new ATOM 0 HD1 TYR A 74 -6.770 10.801 2.311 1.00 10.00 H new ATOM 0 HD2 TYR A 74 -3.434 9.589 -0.125 1.00 10.00 H new ATOM 0 HE1 TYR A 74 -8.300 9.453 0.893 1.00 10.00 H new ATOM 0 HE2 TYR A 74 -4.989 8.354 -1.616 1.00 10.00 H new ATOM 0 HH TYR A 74 -7.002 7.326 -1.677 1.00 10.00 H new ATOM 1171 N ILE A 75 -2.559 13.024 3.902 1.00 10.00 N ATOM 1172 CA ILE A 75 -2.128 13.557 5.184 1.00 10.00 C ATOM 1173 C ILE A 75 -0.625 13.869 5.086 1.00 10.00 C ATOM 1174 O ILE A 75 0.180 12.949 4.936 1.00 10.00 O ATOM 1175 CB ILE A 75 -2.498 12.574 6.318 1.00 10.00 C ATOM 1176 CG1 ILE A 75 -1.935 13.012 7.688 1.00 10.00 C ATOM 1177 CG2 ILE A 75 -2.183 11.108 5.974 1.00 10.00 C ATOM 1178 CD1 ILE A 75 -3.014 13.733 8.502 1.00 10.00 C ATOM 0 H ILE A 75 -1.807 12.585 3.371 1.00 10.00 H new ATOM 0 HA ILE A 75 -2.641 14.487 5.430 1.00 10.00 H new ATOM 0 HB ILE A 75 -3.583 12.619 6.412 1.00 10.00 H new ATOM 0 HG12 ILE A 75 -1.578 12.141 8.237 1.00 10.00 H new ATOM 0 HG13 ILE A 75 -1.079 13.671 7.543 1.00 10.00 H new ATOM 0 HG21 ILE A 75 -2.466 10.469 6.811 1.00 10.00 H new ATOM 0 HG22 ILE A 75 -2.744 10.814 5.087 1.00 10.00 H new ATOM 0 HG23 ILE A 75 -1.116 11.001 5.780 1.00 10.00 H new ATOM 0 HD11 ILE A 75 -2.602 14.035 9.465 1.00 10.00 H new ATOM 0 HD12 ILE A 75 -3.351 14.615 7.958 1.00 10.00 H new ATOM 0 HD13 ILE A 75 -3.858 13.062 8.663 1.00 10.00 H new ATOM 1190 N PRO A 76 -0.210 15.146 5.139 1.00 10.00 N ATOM 1191 CA PRO A 76 1.197 15.510 5.084 1.00 10.00 C ATOM 1192 C PRO A 76 1.875 15.200 6.423 1.00 10.00 C ATOM 1193 O PRO A 76 2.185 16.098 7.201 1.00 10.00 O ATOM 1194 CB PRO A 76 1.222 16.995 4.710 1.00 10.00 C ATOM 1195 CG PRO A 76 -0.121 17.538 5.203 1.00 10.00 C ATOM 1196 CD PRO A 76 -1.058 16.328 5.192 1.00 10.00 C ATOM 0 HA PRO A 76 1.760 14.938 4.346 1.00 10.00 H new ATOM 0 HB2 PRO A 76 2.057 17.510 5.186 1.00 10.00 H new ATOM 0 HB3 PRO A 76 1.334 17.131 3.634 1.00 10.00 H new ATOM 0 HG2 PRO A 76 -0.033 17.962 6.203 1.00 10.00 H new ATOM 0 HG3 PRO A 76 -0.490 18.331 4.552 1.00 10.00 H new ATOM 0 HD2 PRO A 76 -1.685 16.315 6.084 1.00 10.00 H new ATOM 0 HD3 PRO A 76 -1.727 16.364 4.332 1.00 10.00 H new ATOM 1204 N GLY A 77 2.107 13.911 6.683 1.00 10.00 N ATOM 1205 CA GLY A 77 2.742 13.433 7.902 1.00 10.00 C ATOM 1206 C GLY A 77 2.337 11.983 8.141 1.00 10.00 C ATOM 1207 O GLY A 77 1.385 11.708 8.867 1.00 10.00 O ATOM 0 H GLY A 77 1.853 13.162 6.039 1.00 10.00 H new ATOM 0 HA2 GLY A 77 3.826 13.511 7.817 1.00 10.00 H new ATOM 0 HA3 GLY A 77 2.443 14.051 8.749 1.00 10.00 H new ATOM 1211 N THR A 78 3.025 11.042 7.490 1.00 10.00 N ATOM 1212 CA THR A 78 2.759 9.613 7.642 1.00 10.00 C ATOM 1213 C THR A 78 4.058 8.829 7.462 1.00 10.00 C ATOM 1214 O THR A 78 4.691 8.459 8.447 1.00 10.00 O ATOM 1215 CB THR A 78 1.633 9.195 6.675 1.00 10.00 C ATOM 1216 OG1 THR A 78 0.427 9.808 7.074 1.00 10.00 O ATOM 1217 CG2 THR A 78 1.372 7.685 6.621 1.00 10.00 C ATOM 0 H THR A 78 3.784 11.252 6.841 1.00 10.00 H new ATOM 0 HA THR A 78 2.402 9.384 8.646 1.00 10.00 H new ATOM 0 HB THR A 78 1.966 9.510 5.686 1.00 10.00 H new ATOM 0 HG1 THR A 78 0.600 10.413 7.825 1.00 10.00 H new ATOM 0 HG21 THR A 78 0.565 7.480 5.917 1.00 10.00 H new ATOM 0 HG22 THR A 78 2.277 7.171 6.296 1.00 10.00 H new ATOM 0 HG23 THR A 78 1.088 7.329 7.611 1.00 10.00 H new ATOM 1225 N LYS A 79 4.458 8.582 6.212 1.00 10.00 N ATOM 1226 CA LYS A 79 5.664 7.853 5.875 1.00 10.00 C ATOM 1227 C LYS A 79 6.475 8.717 4.922 1.00 10.00 C ATOM 1228 O LYS A 79 7.543 9.185 5.302 1.00 10.00 O ATOM 1229 CB LYS A 79 5.266 6.494 5.285 1.00 10.00 C ATOM 1230 CG LYS A 79 6.420 5.785 4.558 1.00 10.00 C ATOM 1231 CD LYS A 79 6.455 4.302 4.948 1.00 10.00 C ATOM 1232 CE LYS A 79 7.053 4.155 6.359 1.00 10.00 C ATOM 1233 NZ LYS A 79 8.498 3.854 6.334 1.00 10.00 N ATOM 0 H LYS A 79 3.934 8.894 5.394 1.00 10.00 H new ATOM 0 HA LYS A 79 6.288 7.646 6.745 1.00 10.00 H new ATOM 0 HB2 LYS A 79 4.901 5.851 6.086 1.00 10.00 H new ATOM 0 HB3 LYS A 79 4.440 6.636 4.588 1.00 10.00 H new ATOM 0 HG2 LYS A 79 6.296 5.883 3.480 1.00 10.00 H new ATOM 0 HG3 LYS A 79 7.368 6.259 4.814 1.00 10.00 H new ATOM 0 HD2 LYS A 79 5.448 3.885 4.923 1.00 10.00 H new ATOM 0 HD3 LYS A 79 7.051 3.740 4.229 1.00 10.00 H new ATOM 0 HE2 LYS A 79 6.887 5.076 6.918 1.00 10.00 H new ATOM 0 HE3 LYS A 79 6.529 3.361 6.891 1.00 10.00 H new ATOM 0 HZ1 LYS A 79 8.816 3.599 7.291 1.00 10.00 H new ATOM 0 HZ2 LYS A 79 8.676 3.060 5.686 1.00 10.00 H new ATOM 0 HZ3 LYS A 79 9.021 4.691 6.007 1.00 10.00 H new ATOM 1247 N MET A 80 5.951 8.907 3.703 1.00 10.00 N ATOM 1248 CA MET A 80 6.635 9.547 2.586 1.00 10.00 C ATOM 1249 C MET A 80 7.796 8.651 2.107 1.00 10.00 C ATOM 1250 O MET A 80 8.525 8.068 2.904 1.00 10.00 O ATOM 1251 CB MET A 80 7.048 10.992 2.948 1.00 10.00 C ATOM 1252 CG MET A 80 7.669 11.760 1.775 1.00 10.00 C ATOM 1253 SD MET A 80 8.856 13.065 2.189 1.00 10.00 S ATOM 1254 CE MET A 80 7.769 14.465 2.528 1.00 10.00 C ATOM 0 H MET A 80 5.006 8.606 3.466 1.00 10.00 H new ATOM 0 HA MET A 80 5.958 9.652 1.738 1.00 10.00 H new ATOM 0 HB2 MET A 80 6.172 11.534 3.304 1.00 10.00 H new ATOM 0 HB3 MET A 80 7.761 10.963 3.772 1.00 10.00 H new ATOM 0 HG2 MET A 80 8.168 11.041 1.124 1.00 10.00 H new ATOM 0 HG3 MET A 80 6.861 12.207 1.196 1.00 10.00 H new ATOM 0 HE1 MET A 80 8.369 15.335 2.795 1.00 10.00 H new ATOM 0 HE2 MET A 80 7.178 14.690 1.640 1.00 10.00 H new ATOM 0 HE3 MET A 80 7.102 14.216 3.354 1.00 10.00 H new ATOM 1264 N ILE A 81 7.943 8.500 0.786 1.00 10.00 N ATOM 1265 CA ILE A 81 9.069 7.790 0.184 1.00 10.00 C ATOM 1266 C ILE A 81 9.403 8.404 -1.183 1.00 10.00 C ATOM 1267 O ILE A 81 10.491 8.942 -1.359 1.00 10.00 O ATOM 1268 CB ILE A 81 8.842 6.259 0.155 1.00 10.00 C ATOM 1269 CG1 ILE A 81 10.028 5.576 -0.542 1.00 10.00 C ATOM 1270 CG2 ILE A 81 7.490 5.863 -0.473 1.00 10.00 C ATOM 1271 CD1 ILE A 81 9.828 4.064 -0.610 1.00 10.00 C ATOM 0 H ILE A 81 7.280 8.870 0.105 1.00 10.00 H new ATOM 0 HA ILE A 81 9.951 7.920 0.811 1.00 10.00 H new ATOM 0 HB ILE A 81 8.790 5.907 1.185 1.00 10.00 H new ATOM 0 HG12 ILE A 81 10.142 5.977 -1.549 1.00 10.00 H new ATOM 0 HG13 ILE A 81 10.949 5.800 -0.004 1.00 10.00 H new ATOM 0 HG21 ILE A 81 7.389 4.778 -0.465 1.00 10.00 H new ATOM 0 HG22 ILE A 81 6.678 6.307 0.102 1.00 10.00 H new ATOM 0 HG23 ILE A 81 7.447 6.224 -1.501 1.00 10.00 H new ATOM 0 HD11 ILE A 81 10.682 3.606 -1.108 1.00 10.00 H new ATOM 0 HD12 ILE A 81 9.739 3.663 0.400 1.00 10.00 H new ATOM 0 HD13 ILE A 81 8.920 3.842 -1.170 1.00 10.00 H new ATOM 1283 N PHE A 82 8.481 8.346 -2.151 1.00 10.00 N ATOM 1284 CA PHE A 82 8.692 8.844 -3.507 1.00 10.00 C ATOM 1285 C PHE A 82 7.378 9.421 -4.035 1.00 10.00 C ATOM 1286 O PHE A 82 6.324 9.135 -3.472 1.00 10.00 O ATOM 1287 CB PHE A 82 9.237 7.720 -4.409 1.00 10.00 C ATOM 1288 CG PHE A 82 8.347 6.490 -4.541 1.00 10.00 C ATOM 1289 CD1 PHE A 82 7.120 6.574 -5.222 1.00 10.00 C ATOM 1290 CD2 PHE A 82 8.751 5.250 -4.012 1.00 10.00 C ATOM 1291 CE1 PHE A 82 6.217 5.500 -5.195 1.00 10.00 C ATOM 1292 CE2 PHE A 82 7.866 4.156 -4.023 1.00 10.00 C ATOM 1293 CZ PHE A 82 6.581 4.297 -4.574 1.00 10.00 C ATOM 0 H PHE A 82 7.554 7.945 -2.008 1.00 10.00 H new ATOM 0 HA PHE A 82 9.438 9.639 -3.505 1.00 10.00 H new ATOM 0 HB2 PHE A 82 9.410 8.129 -5.404 1.00 10.00 H new ATOM 0 HB3 PHE A 82 10.206 7.405 -4.021 1.00 10.00 H new ATOM 0 HD1 PHE A 82 6.871 7.471 -5.770 1.00 10.00 H new ATOM 0 HD2 PHE A 82 9.742 5.138 -3.597 1.00 10.00 H new ATOM 0 HE1 PHE A 82 5.243 5.600 -5.652 1.00 10.00 H new ATOM 0 HE2 PHE A 82 8.174 3.208 -3.608 1.00 10.00 H new ATOM 0 HZ PHE A 82 5.876 3.481 -4.519 1.00 10.00 H new ATOM 1303 N ALA A 83 7.448 10.237 -5.096 1.00 10.00 N ATOM 1304 CA ALA A 83 6.309 10.898 -5.733 1.00 10.00 C ATOM 1305 C ALA A 83 5.136 9.949 -5.986 1.00 10.00 C ATOM 1306 O ALA A 83 4.102 10.064 -5.339 1.00 10.00 O ATOM 1307 CB ALA A 83 6.764 11.562 -7.039 1.00 10.00 C ATOM 0 H ALA A 83 8.334 10.461 -5.548 1.00 10.00 H new ATOM 0 HA ALA A 83 5.943 11.658 -5.042 1.00 10.00 H new ATOM 0 HB1 ALA A 83 5.914 12.054 -7.512 1.00 10.00 H new ATOM 0 HB2 ALA A 83 7.536 12.300 -6.822 1.00 10.00 H new ATOM 0 HB3 ALA A 83 7.165 10.804 -7.712 1.00 10.00 H new ATOM 1313 N GLY A 84 5.283 9.034 -6.941 1.00 10.00 N ATOM 1314 CA GLY A 84 4.285 8.027 -7.239 1.00 10.00 C ATOM 1315 C GLY A 84 4.926 6.987 -8.145 1.00 10.00 C ATOM 1316 O GLY A 84 6.117 7.086 -8.431 1.00 10.00 O ATOM 0 H GLY A 84 6.111 8.976 -7.533 1.00 10.00 H new ATOM 0 HA2 GLY A 84 3.925 7.563 -6.321 1.00 10.00 H new ATOM 0 HA3 GLY A 84 3.422 8.478 -7.728 1.00 10.00 H new ATOM 1320 N ILE A 85 4.145 5.995 -8.581 1.00 10.00 N ATOM 1321 CA ILE A 85 4.619 4.905 -9.418 1.00 10.00 C ATOM 1322 C ILE A 85 5.212 5.433 -10.721 1.00 10.00 C ATOM 1323 O ILE A 85 6.434 5.531 -10.830 1.00 10.00 O ATOM 1324 CB ILE A 85 3.488 3.870 -9.597 1.00 10.00 C ATOM 1325 CG1 ILE A 85 3.280 3.091 -8.311 1.00 10.00 C ATOM 1326 CG2 ILE A 85 3.649 2.897 -10.777 1.00 10.00 C ATOM 1327 CD1 ILE A 85 4.552 2.393 -7.865 1.00 10.00 C ATOM 0 H ILE A 85 3.152 5.931 -8.356 1.00 10.00 H new ATOM 0 HA ILE A 85 5.443 4.382 -8.933 1.00 10.00 H new ATOM 0 HB ILE A 85 2.609 4.466 -9.843 1.00 10.00 H new ATOM 0 HG12 ILE A 85 2.942 3.768 -7.526 1.00 10.00 H new ATOM 0 HG13 ILE A 85 2.492 2.353 -8.456 1.00 10.00 H new ATOM 0 HG21 ILE A 85 2.798 2.216 -10.806 1.00 10.00 H new ATOM 0 HG22 ILE A 85 3.695 3.460 -11.709 1.00 10.00 H new ATOM 0 HG23 ILE A 85 4.568 2.324 -10.653 1.00 10.00 H new ATOM 0 HD11 ILE A 85 4.362 1.846 -6.941 1.00 10.00 H new ATOM 0 HD12 ILE A 85 4.875 1.697 -8.639 1.00 10.00 H new ATOM 0 HD13 ILE A 85 5.333 3.134 -7.694 1.00 10.00 H new ATOM 1339 N LYS A 86 4.360 5.700 -11.716 1.00 10.00 N ATOM 1340 CA LYS A 86 4.713 6.284 -13.005 1.00 10.00 C ATOM 1341 C LYS A 86 3.569 7.156 -13.534 1.00 10.00 C ATOM 1342 O LYS A 86 3.786 8.319 -13.853 1.00 10.00 O ATOM 1343 CB LYS A 86 5.093 5.198 -14.024 1.00 10.00 C ATOM 1344 CG LYS A 86 6.126 4.229 -13.446 1.00 10.00 C ATOM 1345 CD LYS A 86 6.824 3.403 -14.529 1.00 10.00 C ATOM 1346 CE LYS A 86 8.335 3.650 -14.647 1.00 10.00 C ATOM 1347 NZ LYS A 86 8.654 5.038 -15.041 1.00 10.00 N ATOM 0 H LYS A 86 3.362 5.505 -11.637 1.00 10.00 H new ATOM 0 HA LYS A 86 5.587 6.919 -12.858 1.00 10.00 H new ATOM 0 HB2 LYS A 86 4.201 4.647 -14.321 1.00 10.00 H new ATOM 0 HB3 LYS A 86 5.493 5.665 -14.924 1.00 10.00 H new ATOM 0 HG2 LYS A 86 6.872 4.791 -12.884 1.00 10.00 H new ATOM 0 HG3 LYS A 86 5.635 3.558 -12.741 1.00 10.00 H new ATOM 0 HD2 LYS A 86 6.657 2.345 -14.325 1.00 10.00 H new ATOM 0 HD3 LYS A 86 6.358 3.620 -15.490 1.00 10.00 H new ATOM 0 HE2 LYS A 86 8.811 3.429 -13.692 1.00 10.00 H new ATOM 0 HE3 LYS A 86 8.756 2.962 -15.380 1.00 10.00 H new ATOM 0 HZ1 LYS A 86 9.686 5.152 -15.106 1.00 10.00 H new ATOM 0 HZ2 LYS A 86 8.224 5.244 -15.965 1.00 10.00 H new ATOM 0 HZ3 LYS A 86 8.278 5.696 -14.329 1.00 10.00 H new ATOM 1361 N LYS A 87 2.361 6.591 -13.651 1.00 10.00 N ATOM 1362 CA LYS A 87 1.189 7.297 -14.163 1.00 10.00 C ATOM 1363 C LYS A 87 -0.086 6.604 -13.683 1.00 10.00 C ATOM 1364 O LYS A 87 -0.286 6.503 -12.475 1.00 10.00 O ATOM 1365 CB LYS A 87 1.278 7.436 -15.690 1.00 10.00 C ATOM 1366 CG LYS A 87 1.483 6.098 -16.425 1.00 10.00 C ATOM 1367 CD LYS A 87 2.850 6.028 -17.105 1.00 10.00 C ATOM 1368 CE LYS A 87 2.991 7.143 -18.157 1.00 10.00 C ATOM 1369 NZ LYS A 87 3.691 6.690 -19.376 1.00 10.00 N ATOM 0 H LYS A 87 2.172 5.623 -13.390 1.00 10.00 H new ATOM 0 HA LYS A 87 1.158 8.312 -13.767 1.00 10.00 H new ATOM 0 HB2 LYS A 87 0.365 7.905 -16.057 1.00 10.00 H new ATOM 0 HB3 LYS A 87 2.102 8.106 -15.937 1.00 10.00 H new ATOM 0 HG2 LYS A 87 1.387 5.275 -15.716 1.00 10.00 H new ATOM 0 HG3 LYS A 87 0.699 5.969 -17.171 1.00 10.00 H new ATOM 0 HD2 LYS A 87 3.639 6.123 -16.359 1.00 10.00 H new ATOM 0 HD3 LYS A 87 2.976 5.055 -17.580 1.00 10.00 H new ATOM 0 HE2 LYS A 87 2.001 7.510 -18.427 1.00 10.00 H new ATOM 0 HE3 LYS A 87 3.534 7.982 -17.721 1.00 10.00 H new ATOM 0 HZ1 LYS A 87 3.759 7.479 -20.051 1.00 10.00 H new ATOM 0 HZ2 LYS A 87 4.647 6.364 -19.127 1.00 10.00 H new ATOM 0 HZ3 LYS A 87 3.161 5.908 -19.810 1.00 10.00 H new ATOM 1383 N LYS A 88 -0.911 6.105 -14.609 1.00 10.00 N ATOM 1384 CA LYS A 88 -2.072 5.272 -14.335 1.00 10.00 C ATOM 1385 C LYS A 88 -1.752 3.815 -14.678 1.00 10.00 C ATOM 1386 O LYS A 88 -2.077 2.928 -13.902 1.00 10.00 O ATOM 1387 CB LYS A 88 -3.313 5.819 -15.063 1.00 10.00 C ATOM 1388 CG LYS A 88 -3.327 5.681 -16.595 1.00 10.00 C ATOM 1389 CD LYS A 88 -4.564 6.393 -17.180 1.00 10.00 C ATOM 1390 CE LYS A 88 -4.346 6.876 -18.629 1.00 10.00 C ATOM 1391 NZ LYS A 88 -5.136 6.120 -19.623 1.00 10.00 N ATOM 0 H LYS A 88 -0.778 6.280 -15.605 1.00 10.00 H new ATOM 0 HA LYS A 88 -2.313 5.301 -13.272 1.00 10.00 H new ATOM 0 HB2 LYS A 88 -4.192 5.311 -14.667 1.00 10.00 H new ATOM 0 HB3 LYS A 88 -3.416 6.875 -14.815 1.00 10.00 H new ATOM 0 HG2 LYS A 88 -2.418 6.111 -17.015 1.00 10.00 H new ATOM 0 HG3 LYS A 88 -3.339 4.627 -16.873 1.00 10.00 H new ATOM 0 HD2 LYS A 88 -5.416 5.713 -17.153 1.00 10.00 H new ATOM 0 HD3 LYS A 88 -4.817 7.247 -16.551 1.00 10.00 H new ATOM 0 HE2 LYS A 88 -4.607 7.932 -18.695 1.00 10.00 H new ATOM 0 HE3 LYS A 88 -3.288 6.793 -18.877 1.00 10.00 H new ATOM 0 HZ1 LYS A 88 -4.945 6.493 -20.575 1.00 10.00 H new ATOM 0 HZ2 LYS A 88 -4.871 5.115 -19.585 1.00 10.00 H new ATOM 0 HZ3 LYS A 88 -6.149 6.219 -19.409 1.00 10.00 H new ATOM 1405 N THR A 89 -1.086 3.572 -15.813 1.00 10.00 N ATOM 1406 CA THR A 89 -0.901 2.250 -16.390 1.00 10.00 C ATOM 1407 C THR A 89 -0.193 1.327 -15.402 1.00 10.00 C ATOM 1408 O THR A 89 -0.805 0.420 -14.842 1.00 10.00 O ATOM 1409 CB THR A 89 -0.127 2.407 -17.709 1.00 10.00 C ATOM 1410 OG1 THR A 89 -0.707 3.467 -18.451 1.00 10.00 O ATOM 1411 CG2 THR A 89 -0.129 1.110 -18.523 1.00 10.00 C ATOM 0 H THR A 89 -0.653 4.313 -16.364 1.00 10.00 H new ATOM 0 HA THR A 89 -1.863 1.785 -16.603 1.00 10.00 H new ATOM 0 HB THR A 89 0.915 2.637 -17.485 1.00 10.00 H new ATOM 0 HG1 THR A 89 -0.222 3.579 -19.295 1.00 10.00 H new ATOM 0 HG21 THR A 89 0.428 1.260 -19.448 1.00 10.00 H new ATOM 0 HG22 THR A 89 0.340 0.315 -17.942 1.00 10.00 H new ATOM 0 HG23 THR A 89 -1.156 0.830 -18.759 1.00 10.00 H new ATOM 1419 N GLU A 90 1.089 1.587 -15.145 1.00 10.00 N ATOM 1420 CA GLU A 90 1.855 0.810 -14.195 1.00 10.00 C ATOM 1421 C GLU A 90 1.166 0.700 -12.839 1.00 10.00 C ATOM 1422 O GLU A 90 1.136 -0.369 -12.242 1.00 10.00 O ATOM 1423 CB GLU A 90 3.202 1.496 -14.008 1.00 10.00 C ATOM 1424 CG GLU A 90 4.257 0.923 -14.968 1.00 10.00 C ATOM 1425 CD GLU A 90 4.503 1.797 -16.189 1.00 10.00 C ATOM 1426 OE1 GLU A 90 3.628 2.643 -16.491 1.00 10.00 O ATOM 1427 OE2 GLU A 90 5.606 1.641 -16.757 1.00 10.00 O ATOM 0 H GLU A 90 1.615 2.339 -15.591 1.00 10.00 H new ATOM 0 HA GLU A 90 1.962 -0.201 -14.588 1.00 10.00 H new ATOM 0 HB2 GLU A 90 3.094 2.567 -14.180 1.00 10.00 H new ATOM 0 HB3 GLU A 90 3.537 1.370 -12.978 1.00 10.00 H new ATOM 0 HG2 GLU A 90 5.195 0.793 -14.429 1.00 10.00 H new ATOM 0 HG3 GLU A 90 3.939 -0.066 -15.297 1.00 10.00 H new ATOM 1434 N ARG A 91 0.670 1.824 -12.323 1.00 10.00 N ATOM 1435 CA ARG A 91 -0.006 1.858 -11.036 1.00 10.00 C ATOM 1436 C ARG A 91 -1.159 0.844 -11.038 1.00 10.00 C ATOM 1437 O ARG A 91 -1.319 0.066 -10.099 1.00 10.00 O ATOM 1438 CB ARG A 91 -0.485 3.292 -10.791 1.00 10.00 C ATOM 1439 CG ARG A 91 -0.907 3.546 -9.338 1.00 10.00 C ATOM 1440 CD ARG A 91 -1.534 4.944 -9.226 1.00 10.00 C ATOM 1441 NE ARG A 91 -0.742 5.960 -9.936 1.00 10.00 N ATOM 1442 CZ ARG A 91 0.382 6.536 -9.499 1.00 10.00 C ATOM 1443 NH1 ARG A 91 0.904 6.128 -8.348 1.00 10.00 N ATOM 1444 NH2 ARG A 91 0.980 7.477 -10.232 1.00 10.00 N ATOM 0 H ARG A 91 0.727 2.731 -12.787 1.00 10.00 H new ATOM 0 HA ARG A 91 0.664 1.576 -10.224 1.00 10.00 H new ATOM 0 HB2 ARG A 91 0.312 3.986 -11.058 1.00 10.00 H new ATOM 0 HB3 ARG A 91 -1.327 3.505 -11.450 1.00 10.00 H new ATOM 0 HG2 ARG A 91 -1.622 2.788 -9.017 1.00 10.00 H new ATOM 0 HG3 ARG A 91 -0.043 3.469 -8.678 1.00 10.00 H new ATOM 0 HD2 ARG A 91 -2.545 4.922 -9.633 1.00 10.00 H new ATOM 0 HD3 ARG A 91 -1.620 5.220 -8.175 1.00 10.00 H new ATOM 0 HE ARG A 91 -1.084 6.254 -10.851 1.00 10.00 H new ATOM 0 HH11 ARG A 91 0.448 5.388 -7.815 1.00 10.00 H new ATOM 0 HH12 ARG A 91 1.761 6.555 -7.997 1.00 10.00 H new ATOM 0 HH21 ARG A 91 0.579 7.758 -11.127 1.00 10.00 H new ATOM 0 HH22 ARG A 91 1.838 7.916 -9.897 1.00 10.00 H new ATOM 1458 N GLU A 92 -1.939 0.838 -12.118 1.00 10.00 N ATOM 1459 CA GLU A 92 -3.087 -0.032 -12.288 1.00 10.00 C ATOM 1460 C GLU A 92 -2.635 -1.490 -12.379 1.00 10.00 C ATOM 1461 O GLU A 92 -3.157 -2.343 -11.661 1.00 10.00 O ATOM 1462 CB GLU A 92 -3.900 0.428 -13.505 1.00 10.00 C ATOM 1463 CG GLU A 92 -4.948 -0.612 -13.904 1.00 10.00 C ATOM 1464 CD GLU A 92 -6.161 0.034 -14.551 1.00 10.00 C ATOM 1465 OE1 GLU A 92 -7.074 0.401 -13.785 1.00 10.00 O ATOM 1466 OE2 GLU A 92 -6.152 0.137 -15.796 1.00 10.00 O ATOM 0 H GLU A 92 -1.781 1.455 -12.914 1.00 10.00 H new ATOM 0 HA GLU A 92 -3.744 0.031 -11.421 1.00 10.00 H new ATOM 0 HB2 GLU A 92 -4.392 1.374 -13.279 1.00 10.00 H new ATOM 0 HB3 GLU A 92 -3.229 0.611 -14.344 1.00 10.00 H new ATOM 0 HG2 GLU A 92 -4.505 -1.329 -14.595 1.00 10.00 H new ATOM 0 HG3 GLU A 92 -5.260 -1.171 -13.022 1.00 10.00 H new ATOM 1473 N ASP A 93 -1.655 -1.786 -13.237 1.00 10.00 N ATOM 1474 CA ASP A 93 -1.036 -3.109 -13.312 1.00 10.00 C ATOM 1475 C ASP A 93 -0.653 -3.572 -11.898 1.00 10.00 C ATOM 1476 O ASP A 93 -0.954 -4.694 -11.491 1.00 10.00 O ATOM 1477 CB ASP A 93 0.211 -3.058 -14.210 1.00 10.00 C ATOM 1478 CG ASP A 93 -0.083 -2.995 -15.703 1.00 10.00 C ATOM 1479 OD1 ASP A 93 -1.280 -3.046 -16.070 1.00 10.00 O ATOM 1480 OD2 ASP A 93 0.910 -2.914 -16.457 1.00 10.00 O ATOM 0 H ASP A 93 -1.269 -1.113 -13.899 1.00 10.00 H new ATOM 0 HA ASP A 93 -1.744 -3.817 -13.743 1.00 10.00 H new ATOM 0 HB2 ASP A 93 0.806 -2.188 -13.933 1.00 10.00 H new ATOM 0 HB3 ASP A 93 0.822 -3.938 -14.011 1.00 10.00 H new ATOM 1485 N LEU A 94 -0.024 -2.678 -11.128 1.00 10.00 N ATOM 1486 CA LEU A 94 0.333 -2.908 -9.734 1.00 10.00 C ATOM 1487 C LEU A 94 -0.874 -3.405 -8.936 1.00 10.00 C ATOM 1488 O LEU A 94 -0.818 -4.492 -8.358 1.00 10.00 O ATOM 1489 CB LEU A 94 0.933 -1.635 -9.114 1.00 10.00 C ATOM 1490 CG LEU A 94 2.183 -1.931 -8.287 1.00 10.00 C ATOM 1491 CD1 LEU A 94 2.844 -0.615 -7.890 1.00 10.00 C ATOM 1492 CD2 LEU A 94 1.859 -2.710 -7.025 1.00 10.00 C ATOM 0 H LEU A 94 0.254 -1.758 -11.468 1.00 10.00 H new ATOM 0 HA LEU A 94 1.093 -3.688 -9.696 1.00 10.00 H new ATOM 0 HB2 LEU A 94 1.182 -0.929 -9.907 1.00 10.00 H new ATOM 0 HB3 LEU A 94 0.187 -1.154 -8.482 1.00 10.00 H new ATOM 0 HG LEU A 94 2.850 -2.537 -8.900 1.00 10.00 H new ATOM 0 HD11 LEU A 94 3.737 -0.820 -7.299 1.00 10.00 H new ATOM 0 HD12 LEU A 94 3.122 -0.062 -8.787 1.00 10.00 H new ATOM 0 HD13 LEU A 94 2.147 -0.021 -7.299 1.00 10.00 H new ATOM 0 HD21 LEU A 94 2.777 -2.898 -6.468 1.00 10.00 H new ATOM 0 HD22 LEU A 94 1.172 -2.132 -6.407 1.00 10.00 H new ATOM 0 HD23 LEU A 94 1.396 -3.660 -7.292 1.00 10.00 H new ATOM 1504 N ILE A 95 -1.968 -2.627 -8.920 1.00 10.00 N ATOM 1505 CA ILE A 95 -3.225 -3.067 -8.323 1.00 10.00 C ATOM 1506 C ILE A 95 -3.608 -4.446 -8.843 1.00 10.00 C ATOM 1507 O ILE A 95 -4.046 -5.279 -8.063 1.00 10.00 O ATOM 1508 CB ILE A 95 -4.366 -2.055 -8.557 1.00 10.00 C ATOM 1509 CG1 ILE A 95 -4.377 -0.979 -7.466 1.00 10.00 C ATOM 1510 CG2 ILE A 95 -5.754 -2.726 -8.556 1.00 10.00 C ATOM 1511 CD1 ILE A 95 -3.265 0.057 -7.595 1.00 10.00 C ATOM 0 H ILE A 95 -2.000 -1.688 -9.317 1.00 10.00 H new ATOM 0 HA ILE A 95 -3.070 -3.129 -7.246 1.00 10.00 H new ATOM 0 HB ILE A 95 -4.176 -1.615 -9.536 1.00 10.00 H new ATOM 0 HG12 ILE A 95 -5.339 -0.467 -7.487 1.00 10.00 H new ATOM 0 HG13 ILE A 95 -4.295 -1.464 -6.493 1.00 10.00 H new ATOM 0 HG21 ILE A 95 -6.523 -1.972 -8.724 1.00 10.00 H new ATOM 0 HG22 ILE A 95 -5.798 -3.472 -9.349 1.00 10.00 H new ATOM 0 HG23 ILE A 95 -5.924 -3.209 -7.594 1.00 10.00 H new ATOM 0 HD11 ILE A 95 -3.346 0.781 -6.784 1.00 10.00 H new ATOM 0 HD12 ILE A 95 -2.296 -0.440 -7.542 1.00 10.00 H new ATOM 0 HD13 ILE A 95 -3.357 0.572 -8.551 1.00 10.00 H new ATOM 1523 N ALA A 96 -3.513 -4.680 -10.148 1.00 10.00 N ATOM 1524 CA ALA A 96 -3.921 -5.943 -10.748 1.00 10.00 C ATOM 1525 C ALA A 96 -3.254 -7.121 -10.059 1.00 10.00 C ATOM 1526 O ALA A 96 -3.926 -8.075 -9.668 1.00 10.00 O ATOM 1527 CB ALA A 96 -3.579 -5.970 -12.228 1.00 10.00 C ATOM 0 H ALA A 96 -3.152 -4.000 -10.817 1.00 10.00 H new ATOM 0 HA ALA A 96 -5.001 -6.027 -10.624 1.00 10.00 H new ATOM 0 HB1 ALA A 96 -3.892 -6.922 -12.656 1.00 10.00 H new ATOM 0 HB2 ALA A 96 -4.096 -5.156 -12.736 1.00 10.00 H new ATOM 0 HB3 ALA A 96 -2.503 -5.851 -12.355 1.00 10.00 H new ATOM 1533 N TYR A 97 -1.930 -7.045 -9.911 1.00 10.00 N ATOM 1534 CA TYR A 97 -1.228 -8.040 -9.126 1.00 10.00 C ATOM 1535 C TYR A 97 -1.780 -8.042 -7.716 1.00 10.00 C ATOM 1536 O TYR A 97 -2.322 -9.054 -7.281 1.00 10.00 O ATOM 1537 CB TYR A 97 0.274 -7.791 -9.117 1.00 10.00 C ATOM 1538 CG TYR A 97 1.036 -8.681 -8.148 1.00 10.00 C ATOM 1539 CD1 TYR A 97 0.994 -10.083 -8.282 1.00 10.00 C ATOM 1540 CD2 TYR A 97 1.759 -8.108 -7.085 1.00 10.00 C ATOM 1541 CE1 TYR A 97 1.687 -10.904 -7.370 1.00 10.00 C ATOM 1542 CE2 TYR A 97 2.504 -8.927 -6.218 1.00 10.00 C ATOM 1543 CZ TYR A 97 2.460 -10.325 -6.348 1.00 10.00 C ATOM 1544 OH TYR A 97 3.195 -11.098 -5.495 1.00 10.00 O ATOM 0 H TYR A 97 -1.340 -6.319 -10.318 1.00 10.00 H new ATOM 0 HA TYR A 97 -1.386 -9.018 -9.581 1.00 10.00 H new ATOM 0 HB2 TYR A 97 0.665 -7.946 -10.123 1.00 10.00 H new ATOM 0 HB3 TYR A 97 0.459 -6.748 -8.860 1.00 10.00 H new ATOM 0 HD1 TYR A 97 0.429 -10.530 -9.086 1.00 10.00 H new ATOM 0 HD2 TYR A 97 1.742 -7.039 -6.935 1.00 10.00 H new ATOM 0 HE1 TYR A 97 1.624 -11.979 -7.456 1.00 10.00 H new ATOM 0 HE2 TYR A 97 3.114 -8.478 -5.448 1.00 10.00 H new ATOM 0 HH TYR A 97 3.665 -10.523 -4.855 1.00 10.00 H new ATOM 1554 N LEU A 98 -1.632 -6.912 -7.022 1.00 10.00 N ATOM 1555 CA LEU A 98 -2.051 -6.750 -5.638 1.00 10.00 C ATOM 1556 C LEU A 98 -3.391 -7.441 -5.354 1.00 10.00 C ATOM 1557 O LEU A 98 -3.449 -8.268 -4.457 1.00 10.00 O ATOM 1558 CB LEU A 98 -2.036 -5.270 -5.221 1.00 10.00 C ATOM 1559 CG LEU A 98 -0.946 -4.943 -4.176 1.00 10.00 C ATOM 1560 CD1 LEU A 98 0.095 -3.996 -4.748 1.00 10.00 C ATOM 1561 CD2 LEU A 98 -1.539 -4.272 -2.943 1.00 10.00 C ATOM 0 H LEU A 98 -1.210 -6.072 -7.417 1.00 10.00 H new ATOM 0 HA LEU A 98 -1.320 -7.259 -5.010 1.00 10.00 H new ATOM 0 HB2 LEU A 98 -1.880 -4.652 -6.105 1.00 10.00 H new ATOM 0 HB3 LEU A 98 -3.012 -5.004 -4.814 1.00 10.00 H new ATOM 0 HG LEU A 98 -0.489 -5.894 -3.904 1.00 10.00 H new ATOM 0 HD11 LEU A 98 0.849 -3.784 -3.990 1.00 10.00 H new ATOM 0 HD12 LEU A 98 0.570 -4.458 -5.614 1.00 10.00 H new ATOM 0 HD13 LEU A 98 -0.386 -3.066 -5.051 1.00 10.00 H new ATOM 0 HD21 LEU A 98 -0.744 -4.056 -2.229 1.00 10.00 H new ATOM 0 HD22 LEU A 98 -2.028 -3.342 -3.234 1.00 10.00 H new ATOM 0 HD23 LEU A 98 -2.270 -4.937 -2.483 1.00 10.00 H new ATOM 1573 N LYS A 99 -4.447 -7.168 -6.120 1.00 10.00 N ATOM 1574 CA LYS A 99 -5.750 -7.806 -5.974 1.00 10.00 C ATOM 1575 C LYS A 99 -5.633 -9.309 -5.747 1.00 10.00 C ATOM 1576 O LYS A 99 -6.181 -9.820 -4.773 1.00 10.00 O ATOM 1577 CB LYS A 99 -6.627 -7.558 -7.208 1.00 10.00 C ATOM 1578 CG LYS A 99 -7.286 -6.180 -7.161 1.00 10.00 C ATOM 1579 CD LYS A 99 -8.443 -6.120 -8.168 1.00 10.00 C ATOM 1580 CE LYS A 99 -9.188 -4.788 -8.016 1.00 10.00 C ATOM 1581 NZ LYS A 99 -10.049 -4.472 -9.173 1.00 10.00 N ATOM 0 H LYS A 99 -4.417 -6.482 -6.875 1.00 10.00 H new ATOM 0 HA LYS A 99 -6.213 -7.357 -5.096 1.00 10.00 H new ATOM 0 HB2 LYS A 99 -6.020 -7.641 -8.109 1.00 10.00 H new ATOM 0 HB3 LYS A 99 -7.396 -8.328 -7.269 1.00 10.00 H new ATOM 0 HG2 LYS A 99 -7.656 -5.978 -6.156 1.00 10.00 H new ATOM 0 HG3 LYS A 99 -6.552 -5.408 -7.391 1.00 10.00 H new ATOM 0 HD2 LYS A 99 -8.060 -6.220 -9.184 1.00 10.00 H new ATOM 0 HD3 LYS A 99 -9.127 -6.952 -8.001 1.00 10.00 H new ATOM 0 HE2 LYS A 99 -9.799 -4.821 -7.114 1.00 10.00 H new ATOM 0 HE3 LYS A 99 -8.462 -3.986 -7.880 1.00 10.00 H new ATOM 0 HZ1 LYS A 99 -10.602 -3.615 -8.970 1.00 10.00 H new ATOM 0 HZ2 LYS A 99 -9.457 -4.311 -10.013 1.00 10.00 H new ATOM 0 HZ3 LYS A 99 -10.695 -5.267 -9.352 1.00 10.00 H new ATOM 1595 N LYS A 100 -4.937 -10.022 -6.635 1.00 10.00 N ATOM 1596 CA LYS A 100 -4.694 -11.424 -6.421 1.00 10.00 C ATOM 1597 C LYS A 100 -3.760 -11.545 -5.218 1.00 10.00 C ATOM 1598 O LYS A 100 -4.153 -12.104 -4.212 1.00 10.00 O ATOM 1599 CB LYS A 100 -4.152 -12.037 -7.717 1.00 10.00 C ATOM 1600 CG LYS A 100 -3.773 -13.509 -7.539 1.00 10.00 C ATOM 1601 CD LYS A 100 -4.611 -14.480 -8.385 1.00 10.00 C ATOM 1602 CE LYS A 100 -6.028 -14.687 -7.829 1.00 10.00 C ATOM 1603 NZ LYS A 100 -6.034 -15.511 -6.596 1.00 10.00 N ATOM 0 H LYS A 100 -4.541 -9.644 -7.496 1.00 10.00 H new ATOM 0 HA LYS A 100 -5.598 -11.986 -6.186 1.00 10.00 H new ATOM 0 HB2 LYS A 100 -4.903 -11.948 -8.502 1.00 10.00 H new ATOM 0 HB3 LYS A 100 -3.278 -11.475 -8.047 1.00 10.00 H new ATOM 0 HG2 LYS A 100 -2.721 -13.636 -7.795 1.00 10.00 H new ATOM 0 HG3 LYS A 100 -3.879 -13.776 -6.487 1.00 10.00 H new ATOM 0 HD2 LYS A 100 -4.678 -14.101 -9.405 1.00 10.00 H new ATOM 0 HD3 LYS A 100 -4.102 -15.442 -8.436 1.00 10.00 H new ATOM 0 HE2 LYS A 100 -6.478 -13.717 -7.617 1.00 10.00 H new ATOM 0 HE3 LYS A 100 -6.647 -15.167 -8.587 1.00 10.00 H new ATOM 0 HZ1 LYS A 100 -7.016 -15.694 -6.306 1.00 10.00 H new ATOM 0 HZ2 LYS A 100 -5.553 -16.414 -6.780 1.00 10.00 H new ATOM 0 HZ3 LYS A 100 -5.538 -15.003 -5.836 1.00 10.00 H new ATOM 1617 N ALA A 101 -2.561 -10.982 -5.294 1.00 10.00 N ATOM 1618 CA ALA A 101 -1.456 -11.238 -4.383 1.00 10.00 C ATOM 1619 C ALA A 101 -1.876 -11.137 -2.914 1.00 10.00 C ATOM 1620 O ALA A 101 -1.658 -12.042 -2.117 1.00 10.00 O ATOM 1621 CB ALA A 101 -0.357 -10.232 -4.707 1.00 10.00 C ATOM 0 H ALA A 101 -2.324 -10.308 -6.022 1.00 10.00 H new ATOM 0 HA ALA A 101 -1.101 -12.260 -4.520 1.00 10.00 H new ATOM 0 HB1 ALA A 101 0.491 -10.393 -4.042 1.00 10.00 H new ATOM 0 HB2 ALA A 101 -0.038 -10.363 -5.741 1.00 10.00 H new ATOM 0 HB3 ALA A 101 -0.738 -9.220 -4.570 1.00 10.00 H new ATOM 1627 N THR A 102 -2.494 -10.010 -2.567 1.00 10.00 N ATOM 1628 CA THR A 102 -3.037 -9.747 -1.249 1.00 10.00 C ATOM 1629 C THR A 102 -4.067 -10.802 -0.848 1.00 10.00 C ATOM 1630 O THR A 102 -4.080 -11.221 0.306 1.00 10.00 O ATOM 1631 CB THR A 102 -3.641 -8.338 -1.211 1.00 10.00 C ATOM 1632 OG1 THR A 102 -4.730 -8.212 -2.103 1.00 10.00 O ATOM 1633 CG2 THR A 102 -2.591 -7.279 -1.547 1.00 10.00 C ATOM 0 H THR A 102 -2.631 -9.237 -3.218 1.00 10.00 H new ATOM 0 HA THR A 102 -2.227 -9.802 -0.522 1.00 10.00 H new ATOM 0 HB THR A 102 -4.001 -8.179 -0.195 1.00 10.00 H new ATOM 0 HG1 THR A 102 -4.412 -8.313 -3.024 1.00 10.00 H new ATOM 0 HG21 THR A 102 -3.048 -6.290 -1.512 1.00 10.00 H new ATOM 0 HG22 THR A 102 -1.779 -7.329 -0.822 1.00 10.00 H new ATOM 0 HG23 THR A 102 -2.197 -7.462 -2.547 1.00 10.00 H new ATOM 1641 N ASN A 103 -4.945 -11.186 -1.778 1.00 10.00 N ATOM 1642 CA ASN A 103 -5.946 -12.222 -1.576 1.00 10.00 C ATOM 1643 C ASN A 103 -5.245 -13.552 -1.279 1.00 10.00 C ATOM 1644 O ASN A 103 -5.522 -14.157 -0.247 1.00 10.00 O ATOM 1645 CB ASN A 103 -6.872 -12.270 -2.804 1.00 10.00 C ATOM 1646 CG ASN A 103 -8.068 -13.198 -2.652 1.00 10.00 C ATOM 1647 OD1 ASN A 103 -7.921 -14.396 -2.448 1.00 10.00 O ATOM 1648 ND2 ASN A 103 -9.274 -12.663 -2.830 1.00 10.00 N ATOM 0 H ASN A 103 -4.976 -10.773 -2.710 1.00 10.00 H new ATOM 0 HA ASN A 103 -6.577 -12.005 -0.714 1.00 10.00 H new ATOM 0 HB2 ASN A 103 -7.233 -11.263 -3.012 1.00 10.00 H new ATOM 0 HB3 ASN A 103 -6.291 -12.585 -3.670 1.00 10.00 H new ATOM 0 HD21 ASN A 103 -10.104 -13.255 -2.798 1.00 10.00 H new ATOM 0 HD22 ASN A 103 -9.368 -11.661 -2.998 1.00 10.00 H new ATOM 1655 N GLU A 104 -4.322 -13.956 -2.159 1.00 10.00 N ATOM 1656 CA GLU A 104 -3.437 -15.107 -2.090 1.00 10.00 C ATOM 1657 C GLU A 104 -2.593 -15.114 -3.370 1.00 10.00 C ATOM 1658 O GLU A 104 -1.462 -15.642 -3.315 1.00 10.00 O ATOM 1659 CB GLU A 104 -4.225 -16.425 -2.026 1.00 10.00 C ATOM 1660 CG GLU A 104 -4.269 -17.047 -0.625 1.00 10.00 C ATOM 1661 CD GLU A 104 -4.530 -18.546 -0.699 1.00 10.00 C ATOM 1662 OE1 GLU A 104 -5.378 -18.938 -1.531 1.00 10.00 O ATOM 1663 OE2 GLU A 104 -3.864 -19.275 0.069 1.00 10.00 O ATOM 1664 OXT GLU A 104 -3.133 -14.665 -4.409 1.00 10.00 O ATOM 0 H GLU A 104 -4.167 -13.428 -3.018 1.00 10.00 H new ATOM 0 HA GLU A 104 -2.826 -15.032 -1.191 1.00 10.00 H new ATOM 0 HB2 GLU A 104 -5.245 -16.246 -2.367 1.00 10.00 H new ATOM 0 HB3 GLU A 104 -3.779 -17.139 -2.718 1.00 10.00 H new ATOM 0 HG2 GLU A 104 -3.325 -16.864 -0.113 1.00 10.00 H new ATOM 0 HG3 GLU A 104 -5.050 -16.567 -0.035 1.00 10.00 H new