USER MOD reduce.3.24.130724 H: found=0, std=0, add=1078, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 1078 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 71 TYR OH : rot 150:sc= -0.431 USER MOD Set 1.2: A 74 SER OG : rot -125:sc= 0.0527 USER MOD Set 2.1: A 50 GLN : amide:sc= -0.603 K(o=-1.5,f=-4) USER MOD Set 2.2: A 87 HIS : no HD1:sc= -0.889 K(o=-1.5,f=-10!) USER MOD Set 3.1: A 26 GLN : amide:sc= -1.96 K(o=-2,f=-0.51) USER MOD Set 3.2: A 104 GLN : amide:sc= 0 X(o=-2,f=-1.9) USER MOD Single : A 1 GLY N :NH3+ -114:sc= 0.0871 (180deg=0) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 MET CE :methyl -163:sc= -0.163 (180deg=-0.726) USER MOD Single : A 7 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0617) USER MOD Single : A 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 21 LYS NZ :NH3+ 171:sc=-0.00856 (180deg=-0.133) USER MOD Single : A 30 GLN : amide:sc= 0 K(o=0,f=-0.63) USER MOD Single : A 31 SER OG : rot -130:sc= -0.788 USER MOD Single : A 33 GLN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : A 43 LYS NZ :NH3+ -161:sc= 1.81 (180deg=1.58) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 52 GLN : amide:sc= 0.763 K(o=0.76,f=-5.8!) USER MOD Single : A 67 THR OG1 : rot 132:sc= 0.161 USER MOD Single : A 75 HIS : no HD1:sc= -0.288 X(o=-0.29,f=-0.03) USER MOD Single : A 76 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 85 HIS : no HD1:sc= 0 X(o=0,f=-0.007) USER MOD Single : A 90 HIS : no HD1:sc= -3.03! C(o=-3!,f=-7.9!) USER MOD Single : A 95 HIS : no HE2:sc= 1.08 K(o=1.1,f=-5.8!) USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 101 HIS : no HE2:sc= 0.884 K(o=0.88,f=-5!) USER MOD Single : A 103 HIS : no HE2:sc= -1.47 K(o=-1.5,f=-2.1!) USER MOD Single : A 109 CYS SG : rot 180:sc= -3.32! USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 116 GLN : amide:sc= -0.0546 K(o=-0.055,f=-0.68) USER MOD Single : A 117 TYR OH : rot 180:sc= 0 USER MOD Single : A 131 MET CE :methyl -160:sc= -0.155 (180deg=-0.605) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -28.023 -13.478 1.740 1.00 0.00 N ATOM 2 CA GLY A 1 -29.060 -13.874 0.759 1.00 0.00 C ATOM 3 C GLY A 1 -28.760 -15.213 0.118 1.00 0.00 C ATOM 4 O GLY A 1 -27.661 -15.744 0.281 1.00 0.00 O ATOM 0 H1 GLY A 1 -28.436 -13.462 2.694 1.00 0.00 H new ATOM 0 H2 GLY A 1 -27.240 -14.162 1.713 1.00 0.00 H new ATOM 0 H3 GLY A 1 -27.663 -12.532 1.502 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -30.029 -13.920 1.256 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -29.135 -13.111 -0.016 1.00 0.00 H new ATOM 10 N PRO A 2 -29.727 -15.788 -0.621 1.00 0.00 N ATOM 11 CA PRO A 2 -29.553 -17.084 -1.292 1.00 0.00 C ATOM 12 C PRO A 2 -28.494 -17.023 -2.391 1.00 0.00 C ATOM 13 O PRO A 2 -27.814 -18.011 -2.678 1.00 0.00 O ATOM 14 CB PRO A 2 -30.936 -17.374 -1.897 1.00 0.00 C ATOM 15 CG PRO A 2 -31.874 -16.447 -1.199 1.00 0.00 C ATOM 16 CD PRO A 2 -31.066 -15.232 -0.850 1.00 0.00 C ATOM 0 HA PRO A 2 -29.211 -17.855 -0.601 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -30.939 -17.200 -2.973 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -31.223 -18.414 -1.742 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -32.715 -16.186 -1.841 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -32.288 -16.911 -0.304 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -31.067 -14.500 -1.657 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -31.453 -14.730 0.037 1.00 0.00 H new ATOM 24 N LEU A 3 -28.364 -15.859 -3.005 1.00 0.00 N ATOM 25 CA LEU A 3 -27.366 -15.651 -4.037 1.00 0.00 C ATOM 26 C LEU A 3 -26.102 -15.077 -3.416 1.00 0.00 C ATOM 27 O LEU A 3 -26.166 -14.147 -2.610 1.00 0.00 O ATOM 28 CB LEU A 3 -27.888 -14.716 -5.140 1.00 0.00 C ATOM 29 CG LEU A 3 -29.004 -15.281 -6.036 1.00 0.00 C ATOM 30 CD1 LEU A 3 -30.326 -15.375 -5.287 1.00 0.00 C ATOM 31 CD2 LEU A 3 -29.164 -14.423 -7.281 1.00 0.00 C ATOM 0 H LEU A 3 -28.940 -15.042 -2.805 1.00 0.00 H new ATOM 0 HA LEU A 3 -27.142 -16.613 -4.497 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -28.254 -13.803 -4.671 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -27.049 -14.433 -5.775 1.00 0.00 H new ATOM 0 HG LEU A 3 -28.716 -16.290 -6.332 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -31.092 -15.778 -5.950 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -30.210 -16.032 -4.425 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -30.624 -14.382 -4.949 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -29.957 -14.834 -7.906 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -29.422 -13.405 -6.990 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -28.228 -14.415 -7.840 1.00 0.00 H new ATOM 43 N GLY A 4 -24.961 -15.646 -3.782 1.00 0.00 N ATOM 44 CA GLY A 4 -23.695 -15.204 -3.238 1.00 0.00 C ATOM 45 C GLY A 4 -23.384 -13.774 -3.619 1.00 0.00 C ATOM 46 O GLY A 4 -22.962 -13.502 -4.745 1.00 0.00 O ATOM 0 H GLY A 4 -24.892 -16.412 -4.452 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -23.716 -15.294 -2.152 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -22.899 -15.856 -3.596 1.00 0.00 H new ATOM 50 N SER A 5 -23.602 -12.864 -2.683 1.00 0.00 N ATOM 51 CA SER A 5 -23.400 -11.446 -2.923 1.00 0.00 C ATOM 52 C SER A 5 -21.931 -11.077 -2.751 1.00 0.00 C ATOM 53 O SER A 5 -21.565 -10.334 -1.838 1.00 0.00 O ATOM 54 CB SER A 5 -24.266 -10.635 -1.956 1.00 0.00 C ATOM 55 OG SER A 5 -25.577 -11.181 -1.875 1.00 0.00 O ATOM 0 H SER A 5 -23.922 -13.087 -1.741 1.00 0.00 H new ATOM 0 HA SER A 5 -23.691 -11.216 -3.948 1.00 0.00 H new ATOM 0 HB2 SER A 5 -23.808 -10.629 -0.967 1.00 0.00 H new ATOM 0 HB3 SER A 5 -24.318 -9.598 -2.289 1.00 0.00 H new ATOM 0 HG SER A 5 -26.115 -10.650 -1.251 1.00 0.00 H new ATOM 61 N MET A 6 -21.088 -11.607 -3.621 1.00 0.00 N ATOM 62 CA MET A 6 -19.661 -11.356 -3.531 1.00 0.00 C ATOM 63 C MET A 6 -19.263 -10.206 -4.439 1.00 0.00 C ATOM 64 O MET A 6 -19.023 -10.395 -5.632 1.00 0.00 O ATOM 65 CB MET A 6 -18.845 -12.597 -3.894 1.00 0.00 C ATOM 66 CG MET A 6 -19.156 -13.814 -3.042 1.00 0.00 C ATOM 67 SD MET A 6 -17.998 -15.169 -3.323 1.00 0.00 S ATOM 68 CE MET A 6 -18.065 -15.304 -5.107 1.00 0.00 C ATOM 0 H MET A 6 -21.366 -12.211 -4.394 1.00 0.00 H new ATOM 0 HA MET A 6 -19.445 -11.094 -2.495 1.00 0.00 H new ATOM 0 HB2 MET A 6 -19.025 -12.844 -4.940 1.00 0.00 H new ATOM 0 HB3 MET A 6 -17.785 -12.362 -3.800 1.00 0.00 H new ATOM 0 HG2 MET A 6 -19.132 -13.532 -1.989 1.00 0.00 H new ATOM 0 HG3 MET A 6 -20.169 -14.155 -3.258 1.00 0.00 H new ATOM 0 HE1 MET A 6 -17.655 -16.266 -5.415 1.00 0.00 H new ATOM 0 HE2 MET A 6 -19.100 -15.228 -5.439 1.00 0.00 H new ATOM 0 HE3 MET A 6 -17.480 -14.500 -5.555 1.00 0.00 H new ATOM 78 N LYS A 7 -19.227 -9.011 -3.879 1.00 0.00 N ATOM 79 CA LYS A 7 -18.734 -7.853 -4.604 1.00 0.00 C ATOM 80 C LYS A 7 -17.236 -7.720 -4.389 1.00 0.00 C ATOM 81 O LYS A 7 -16.712 -8.149 -3.357 1.00 0.00 O ATOM 82 CB LYS A 7 -19.448 -6.570 -4.158 1.00 0.00 C ATOM 83 CG LYS A 7 -20.750 -6.294 -4.899 1.00 0.00 C ATOM 84 CD LYS A 7 -21.825 -7.316 -4.576 1.00 0.00 C ATOM 85 CE LYS A 7 -23.047 -7.129 -5.460 1.00 0.00 C ATOM 86 NZ LYS A 7 -23.663 -5.783 -5.304 1.00 0.00 N ATOM 0 H LYS A 7 -19.533 -8.816 -2.926 1.00 0.00 H new ATOM 0 HA LYS A 7 -18.941 -7.997 -5.665 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -19.657 -6.635 -3.090 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -18.775 -5.724 -4.300 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -21.109 -5.298 -4.639 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -20.562 -6.295 -5.973 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -21.426 -8.321 -4.711 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -22.114 -7.225 -3.529 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -22.764 -7.277 -6.502 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -23.786 -7.893 -5.219 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -24.548 -5.741 -5.849 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -23.867 -5.609 -4.299 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -23.006 -5.058 -5.655 1.00 0.00 H new ATOM 100 N MET A 8 -16.549 -7.139 -5.357 1.00 0.00 N ATOM 101 CA MET A 8 -15.113 -6.965 -5.251 1.00 0.00 C ATOM 102 C MET A 8 -14.773 -5.565 -4.777 1.00 0.00 C ATOM 103 O MET A 8 -15.293 -4.569 -5.283 1.00 0.00 O ATOM 104 CB MET A 8 -14.415 -7.266 -6.578 1.00 0.00 C ATOM 105 CG MET A 8 -14.238 -8.752 -6.847 1.00 0.00 C ATOM 106 SD MET A 8 -13.382 -9.078 -8.402 1.00 0.00 S ATOM 107 CE MET A 8 -13.244 -10.863 -8.343 1.00 0.00 C ATOM 0 H MET A 8 -16.960 -6.782 -6.220 1.00 0.00 H new ATOM 0 HA MET A 8 -14.749 -7.678 -4.512 1.00 0.00 H new ATOM 0 HB2 MET A 8 -14.991 -6.824 -7.391 1.00 0.00 H new ATOM 0 HB3 MET A 8 -13.437 -6.785 -6.582 1.00 0.00 H new ATOM 0 HG2 MET A 8 -13.678 -9.202 -6.027 1.00 0.00 H new ATOM 0 HG3 MET A 8 -15.216 -9.233 -6.867 1.00 0.00 H new ATOM 0 HE1 MET A 8 -12.735 -11.218 -9.239 1.00 0.00 H new ATOM 0 HE2 MET A 8 -12.673 -11.155 -7.461 1.00 0.00 H new ATOM 0 HE3 MET A 8 -14.240 -11.303 -8.293 1.00 0.00 H new ATOM 117 N ILE A 9 -13.901 -5.507 -3.793 1.00 0.00 N ATOM 118 CA ILE A 9 -13.458 -4.255 -3.223 1.00 0.00 C ATOM 119 C ILE A 9 -12.049 -3.965 -3.705 1.00 0.00 C ATOM 120 O ILE A 9 -11.124 -4.715 -3.418 1.00 0.00 O ATOM 121 CB ILE A 9 -13.474 -4.319 -1.682 1.00 0.00 C ATOM 122 CG1 ILE A 9 -14.891 -4.605 -1.173 1.00 0.00 C ATOM 123 CG2 ILE A 9 -12.924 -3.041 -1.058 1.00 0.00 C ATOM 124 CD1 ILE A 9 -15.012 -4.559 0.335 1.00 0.00 C ATOM 0 H ILE A 9 -13.478 -6.331 -3.365 1.00 0.00 H new ATOM 0 HA ILE A 9 -14.135 -3.462 -3.541 1.00 0.00 H new ATOM 0 HB ILE A 9 -12.821 -5.137 -1.378 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -15.578 -3.878 -1.607 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -15.203 -5.588 -1.525 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -12.952 -3.125 0.028 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -11.895 -2.891 -1.384 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -13.532 -2.192 -1.372 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -16.041 -4.771 0.624 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -14.351 -5.305 0.776 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -14.731 -3.568 0.692 1.00 0.00 H new ATOM 136 N GLU A 10 -11.882 -2.888 -4.436 1.00 0.00 N ATOM 137 CA GLU A 10 -10.579 -2.552 -4.976 1.00 0.00 C ATOM 138 C GLU A 10 -9.865 -1.608 -4.030 1.00 0.00 C ATOM 139 O GLU A 10 -10.394 -0.553 -3.682 1.00 0.00 O ATOM 140 CB GLU A 10 -10.709 -1.913 -6.363 1.00 0.00 C ATOM 141 CG GLU A 10 -11.106 -2.889 -7.457 1.00 0.00 C ATOM 142 CD GLU A 10 -9.912 -3.386 -8.244 1.00 0.00 C ATOM 143 OE1 GLU A 10 -9.552 -2.742 -9.249 1.00 0.00 O ATOM 144 OE2 GLU A 10 -9.315 -4.411 -7.863 1.00 0.00 O ATOM 0 H GLU A 10 -12.625 -2.231 -4.671 1.00 0.00 H new ATOM 0 HA GLU A 10 -9.998 -3.468 -5.080 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -11.450 -1.115 -6.316 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -9.758 -1.451 -6.630 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -11.625 -3.738 -7.012 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -11.809 -2.405 -8.135 1.00 0.00 H new ATOM 151 N VAL A 11 -8.678 -1.993 -3.603 1.00 0.00 N ATOM 152 CA VAL A 11 -7.900 -1.178 -2.690 1.00 0.00 C ATOM 153 C VAL A 11 -6.500 -0.989 -3.245 1.00 0.00 C ATOM 154 O VAL A 11 -5.841 -1.953 -3.634 1.00 0.00 O ATOM 155 CB VAL A 11 -7.810 -1.812 -1.282 1.00 0.00 C ATOM 156 CG1 VAL A 11 -6.899 -0.995 -0.372 1.00 0.00 C ATOM 157 CG2 VAL A 11 -9.194 -1.943 -0.665 1.00 0.00 C ATOM 0 H VAL A 11 -8.230 -2.868 -3.875 1.00 0.00 H new ATOM 0 HA VAL A 11 -8.404 -0.216 -2.594 1.00 0.00 H new ATOM 0 HB VAL A 11 -7.380 -2.808 -1.389 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -6.853 -1.462 0.612 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -5.898 -0.954 -0.801 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -7.294 0.016 -0.275 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -9.110 -2.391 0.325 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -9.649 -0.956 -0.579 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -9.816 -2.576 -1.298 1.00 0.00 H new ATOM 167 N VAL A 12 -6.057 0.247 -3.305 1.00 0.00 N ATOM 168 CA VAL A 12 -4.715 0.536 -3.762 1.00 0.00 C ATOM 169 C VAL A 12 -3.809 0.826 -2.579 1.00 0.00 C ATOM 170 O VAL A 12 -4.174 1.568 -1.666 1.00 0.00 O ATOM 171 CB VAL A 12 -4.677 1.715 -4.755 1.00 0.00 C ATOM 172 CG1 VAL A 12 -5.049 1.249 -6.153 1.00 0.00 C ATOM 173 CG2 VAL A 12 -5.605 2.834 -4.301 1.00 0.00 C ATOM 0 H VAL A 12 -6.605 1.067 -3.044 1.00 0.00 H new ATOM 0 HA VAL A 12 -4.357 -0.348 -4.290 1.00 0.00 H new ATOM 0 HB VAL A 12 -3.659 2.105 -4.781 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -5.016 2.095 -6.839 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -4.343 0.487 -6.483 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -6.055 0.830 -6.141 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -5.562 3.655 -5.017 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -6.626 2.458 -4.241 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -5.292 3.191 -3.320 1.00 0.00 H new ATOM 183 N ALA A 13 -2.638 0.217 -2.594 1.00 0.00 N ATOM 184 CA ALA A 13 -1.662 0.395 -1.540 1.00 0.00 C ATOM 185 C ALA A 13 -0.448 1.109 -2.104 1.00 0.00 C ATOM 186 O ALA A 13 0.053 0.745 -3.168 1.00 0.00 O ATOM 187 CB ALA A 13 -1.265 -0.950 -0.944 1.00 0.00 C ATOM 0 H ALA A 13 -2.339 -0.414 -3.337 1.00 0.00 H new ATOM 0 HA ALA A 13 -2.097 0.997 -0.742 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -0.531 -0.795 -0.153 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -2.147 -1.439 -0.530 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -0.833 -1.580 -1.722 1.00 0.00 H new ATOM 193 N ALA A 14 0.014 2.125 -1.405 1.00 0.00 N ATOM 194 CA ALA A 14 1.129 2.917 -1.878 1.00 0.00 C ATOM 195 C ALA A 14 2.399 2.547 -1.147 1.00 0.00 C ATOM 196 O ALA A 14 2.509 2.721 0.067 1.00 0.00 O ATOM 197 CB ALA A 14 0.847 4.398 -1.701 1.00 0.00 C ATOM 0 H ALA A 14 -0.366 2.422 -0.506 1.00 0.00 H new ATOM 0 HA ALA A 14 1.262 2.707 -2.939 1.00 0.00 H new ATOM 0 HB1 ALA A 14 1.697 4.976 -2.063 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -0.044 4.669 -2.268 1.00 0.00 H new ATOM 0 HB3 ALA A 14 0.684 4.614 -0.645 1.00 0.00 H new ATOM 203 N ILE A 15 3.361 2.044 -1.890 1.00 0.00 N ATOM 204 CA ILE A 15 4.663 1.761 -1.339 1.00 0.00 C ATOM 205 C ILE A 15 5.588 2.917 -1.662 1.00 0.00 C ATOM 206 O ILE A 15 6.074 3.049 -2.790 1.00 0.00 O ATOM 207 CB ILE A 15 5.251 0.440 -1.876 1.00 0.00 C ATOM 208 CG1 ILE A 15 4.401 -0.738 -1.389 1.00 0.00 C ATOM 209 CG2 ILE A 15 6.702 0.277 -1.446 1.00 0.00 C ATOM 210 CD1 ILE A 15 5.122 -2.068 -1.414 1.00 0.00 C ATOM 0 H ILE A 15 3.263 1.823 -2.881 1.00 0.00 H new ATOM 0 HA ILE A 15 4.562 1.644 -0.260 1.00 0.00 H new ATOM 0 HB ILE A 15 5.231 0.462 -2.966 1.00 0.00 H new ATOM 0 HG12 ILE A 15 4.068 -0.536 -0.371 1.00 0.00 H new ATOM 0 HG13 ILE A 15 3.507 -0.809 -2.009 1.00 0.00 H new ATOM 0 HG21 ILE A 15 7.094 -0.662 -1.837 1.00 0.00 H new ATOM 0 HG22 ILE A 15 7.292 1.107 -1.835 1.00 0.00 H new ATOM 0 HG23 ILE A 15 6.760 0.269 -0.358 1.00 0.00 H new ATOM 0 HD11 ILE A 15 4.454 -2.851 -1.055 1.00 0.00 H new ATOM 0 HD12 ILE A 15 5.432 -2.295 -2.434 1.00 0.00 H new ATOM 0 HD13 ILE A 15 6.001 -2.018 -0.771 1.00 0.00 H new ATOM 222 N ILE A 16 5.799 3.774 -0.680 1.00 0.00 N ATOM 223 CA ILE A 16 6.596 4.965 -0.873 1.00 0.00 C ATOM 224 C ILE A 16 8.039 4.664 -0.521 1.00 0.00 C ATOM 225 O ILE A 16 8.387 4.539 0.649 1.00 0.00 O ATOM 226 CB ILE A 16 6.069 6.128 -0.004 1.00 0.00 C ATOM 227 CG1 ILE A 16 4.560 6.288 -0.212 1.00 0.00 C ATOM 228 CG2 ILE A 16 6.799 7.424 -0.341 1.00 0.00 C ATOM 229 CD1 ILE A 16 3.942 7.380 0.622 1.00 0.00 C ATOM 0 H ILE A 16 5.426 3.664 0.263 1.00 0.00 H new ATOM 0 HA ILE A 16 6.529 5.268 -1.918 1.00 0.00 H new ATOM 0 HB ILE A 16 6.258 5.898 1.045 1.00 0.00 H new ATOM 0 HG12 ILE A 16 4.368 6.495 -1.265 1.00 0.00 H new ATOM 0 HG13 ILE A 16 4.069 5.343 0.022 1.00 0.00 H new ATOM 0 HG21 ILE A 16 6.413 8.231 0.282 1.00 0.00 H new ATOM 0 HG22 ILE A 16 7.866 7.300 -0.155 1.00 0.00 H new ATOM 0 HG23 ILE A 16 6.640 7.668 -1.391 1.00 0.00 H new ATOM 0 HD11 ILE A 16 2.872 7.432 0.419 1.00 0.00 H new ATOM 0 HD12 ILE A 16 4.101 7.165 1.679 1.00 0.00 H new ATOM 0 HD13 ILE A 16 4.405 8.335 0.372 1.00 0.00 H new ATOM 241 N GLU A 17 8.868 4.524 -1.537 1.00 0.00 N ATOM 242 CA GLU A 17 10.247 4.135 -1.331 1.00 0.00 C ATOM 243 C GLU A 17 11.172 5.287 -1.677 1.00 0.00 C ATOM 244 O GLU A 17 11.248 5.717 -2.828 1.00 0.00 O ATOM 245 CB GLU A 17 10.582 2.906 -2.176 1.00 0.00 C ATOM 246 CG GLU A 17 12.015 2.425 -2.025 1.00 0.00 C ATOM 247 CD GLU A 17 12.346 1.303 -2.986 1.00 0.00 C ATOM 248 OE1 GLU A 17 12.296 1.541 -4.213 1.00 0.00 O ATOM 249 OE2 GLU A 17 12.658 0.187 -2.522 1.00 0.00 O ATOM 0 H GLU A 17 8.610 4.674 -2.512 1.00 0.00 H new ATOM 0 HA GLU A 17 10.388 3.880 -0.281 1.00 0.00 H new ATOM 0 HB2 GLU A 17 9.907 2.095 -1.903 1.00 0.00 H new ATOM 0 HB3 GLU A 17 10.396 3.137 -3.225 1.00 0.00 H new ATOM 0 HG2 GLU A 17 12.696 3.259 -2.194 1.00 0.00 H new ATOM 0 HG3 GLU A 17 12.176 2.084 -1.002 1.00 0.00 H new ATOM 256 N ARG A 18 11.848 5.800 -0.669 1.00 0.00 N ATOM 257 CA ARG A 18 12.822 6.848 -0.862 1.00 0.00 C ATOM 258 C ARG A 18 14.043 6.532 -0.020 1.00 0.00 C ATOM 259 O ARG A 18 13.914 5.965 1.065 1.00 0.00 O ATOM 260 CB ARG A 18 12.249 8.214 -0.474 1.00 0.00 C ATOM 261 CG ARG A 18 12.628 9.319 -1.447 1.00 0.00 C ATOM 262 CD ARG A 18 11.814 9.225 -2.728 1.00 0.00 C ATOM 263 NE ARG A 18 12.393 10.014 -3.816 1.00 0.00 N ATOM 264 CZ ARG A 18 11.850 11.126 -4.316 1.00 0.00 C ATOM 265 NH1 ARG A 18 10.786 11.676 -3.739 1.00 0.00 N ATOM 266 NH2 ARG A 18 12.388 11.701 -5.383 1.00 0.00 N ATOM 0 H ARG A 18 11.737 5.503 0.300 1.00 0.00 H new ATOM 0 HA ARG A 18 13.095 6.895 -1.916 1.00 0.00 H new ATOM 0 HB2 ARG A 18 11.163 8.143 -0.419 1.00 0.00 H new ATOM 0 HB3 ARG A 18 12.602 8.479 0.523 1.00 0.00 H new ATOM 0 HG2 ARG A 18 12.465 10.290 -0.980 1.00 0.00 H new ATOM 0 HG3 ARG A 18 13.690 9.252 -1.682 1.00 0.00 H new ATOM 0 HD2 ARG A 18 11.746 8.182 -3.036 1.00 0.00 H new ATOM 0 HD3 ARG A 18 10.797 9.568 -2.535 1.00 0.00 H new ATOM 0 HE ARG A 18 13.272 9.692 -4.220 1.00 0.00 H new ATOM 0 HH11 ARG A 18 10.378 11.248 -2.908 1.00 0.00 H new ATOM 0 HH12 ARG A 18 10.377 12.526 -4.128 1.00 0.00 H new ATOM 0 HH21 ARG A 18 13.215 11.293 -5.820 1.00 0.00 H new ATOM 0 HH22 ARG A 18 11.975 12.551 -5.767 1.00 0.00 H new ATOM 280 N ASP A 19 15.221 6.848 -0.547 1.00 0.00 N ATOM 281 CA ASP A 19 16.488 6.621 0.155 1.00 0.00 C ATOM 282 C ASP A 19 16.794 5.132 0.262 1.00 0.00 C ATOM 283 O ASP A 19 17.744 4.734 0.942 1.00 0.00 O ATOM 284 CB ASP A 19 16.480 7.245 1.563 1.00 0.00 C ATOM 285 CG ASP A 19 16.179 8.729 1.541 1.00 0.00 C ATOM 286 OD1 ASP A 19 17.007 9.497 1.011 1.00 0.00 O ATOM 287 OD2 ASP A 19 15.110 9.139 2.043 1.00 0.00 O ATOM 0 H ASP A 19 15.329 7.268 -1.470 1.00 0.00 H new ATOM 0 HA ASP A 19 17.266 7.107 -0.434 1.00 0.00 H new ATOM 0 HB2 ASP A 19 15.737 6.736 2.177 1.00 0.00 H new ATOM 0 HB3 ASP A 19 17.449 7.082 2.034 1.00 0.00 H new ATOM 292 N GLY A 20 15.992 4.306 -0.404 1.00 0.00 N ATOM 293 CA GLY A 20 16.167 2.871 -0.320 1.00 0.00 C ATOM 294 C GLY A 20 15.261 2.268 0.733 1.00 0.00 C ATOM 295 O GLY A 20 15.244 1.054 0.940 1.00 0.00 O ATOM 0 H GLY A 20 15.223 4.608 -1.001 1.00 0.00 H new ATOM 0 HA2 GLY A 20 15.954 2.419 -1.289 1.00 0.00 H new ATOM 0 HA3 GLY A 20 17.206 2.642 -0.083 1.00 0.00 H new ATOM 299 N LYS A 21 14.502 3.129 1.391 1.00 0.00 N ATOM 300 CA LYS A 21 13.631 2.724 2.478 1.00 0.00 C ATOM 301 C LYS A 21 12.170 2.923 2.089 1.00 0.00 C ATOM 302 O LYS A 21 11.857 3.764 1.248 1.00 0.00 O ATOM 303 CB LYS A 21 13.955 3.556 3.715 1.00 0.00 C ATOM 304 CG LYS A 21 15.434 3.585 4.053 1.00 0.00 C ATOM 305 CD LYS A 21 15.779 2.544 5.098 1.00 0.00 C ATOM 306 CE LYS A 21 17.274 2.491 5.379 1.00 0.00 C ATOM 307 NZ LYS A 21 17.795 3.795 5.865 1.00 0.00 N ATOM 0 H LYS A 21 14.474 4.128 1.185 1.00 0.00 H new ATOM 0 HA LYS A 21 13.792 1.667 2.692 1.00 0.00 H new ATOM 0 HB2 LYS A 21 13.606 4.577 3.559 1.00 0.00 H new ATOM 0 HB3 LYS A 21 13.403 3.157 4.566 1.00 0.00 H new ATOM 0 HG2 LYS A 21 16.019 3.406 3.151 1.00 0.00 H new ATOM 0 HG3 LYS A 21 15.707 4.575 4.419 1.00 0.00 H new ATOM 0 HD2 LYS A 21 15.244 2.766 6.021 1.00 0.00 H new ATOM 0 HD3 LYS A 21 15.439 1.565 4.761 1.00 0.00 H new ATOM 0 HE2 LYS A 21 17.476 1.720 6.122 1.00 0.00 H new ATOM 0 HE3 LYS A 21 17.804 2.205 4.471 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 18.777 3.678 6.188 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 17.765 4.490 5.092 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 17.208 4.131 6.655 1.00 0.00 H new ATOM 321 N ILE A 22 11.288 2.159 2.709 1.00 0.00 N ATOM 322 CA ILE A 22 9.863 2.262 2.442 1.00 0.00 C ATOM 323 C ILE A 22 9.185 2.998 3.591 1.00 0.00 C ATOM 324 O ILE A 22 9.578 2.847 4.750 1.00 0.00 O ATOM 325 CB ILE A 22 9.218 0.862 2.282 1.00 0.00 C ATOM 326 CG1 ILE A 22 10.057 -0.012 1.347 1.00 0.00 C ATOM 327 CG2 ILE A 22 7.792 0.978 1.750 1.00 0.00 C ATOM 328 CD1 ILE A 22 9.536 -1.426 1.229 1.00 0.00 C ATOM 0 H ILE A 22 11.535 1.456 3.405 1.00 0.00 H new ATOM 0 HA ILE A 22 9.730 2.811 1.510 1.00 0.00 H new ATOM 0 HB ILE A 22 9.183 0.393 3.265 1.00 0.00 H new ATOM 0 HG12 ILE A 22 10.080 0.444 0.357 1.00 0.00 H new ATOM 0 HG13 ILE A 22 11.085 -0.039 1.710 1.00 0.00 H new ATOM 0 HG21 ILE A 22 7.360 -0.017 1.646 1.00 0.00 H new ATOM 0 HG22 ILE A 22 7.191 1.564 2.445 1.00 0.00 H new ATOM 0 HG23 ILE A 22 7.805 1.471 0.778 1.00 0.00 H new ATOM 0 HD11 ILE A 22 10.175 -1.994 0.552 1.00 0.00 H new ATOM 0 HD12 ILE A 22 9.539 -1.898 2.212 1.00 0.00 H new ATOM 0 HD13 ILE A 22 8.519 -1.407 0.838 1.00 0.00 H new ATOM 340 N LEU A 23 8.195 3.818 3.269 1.00 0.00 N ATOM 341 CA LEU A 23 7.447 4.539 4.283 1.00 0.00 C ATOM 342 C LEU A 23 6.378 3.642 4.902 1.00 0.00 C ATOM 343 O LEU A 23 5.488 3.144 4.212 1.00 0.00 O ATOM 344 CB LEU A 23 6.793 5.791 3.697 1.00 0.00 C ATOM 345 CG LEU A 23 6.067 6.666 4.719 1.00 0.00 C ATOM 346 CD1 LEU A 23 7.058 7.322 5.667 1.00 0.00 C ATOM 347 CD2 LEU A 23 5.211 7.710 4.023 1.00 0.00 C ATOM 0 H LEU A 23 7.893 3.999 2.312 1.00 0.00 H new ATOM 0 HA LEU A 23 8.150 4.844 5.059 1.00 0.00 H new ATOM 0 HB2 LEU A 23 7.560 6.389 3.205 1.00 0.00 H new ATOM 0 HB3 LEU A 23 6.083 5.488 2.928 1.00 0.00 H new ATOM 0 HG LEU A 23 5.408 6.027 5.307 1.00 0.00 H new ATOM 0 HD11 LEU A 23 6.520 7.940 6.386 1.00 0.00 H new ATOM 0 HD12 LEU A 23 7.618 6.552 6.198 1.00 0.00 H new ATOM 0 HD13 LEU A 23 7.748 7.945 5.098 1.00 0.00 H new ATOM 0 HD21 LEU A 23 4.704 8.321 4.770 1.00 0.00 H new ATOM 0 HD22 LEU A 23 5.844 8.345 3.403 1.00 0.00 H new ATOM 0 HD23 LEU A 23 4.470 7.214 3.396 1.00 0.00 H new ATOM 359 N LEU A 24 6.495 3.436 6.200 1.00 0.00 N ATOM 360 CA LEU A 24 5.519 2.661 6.951 1.00 0.00 C ATOM 361 C LEU A 24 4.809 3.551 7.957 1.00 0.00 C ATOM 362 O LEU A 24 5.444 4.342 8.660 1.00 0.00 O ATOM 363 CB LEU A 24 6.173 1.472 7.664 1.00 0.00 C ATOM 364 CG LEU A 24 6.533 0.273 6.770 1.00 0.00 C ATOM 365 CD1 LEU A 24 7.712 0.585 5.869 1.00 0.00 C ATOM 366 CD2 LEU A 24 6.821 -0.953 7.619 1.00 0.00 C ATOM 0 H LEU A 24 7.264 3.798 6.764 1.00 0.00 H new ATOM 0 HA LEU A 24 4.790 2.265 6.244 1.00 0.00 H new ATOM 0 HB2 LEU A 24 7.081 1.821 8.155 1.00 0.00 H new ATOM 0 HB3 LEU A 24 5.499 1.127 8.449 1.00 0.00 H new ATOM 0 HG LEU A 24 5.675 0.065 6.131 1.00 0.00 H new ATOM 0 HD11 LEU A 24 7.938 -0.284 5.252 1.00 0.00 H new ATOM 0 HD12 LEU A 24 7.466 1.431 5.228 1.00 0.00 H new ATOM 0 HD13 LEU A 24 8.581 0.833 6.479 1.00 0.00 H new ATOM 0 HD21 LEU A 24 7.074 -1.793 6.972 1.00 0.00 H new ATOM 0 HD22 LEU A 24 7.657 -0.745 8.287 1.00 0.00 H new ATOM 0 HD23 LEU A 24 5.939 -1.203 8.209 1.00 0.00 H new ATOM 378 N ALA A 25 3.492 3.435 8.008 1.00 0.00 N ATOM 379 CA ALA A 25 2.698 4.240 8.916 1.00 0.00 C ATOM 380 C ALA A 25 2.145 3.403 10.055 1.00 0.00 C ATOM 381 O ALA A 25 1.548 2.353 9.839 1.00 0.00 O ATOM 382 CB ALA A 25 1.567 4.925 8.173 1.00 0.00 C ATOM 0 H ALA A 25 2.952 2.791 7.430 1.00 0.00 H new ATOM 0 HA ALA A 25 3.352 5.001 9.341 1.00 0.00 H new ATOM 0 HB1 ALA A 25 0.983 5.524 8.872 1.00 0.00 H new ATOM 0 HB2 ALA A 25 1.979 5.571 7.398 1.00 0.00 H new ATOM 0 HB3 ALA A 25 0.925 4.173 7.715 1.00 0.00 H new ATOM 388 N GLN A 26 2.387 3.851 11.271 1.00 0.00 N ATOM 389 CA GLN A 26 1.809 3.214 12.436 1.00 0.00 C ATOM 390 C GLN A 26 0.348 3.618 12.591 1.00 0.00 C ATOM 391 O GLN A 26 0.011 4.795 12.492 1.00 0.00 O ATOM 392 CB GLN A 26 2.608 3.567 13.690 1.00 0.00 C ATOM 393 CG GLN A 26 2.036 2.976 14.966 1.00 0.00 C ATOM 394 CD GLN A 26 2.982 3.112 16.137 1.00 0.00 C ATOM 395 OE1 GLN A 26 2.983 4.124 16.830 1.00 0.00 O ATOM 396 NE2 GLN A 26 3.771 2.079 16.382 1.00 0.00 N ATOM 0 H GLN A 26 2.981 4.654 11.477 1.00 0.00 H new ATOM 0 HA GLN A 26 1.852 2.133 12.300 1.00 0.00 H new ATOM 0 HB2 GLN A 26 3.633 3.218 13.567 1.00 0.00 H new ATOM 0 HB3 GLN A 26 2.650 4.652 13.790 1.00 0.00 H new ATOM 0 HG2 GLN A 26 1.095 3.472 15.203 1.00 0.00 H new ATOM 0 HG3 GLN A 26 1.809 1.922 14.806 1.00 0.00 H new ATOM 0 HE21 GLN A 26 3.737 1.257 15.779 1.00 0.00 H new ATOM 0 HE22 GLN A 26 4.413 2.104 17.174 1.00 0.00 H new ATOM 405 N ARG A 27 -0.490 2.615 12.822 1.00 0.00 N ATOM 406 CA ARG A 27 -1.943 2.762 12.952 1.00 0.00 C ATOM 407 C ARG A 27 -2.579 2.827 11.574 1.00 0.00 C ATOM 408 O ARG A 27 -2.449 3.826 10.867 1.00 0.00 O ATOM 409 CB ARG A 27 -2.367 3.984 13.781 1.00 0.00 C ATOM 410 CG ARG A 27 -3.864 4.008 14.061 1.00 0.00 C ATOM 411 CD ARG A 27 -4.329 5.344 14.618 1.00 0.00 C ATOM 412 NE ARG A 27 -5.724 5.287 15.057 1.00 0.00 N ATOM 413 CZ ARG A 27 -6.746 5.876 14.427 1.00 0.00 C ATOM 414 NH1 ARG A 27 -6.543 6.594 13.329 1.00 0.00 N ATOM 415 NH2 ARG A 27 -7.973 5.748 14.913 1.00 0.00 N ATOM 0 H ARG A 27 -0.175 1.651 12.928 1.00 0.00 H new ATOM 0 HA ARG A 27 -2.295 1.885 13.494 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -1.824 3.984 14.726 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -2.085 4.894 13.251 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -4.406 3.793 13.140 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -4.111 3.217 14.769 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -3.694 5.630 15.457 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -4.218 6.115 13.856 1.00 0.00 H new ATOM 0 HE ARG A 27 -5.932 4.760 15.905 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -5.599 6.701 12.957 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -7.331 7.038 12.857 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -8.131 5.204 15.761 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -8.758 6.194 14.439 1.00 0.00 H new ATOM 429 N PRO A 28 -3.269 1.748 11.186 1.00 0.00 N ATOM 430 CA PRO A 28 -3.874 1.624 9.863 1.00 0.00 C ATOM 431 C PRO A 28 -4.987 2.634 9.635 1.00 0.00 C ATOM 432 O PRO A 28 -4.812 3.633 8.936 1.00 0.00 O ATOM 433 CB PRO A 28 -4.447 0.199 9.841 1.00 0.00 C ATOM 434 CG PRO A 28 -3.850 -0.499 11.007 1.00 0.00 C ATOM 435 CD PRO A 28 -3.508 0.558 12.013 1.00 0.00 C ATOM 0 HA PRO A 28 -3.142 1.813 9.077 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -5.535 0.215 9.910 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -4.194 -0.309 8.910 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -4.551 -1.220 11.427 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -2.960 -1.054 10.711 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -4.321 0.717 12.721 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -2.626 0.289 12.595 1.00 0.00 H new ATOM 443 N ALA A 29 -6.128 2.374 10.250 1.00 0.00 N ATOM 444 CA ALA A 29 -7.298 3.212 10.054 1.00 0.00 C ATOM 445 C ALA A 29 -8.277 3.076 11.211 1.00 0.00 C ATOM 446 O ALA A 29 -8.326 3.922 12.099 1.00 0.00 O ATOM 447 CB ALA A 29 -7.979 2.850 8.744 1.00 0.00 C ATOM 0 H ALA A 29 -6.269 1.591 10.888 1.00 0.00 H new ATOM 0 HA ALA A 29 -6.970 4.251 10.015 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -8.856 3.482 8.603 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -7.284 3.004 7.918 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -8.286 1.804 8.770 1.00 0.00 H new ATOM 453 N GLN A 30 -9.038 1.990 11.207 1.00 0.00 N ATOM 454 CA GLN A 30 -10.068 1.779 12.215 1.00 0.00 C ATOM 455 C GLN A 30 -9.585 0.825 13.299 1.00 0.00 C ATOM 456 O GLN A 30 -10.365 0.363 14.131 1.00 0.00 O ATOM 457 CB GLN A 30 -11.343 1.244 11.562 1.00 0.00 C ATOM 458 CG GLN A 30 -11.992 2.239 10.615 1.00 0.00 C ATOM 459 CD GLN A 30 -13.261 1.707 9.979 1.00 0.00 C ATOM 460 OE1 GLN A 30 -13.968 0.884 10.560 1.00 0.00 O ATOM 461 NE2 GLN A 30 -13.560 2.182 8.781 1.00 0.00 N ATOM 0 H GLN A 30 -8.962 1.242 10.518 1.00 0.00 H new ATOM 0 HA GLN A 30 -10.288 2.738 12.685 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -11.108 0.331 11.015 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -12.057 0.974 12.340 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -12.221 3.155 11.160 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -11.282 2.503 9.831 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -12.946 2.863 8.335 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -14.404 1.867 8.304 1.00 0.00 H new ATOM 470 N SER A 31 -8.294 0.534 13.278 1.00 0.00 N ATOM 471 CA SER A 31 -7.679 -0.297 14.288 1.00 0.00 C ATOM 472 C SER A 31 -7.514 0.491 15.581 1.00 0.00 C ATOM 473 O SER A 31 -6.701 1.417 15.655 1.00 0.00 O ATOM 474 CB SER A 31 -6.328 -0.798 13.775 1.00 0.00 C ATOM 475 OG SER A 31 -6.491 -1.522 12.566 1.00 0.00 O ATOM 0 H SER A 31 -7.649 0.868 12.561 1.00 0.00 H new ATOM 0 HA SER A 31 -8.316 -1.157 14.496 1.00 0.00 H new ATOM 0 HB2 SER A 31 -5.659 0.047 13.612 1.00 0.00 H new ATOM 0 HB3 SER A 31 -5.861 -1.435 14.526 1.00 0.00 H new ATOM 0 HG SER A 31 -6.023 -2.380 12.633 1.00 0.00 H new ATOM 481 N ASP A 32 -8.319 0.153 16.582 1.00 0.00 N ATOM 482 CA ASP A 32 -8.237 0.810 17.881 1.00 0.00 C ATOM 483 C ASP A 32 -6.883 0.528 18.511 1.00 0.00 C ATOM 484 O ASP A 32 -6.284 1.388 19.157 1.00 0.00 O ATOM 485 CB ASP A 32 -9.356 0.331 18.809 1.00 0.00 C ATOM 486 CG ASP A 32 -9.354 1.070 20.131 1.00 0.00 C ATOM 487 OD1 ASP A 32 -9.822 2.230 20.165 1.00 0.00 O ATOM 488 OD2 ASP A 32 -8.892 0.499 21.139 1.00 0.00 O ATOM 0 H ASP A 32 -9.035 -0.571 16.519 1.00 0.00 H new ATOM 0 HA ASP A 32 -8.354 1.884 17.734 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -10.319 0.470 18.317 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -9.243 -0.738 18.991 1.00 0.00 H new ATOM 493 N GLN A 33 -6.411 -0.686 18.300 1.00 0.00 N ATOM 494 CA GLN A 33 -5.075 -1.077 18.704 1.00 0.00 C ATOM 495 C GLN A 33 -4.038 -0.441 17.787 1.00 0.00 C ATOM 496 O GLN A 33 -4.046 -0.656 16.571 1.00 0.00 O ATOM 497 CB GLN A 33 -4.939 -2.598 18.666 1.00 0.00 C ATOM 498 CG GLN A 33 -5.586 -3.229 17.442 1.00 0.00 C ATOM 499 CD GLN A 33 -5.227 -4.692 17.278 1.00 0.00 C ATOM 500 OE1 GLN A 33 -4.973 -5.402 18.256 1.00 0.00 O ATOM 501 NE2 GLN A 33 -5.212 -5.156 16.041 1.00 0.00 N ATOM 0 H GLN A 33 -6.943 -1.428 17.844 1.00 0.00 H new ATOM 0 HA GLN A 33 -4.904 -0.730 19.723 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -3.882 -2.862 18.686 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -5.390 -3.019 19.565 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -6.669 -3.131 17.518 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -5.278 -2.682 16.551 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -5.428 -4.535 15.261 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -4.984 -6.135 15.866 1.00 0.00 H new ATOM 510 N ALA A 34 -3.162 0.356 18.365 1.00 0.00 N ATOM 511 CA ALA A 34 -2.094 0.979 17.608 1.00 0.00 C ATOM 512 C ALA A 34 -0.832 0.136 17.694 1.00 0.00 C ATOM 513 O ALA A 34 -0.777 -0.841 18.440 1.00 0.00 O ATOM 514 CB ALA A 34 -1.834 2.393 18.111 1.00 0.00 C ATOM 0 H ALA A 34 -3.168 0.588 19.358 1.00 0.00 H new ATOM 0 HA ALA A 34 -2.398 1.043 16.563 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -1.029 2.844 17.530 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -2.739 2.990 18.001 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -1.547 2.358 19.162 1.00 0.00 H new ATOM 520 N GLY A 35 0.172 0.506 16.918 1.00 0.00 N ATOM 521 CA GLY A 35 1.433 -0.203 16.944 1.00 0.00 C ATOM 522 C GLY A 35 1.723 -0.913 15.641 1.00 0.00 C ATOM 523 O GLY A 35 2.882 -1.070 15.264 1.00 0.00 O ATOM 0 H GLY A 35 0.136 1.290 16.266 1.00 0.00 H new ATOM 0 HA2 GLY A 35 2.238 0.500 17.158 1.00 0.00 H new ATOM 0 HA3 GLY A 35 1.421 -0.930 17.756 1.00 0.00 H new ATOM 527 N LEU A 36 0.673 -1.319 14.935 1.00 0.00 N ATOM 528 CA LEU A 36 0.828 -1.961 13.636 1.00 0.00 C ATOM 529 C LEU A 36 1.207 -0.935 12.577 1.00 0.00 C ATOM 530 O LEU A 36 0.730 0.200 12.603 1.00 0.00 O ATOM 531 CB LEU A 36 -0.479 -2.655 13.190 1.00 0.00 C ATOM 532 CG LEU A 36 -1.078 -3.732 14.121 1.00 0.00 C ATOM 533 CD1 LEU A 36 -0.022 -4.720 14.580 1.00 0.00 C ATOM 534 CD2 LEU A 36 -1.795 -3.111 15.315 1.00 0.00 C ATOM 0 H LEU A 36 -0.294 -1.215 15.241 1.00 0.00 H new ATOM 0 HA LEU A 36 1.616 -2.707 13.740 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -1.234 -1.883 13.042 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -0.299 -3.115 12.218 1.00 0.00 H new ATOM 0 HG LEU A 36 -1.819 -4.279 13.538 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -0.479 -5.463 15.233 1.00 0.00 H new ATOM 0 HD12 LEU A 36 0.413 -5.217 13.713 1.00 0.00 H new ATOM 0 HD13 LEU A 36 0.760 -4.190 15.124 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -2.202 -3.901 15.946 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -1.090 -2.513 15.892 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -2.606 -2.474 14.962 1.00 0.00 H new ATOM 546 N TRP A 37 2.080 -1.342 11.670 1.00 0.00 N ATOM 547 CA TRP A 37 2.462 -0.515 10.533 1.00 0.00 C ATOM 548 C TRP A 37 1.836 -1.085 9.266 1.00 0.00 C ATOM 549 O TRP A 37 1.641 -2.297 9.163 1.00 0.00 O ATOM 550 CB TRP A 37 3.989 -0.468 10.378 1.00 0.00 C ATOM 551 CG TRP A 37 4.713 0.039 11.591 1.00 0.00 C ATOM 552 CD1 TRP A 37 4.156 0.512 12.740 1.00 0.00 C ATOM 553 CD2 TRP A 37 6.132 0.133 11.769 1.00 0.00 C ATOM 554 NE1 TRP A 37 5.133 0.881 13.624 1.00 0.00 N ATOM 555 CE2 TRP A 37 6.357 0.664 13.052 1.00 0.00 C ATOM 556 CE3 TRP A 37 7.234 -0.183 10.971 1.00 0.00 C ATOM 557 CZ2 TRP A 37 7.637 0.889 13.553 1.00 0.00 C ATOM 558 CZ3 TRP A 37 8.504 0.040 11.468 1.00 0.00 C ATOM 559 CH2 TRP A 37 8.697 0.570 12.750 1.00 0.00 C ATOM 0 H TRP A 37 2.543 -2.250 11.699 1.00 0.00 H new ATOM 0 HA TRP A 37 2.104 0.500 10.702 1.00 0.00 H new ATOM 0 HB2 TRP A 37 4.351 -1.469 10.144 1.00 0.00 H new ATOM 0 HB3 TRP A 37 4.238 0.167 9.528 1.00 0.00 H new ATOM 0 HD1 TRP A 37 3.095 0.585 12.927 1.00 0.00 H new ATOM 0 HE1 TRP A 37 4.974 1.257 14.559 1.00 0.00 H new ATOM 0 HE3 TRP A 37 7.096 -0.595 9.982 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 7.787 1.301 14.540 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 9.362 -0.198 10.857 1.00 0.00 H new ATOM 0 HH2 TRP A 37 9.702 0.730 13.111 1.00 0.00 H new ATOM 570 N GLU A 38 1.499 -0.222 8.320 1.00 0.00 N ATOM 571 CA GLU A 38 0.946 -0.669 7.046 1.00 0.00 C ATOM 572 C GLU A 38 1.317 0.280 5.911 1.00 0.00 C ATOM 573 O GLU A 38 1.941 1.326 6.135 1.00 0.00 O ATOM 574 CB GLU A 38 -0.579 -0.832 7.156 1.00 0.00 C ATOM 575 CG GLU A 38 -1.267 0.208 8.035 1.00 0.00 C ATOM 576 CD GLU A 38 -1.318 1.594 7.418 1.00 0.00 C ATOM 577 OE1 GLU A 38 -2.173 1.823 6.536 1.00 0.00 O ATOM 578 OE2 GLU A 38 -0.535 2.471 7.840 1.00 0.00 O ATOM 0 H GLU A 38 1.597 0.789 8.408 1.00 0.00 H new ATOM 0 HA GLU A 38 1.382 -1.640 6.809 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -1.009 -0.785 6.156 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -0.798 -1.824 7.551 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -2.284 -0.123 8.246 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -0.746 0.265 8.991 1.00 0.00 H new ATOM 585 N PHE A 39 0.969 -0.114 4.693 1.00 0.00 N ATOM 586 CA PHE A 39 1.184 0.720 3.520 1.00 0.00 C ATOM 587 C PHE A 39 -0.060 1.556 3.256 1.00 0.00 C ATOM 588 O PHE A 39 -1.141 1.019 3.009 1.00 0.00 O ATOM 589 CB PHE A 39 1.511 -0.138 2.291 1.00 0.00 C ATOM 590 CG PHE A 39 2.746 -0.961 2.430 1.00 0.00 C ATOM 591 CD1 PHE A 39 3.989 -0.416 2.181 1.00 0.00 C ATOM 592 CD2 PHE A 39 2.660 -2.283 2.805 1.00 0.00 C ATOM 593 CE1 PHE A 39 5.126 -1.178 2.307 1.00 0.00 C ATOM 594 CE2 PHE A 39 3.790 -3.053 2.933 1.00 0.00 C ATOM 595 CZ PHE A 39 5.030 -2.500 2.687 1.00 0.00 C ATOM 0 H PHE A 39 0.533 -1.014 4.492 1.00 0.00 H new ATOM 0 HA PHE A 39 2.032 1.378 3.710 1.00 0.00 H new ATOM 0 HB2 PHE A 39 0.668 -0.799 2.089 1.00 0.00 H new ATOM 0 HB3 PHE A 39 1.619 0.515 1.425 1.00 0.00 H new ATOM 0 HD1 PHE A 39 4.069 0.619 1.884 1.00 0.00 H new ATOM 0 HD2 PHE A 39 1.692 -2.720 3.001 1.00 0.00 H new ATOM 0 HE1 PHE A 39 6.094 -0.742 2.109 1.00 0.00 H new ATOM 0 HE2 PHE A 39 3.708 -4.089 3.226 1.00 0.00 H new ATOM 0 HZ PHE A 39 5.922 -3.100 2.792 1.00 0.00 H new ATOM 605 N ALA A 40 0.104 2.872 3.309 1.00 0.00 N ATOM 606 CA ALA A 40 -1.008 3.796 3.140 1.00 0.00 C ATOM 607 C ALA A 40 -1.651 3.660 1.764 1.00 0.00 C ATOM 608 O ALA A 40 -1.068 3.090 0.843 1.00 0.00 O ATOM 609 CB ALA A 40 -0.541 5.224 3.362 1.00 0.00 C ATOM 0 H ALA A 40 1.004 3.325 3.469 1.00 0.00 H new ATOM 0 HA ALA A 40 -1.764 3.544 3.884 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -1.381 5.906 3.233 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -0.144 5.324 4.372 1.00 0.00 H new ATOM 0 HB3 ALA A 40 0.239 5.468 2.640 1.00 0.00 H new ATOM 615 N GLY A 41 -2.846 4.210 1.629 1.00 0.00 N ATOM 616 CA GLY A 41 -3.594 4.087 0.400 1.00 0.00 C ATOM 617 C GLY A 41 -5.070 4.274 0.648 1.00 0.00 C ATOM 618 O GLY A 41 -5.465 5.191 1.369 1.00 0.00 O ATOM 0 H GLY A 41 -3.315 4.746 2.359 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -3.245 4.828 -0.319 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -3.417 3.107 -0.042 1.00 0.00 H new ATOM 622 N GLY A 42 -5.878 3.390 0.088 1.00 0.00 N ATOM 623 CA GLY A 42 -7.310 3.490 0.270 1.00 0.00 C ATOM 624 C GLY A 42 -8.086 2.711 -0.766 1.00 0.00 C ATOM 625 O GLY A 42 -7.501 2.077 -1.647 1.00 0.00 O ATOM 0 H GLY A 42 -5.570 2.607 -0.488 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -7.572 3.126 1.263 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -7.605 4.538 0.226 1.00 0.00 H new ATOM 629 N LYS A 43 -9.404 2.748 -0.651 1.00 0.00 N ATOM 630 CA LYS A 43 -10.270 2.064 -1.595 1.00 0.00 C ATOM 631 C LYS A 43 -10.389 2.864 -2.885 1.00 0.00 C ATOM 632 O LYS A 43 -10.307 4.091 -2.878 1.00 0.00 O ATOM 633 CB LYS A 43 -11.661 1.843 -0.996 1.00 0.00 C ATOM 634 CG LYS A 43 -12.626 1.167 -1.960 1.00 0.00 C ATOM 635 CD LYS A 43 -14.040 1.132 -1.418 1.00 0.00 C ATOM 636 CE LYS A 43 -15.019 0.613 -2.458 1.00 0.00 C ATOM 637 NZ LYS A 43 -15.015 1.442 -3.693 1.00 0.00 N ATOM 0 H LYS A 43 -9.898 3.246 0.090 1.00 0.00 H new ATOM 0 HA LYS A 43 -9.825 1.094 -1.816 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -11.570 1.235 -0.096 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -12.075 2.804 -0.691 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -12.616 1.696 -2.913 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -12.288 0.150 -2.157 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -14.076 0.497 -0.533 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -14.336 2.133 -1.105 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -14.766 -0.416 -2.712 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -16.023 0.599 -2.035 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -15.889 1.269 -4.230 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -14.960 2.448 -3.436 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -14.193 1.189 -4.278 1.00 0.00 H new ATOM 651 N VAL A 44 -10.602 2.159 -3.982 1.00 0.00 N ATOM 652 CA VAL A 44 -10.768 2.786 -5.278 1.00 0.00 C ATOM 653 C VAL A 44 -12.247 2.885 -5.612 1.00 0.00 C ATOM 654 O VAL A 44 -12.970 1.884 -5.540 1.00 0.00 O ATOM 655 CB VAL A 44 -10.064 1.977 -6.388 1.00 0.00 C ATOM 656 CG1 VAL A 44 -10.213 2.659 -7.740 1.00 0.00 C ATOM 657 CG2 VAL A 44 -8.599 1.764 -6.056 1.00 0.00 C ATOM 0 H VAL A 44 -10.664 1.141 -3.998 1.00 0.00 H new ATOM 0 HA VAL A 44 -10.320 3.778 -5.228 1.00 0.00 H new ATOM 0 HB VAL A 44 -10.547 1.001 -6.446 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -9.708 2.068 -8.504 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -11.271 2.746 -7.989 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -9.768 3.653 -7.697 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -8.125 1.191 -6.853 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -8.104 2.730 -5.959 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -8.515 1.217 -5.117 1.00 0.00 H new ATOM 667 N GLU A 45 -12.704 4.081 -5.933 1.00 0.00 N ATOM 668 CA GLU A 45 -14.052 4.259 -6.438 1.00 0.00 C ATOM 669 C GLU A 45 -14.059 4.018 -7.943 1.00 0.00 C ATOM 670 O GLU A 45 -13.100 4.362 -8.629 1.00 0.00 O ATOM 671 CB GLU A 45 -14.569 5.662 -6.117 1.00 0.00 C ATOM 672 CG GLU A 45 -14.800 5.895 -4.633 1.00 0.00 C ATOM 673 CD GLU A 45 -15.861 4.976 -4.063 1.00 0.00 C ATOM 674 OE1 GLU A 45 -17.062 5.248 -4.270 1.00 0.00 O ATOM 675 OE2 GLU A 45 -15.508 3.978 -3.401 1.00 0.00 O ATOM 0 H GLU A 45 -12.163 4.942 -5.853 1.00 0.00 H new ATOM 0 HA GLU A 45 -14.714 3.541 -5.954 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -13.854 6.398 -6.486 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -15.503 5.828 -6.653 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -13.865 5.744 -4.094 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -15.096 6.932 -4.472 1.00 0.00 H new ATOM 682 N PRO A 46 -15.131 3.416 -8.478 1.00 0.00 N ATOM 683 CA PRO A 46 -15.218 3.069 -9.903 1.00 0.00 C ATOM 684 C PRO A 46 -14.987 4.267 -10.828 1.00 0.00 C ATOM 685 O PRO A 46 -14.508 4.111 -11.951 1.00 0.00 O ATOM 686 CB PRO A 46 -16.647 2.532 -10.070 1.00 0.00 C ATOM 687 CG PRO A 46 -17.376 2.923 -8.826 1.00 0.00 C ATOM 688 CD PRO A 46 -16.341 3.018 -7.744 1.00 0.00 C ATOM 0 HA PRO A 46 -14.445 2.351 -10.179 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -17.124 2.957 -10.953 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -16.646 1.450 -10.199 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -17.888 3.876 -8.959 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -18.137 2.185 -8.573 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -16.614 3.754 -6.987 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -16.206 2.067 -7.230 1.00 0.00 H new ATOM 696 N ASP A 47 -15.335 5.456 -10.351 1.00 0.00 N ATOM 697 CA ASP A 47 -15.178 6.675 -11.141 1.00 0.00 C ATOM 698 C ASP A 47 -13.714 7.069 -11.314 1.00 0.00 C ATOM 699 O ASP A 47 -13.339 7.664 -12.327 1.00 0.00 O ATOM 700 CB ASP A 47 -15.959 7.830 -10.506 1.00 0.00 C ATOM 701 CG ASP A 47 -15.937 9.085 -11.356 1.00 0.00 C ATOM 702 OD1 ASP A 47 -16.756 9.181 -12.296 1.00 0.00 O ATOM 703 OD2 ASP A 47 -15.113 9.983 -11.084 1.00 0.00 O ATOM 0 H ASP A 47 -15.728 5.604 -9.421 1.00 0.00 H new ATOM 0 HA ASP A 47 -15.581 6.466 -12.132 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -16.992 7.521 -10.347 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -15.538 8.052 -9.525 1.00 0.00 H new ATOM 708 N GLU A 48 -12.890 6.706 -10.354 1.00 0.00 N ATOM 709 CA GLU A 48 -11.502 7.155 -10.338 1.00 0.00 C ATOM 710 C GLU A 48 -10.549 6.045 -10.770 1.00 0.00 C ATOM 711 O GLU A 48 -10.906 4.865 -10.796 1.00 0.00 O ATOM 712 CB GLU A 48 -11.121 7.676 -8.948 1.00 0.00 C ATOM 713 CG GLU A 48 -11.097 6.608 -7.870 1.00 0.00 C ATOM 714 CD GLU A 48 -10.860 7.179 -6.489 1.00 0.00 C ATOM 715 OE1 GLU A 48 -10.238 8.260 -6.385 1.00 0.00 O ATOM 716 OE2 GLU A 48 -11.292 6.545 -5.503 1.00 0.00 O ATOM 0 H GLU A 48 -13.150 6.103 -9.574 1.00 0.00 H new ATOM 0 HA GLU A 48 -11.411 7.970 -11.056 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -10.137 8.143 -9.004 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -11.827 8.454 -8.658 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -12.044 6.068 -7.878 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -10.315 5.884 -8.099 1.00 0.00 H new ATOM 723 N SER A 49 -9.333 6.443 -11.113 1.00 0.00 N ATOM 724 CA SER A 49 -8.332 5.517 -11.611 1.00 0.00 C ATOM 725 C SER A 49 -7.389 5.046 -10.496 1.00 0.00 C ATOM 726 O SER A 49 -7.363 5.623 -9.407 1.00 0.00 O ATOM 727 CB SER A 49 -7.546 6.185 -12.740 1.00 0.00 C ATOM 728 OG SER A 49 -8.416 6.611 -13.780 1.00 0.00 O ATOM 0 H SER A 49 -9.016 7.411 -11.054 1.00 0.00 H new ATOM 0 HA SER A 49 -8.839 4.631 -11.994 1.00 0.00 H new ATOM 0 HB2 SER A 49 -6.995 7.040 -12.348 1.00 0.00 H new ATOM 0 HB3 SER A 49 -6.810 5.487 -13.139 1.00 0.00 H new ATOM 0 HG SER A 49 -7.892 7.037 -14.491 1.00 0.00 H new ATOM 734 N GLN A 50 -6.609 4.001 -10.790 1.00 0.00 N ATOM 735 CA GLN A 50 -5.701 3.391 -9.813 1.00 0.00 C ATOM 736 C GLN A 50 -4.705 4.398 -9.248 1.00 0.00 C ATOM 737 O GLN A 50 -4.640 4.599 -8.034 1.00 0.00 O ATOM 738 CB GLN A 50 -4.941 2.219 -10.442 1.00 0.00 C ATOM 739 CG GLN A 50 -5.787 0.973 -10.636 1.00 0.00 C ATOM 740 CD GLN A 50 -5.006 -0.167 -11.263 1.00 0.00 C ATOM 741 OE1 GLN A 50 -4.370 -0.958 -10.563 1.00 0.00 O ATOM 742 NE2 GLN A 50 -5.057 -0.265 -12.581 1.00 0.00 N ATOM 0 H GLN A 50 -6.589 3.556 -11.707 1.00 0.00 H new ATOM 0 HA GLN A 50 -6.318 3.029 -8.991 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -4.545 2.532 -11.408 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -4.087 1.972 -9.812 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -6.182 0.652 -9.672 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -6.643 1.213 -11.267 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -5.596 0.411 -13.122 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -4.558 -1.017 -13.056 1.00 0.00 H new ATOM 751 N ARG A 51 -3.935 5.036 -10.126 1.00 0.00 N ATOM 752 CA ARG A 51 -2.938 6.012 -9.691 1.00 0.00 C ATOM 753 C ARG A 51 -3.633 7.214 -9.074 1.00 0.00 C ATOM 754 O ARG A 51 -3.107 7.859 -8.173 1.00 0.00 O ATOM 755 CB ARG A 51 -2.067 6.490 -10.859 1.00 0.00 C ATOM 756 CG ARG A 51 -1.361 5.382 -11.626 1.00 0.00 C ATOM 757 CD ARG A 51 -0.424 5.970 -12.673 1.00 0.00 C ATOM 758 NE ARG A 51 0.167 4.953 -13.542 1.00 0.00 N ATOM 759 CZ ARG A 51 1.300 5.130 -14.224 1.00 0.00 C ATOM 760 NH1 ARG A 51 2.005 6.247 -14.078 1.00 0.00 N ATOM 761 NH2 ARG A 51 1.735 4.183 -15.041 1.00 0.00 N ATOM 0 H ARG A 51 -3.981 4.897 -11.135 1.00 0.00 H new ATOM 0 HA ARG A 51 -2.296 5.524 -8.958 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -2.692 7.052 -11.553 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -1.317 7.181 -10.475 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -0.796 4.756 -10.935 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -2.098 4.740 -12.109 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -0.973 6.687 -13.283 1.00 0.00 H new ATOM 0 HD3 ARG A 51 0.372 6.521 -12.172 1.00 0.00 H new ATOM 0 HE ARG A 51 -0.314 4.058 -13.632 1.00 0.00 H new ATOM 0 HH11 ARG A 51 1.681 6.975 -13.442 1.00 0.00 H new ATOM 0 HH12 ARG A 51 2.870 6.376 -14.602 1.00 0.00 H new ATOM 0 HH21 ARG A 51 1.204 3.319 -15.149 1.00 0.00 H new ATOM 0 HH22 ARG A 51 2.601 4.318 -15.563 1.00 0.00 H new ATOM 775 N GLN A 52 -4.848 7.466 -9.535 1.00 0.00 N ATOM 776 CA GLN A 52 -5.591 8.657 -9.166 1.00 0.00 C ATOM 777 C GLN A 52 -6.051 8.568 -7.715 1.00 0.00 C ATOM 778 O GLN A 52 -5.942 9.536 -6.957 1.00 0.00 O ATOM 779 CB GLN A 52 -6.781 8.803 -10.120 1.00 0.00 C ATOM 780 CG GLN A 52 -7.658 10.013 -9.867 1.00 0.00 C ATOM 781 CD GLN A 52 -8.699 10.193 -10.955 1.00 0.00 C ATOM 782 OE1 GLN A 52 -9.152 9.222 -11.561 1.00 0.00 O ATOM 783 NE2 GLN A 52 -9.076 11.433 -11.221 1.00 0.00 N ATOM 0 H GLN A 52 -5.346 6.849 -10.176 1.00 0.00 H new ATOM 0 HA GLN A 52 -4.954 9.538 -9.250 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -6.405 8.853 -11.142 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -7.396 7.906 -10.050 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -8.155 9.906 -8.903 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -7.036 10.906 -9.808 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -8.677 12.211 -10.696 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -9.766 11.611 -11.951 1.00 0.00 H new ATOM 792 N ALA A 53 -6.548 7.397 -7.331 1.00 0.00 N ATOM 793 CA ALA A 53 -6.970 7.151 -5.960 1.00 0.00 C ATOM 794 C ALA A 53 -5.804 7.322 -4.994 1.00 0.00 C ATOM 795 O ALA A 53 -5.922 8.010 -3.986 1.00 0.00 O ATOM 796 CB ALA A 53 -7.572 5.761 -5.829 1.00 0.00 C ATOM 0 H ALA A 53 -6.668 6.600 -7.956 1.00 0.00 H new ATOM 0 HA ALA A 53 -7.734 7.885 -5.703 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -7.882 5.594 -4.797 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -8.437 5.676 -6.486 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -6.829 5.015 -6.110 1.00 0.00 H new ATOM 802 N LEU A 54 -4.665 6.723 -5.325 1.00 0.00 N ATOM 803 CA LEU A 54 -3.488 6.801 -4.467 1.00 0.00 C ATOM 804 C LEU A 54 -3.022 8.239 -4.299 1.00 0.00 C ATOM 805 O LEU A 54 -2.706 8.671 -3.194 1.00 0.00 O ATOM 806 CB LEU A 54 -2.346 5.958 -5.032 1.00 0.00 C ATOM 807 CG LEU A 54 -2.477 4.455 -4.805 1.00 0.00 C ATOM 808 CD1 LEU A 54 -1.301 3.722 -5.425 1.00 0.00 C ATOM 809 CD2 LEU A 54 -2.572 4.157 -3.318 1.00 0.00 C ATOM 0 H LEU A 54 -4.532 6.180 -6.178 1.00 0.00 H new ATOM 0 HA LEU A 54 -3.773 6.409 -3.491 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -2.274 6.143 -6.104 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -1.410 6.297 -4.587 1.00 0.00 H new ATOM 0 HG LEU A 54 -3.390 4.105 -5.287 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -1.409 2.651 -5.255 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -1.274 3.918 -6.497 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -0.374 4.070 -4.969 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -2.665 3.081 -3.168 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -1.674 4.517 -2.817 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -3.446 4.659 -2.901 1.00 0.00 H new ATOM 821 N VAL A 55 -3.010 8.979 -5.393 1.00 0.00 N ATOM 822 CA VAL A 55 -2.534 10.354 -5.374 1.00 0.00 C ATOM 823 C VAL A 55 -3.393 11.219 -4.453 1.00 0.00 C ATOM 824 O VAL A 55 -2.865 12.011 -3.672 1.00 0.00 O ATOM 825 CB VAL A 55 -2.492 10.970 -6.790 1.00 0.00 C ATOM 826 CG1 VAL A 55 -2.217 12.466 -6.729 1.00 0.00 C ATOM 827 CG2 VAL A 55 -1.434 10.276 -7.633 1.00 0.00 C ATOM 0 H VAL A 55 -3.324 8.653 -6.307 1.00 0.00 H new ATOM 0 HA VAL A 55 -1.515 10.330 -4.988 1.00 0.00 H new ATOM 0 HB VAL A 55 -3.468 10.823 -7.252 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -2.193 12.873 -7.740 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -3.005 12.958 -6.158 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -1.256 12.640 -6.245 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -1.414 10.719 -8.629 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -0.458 10.396 -7.163 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -1.671 9.215 -7.713 1.00 0.00 H new ATOM 837 N ARG A 56 -4.712 11.055 -4.520 1.00 0.00 N ATOM 838 CA ARG A 56 -5.594 11.836 -3.660 1.00 0.00 C ATOM 839 C ARG A 56 -5.526 11.340 -2.216 1.00 0.00 C ATOM 840 O ARG A 56 -5.424 12.143 -1.291 1.00 0.00 O ATOM 841 CB ARG A 56 -7.046 11.827 -4.164 1.00 0.00 C ATOM 842 CG ARG A 56 -7.701 10.457 -4.190 1.00 0.00 C ATOM 843 CD ARG A 56 -9.188 10.549 -3.894 1.00 0.00 C ATOM 844 NE ARG A 56 -9.838 9.242 -3.959 1.00 0.00 N ATOM 845 CZ ARG A 56 -10.260 8.572 -2.890 1.00 0.00 C ATOM 846 NH1 ARG A 56 -10.127 9.099 -1.679 1.00 0.00 N ATOM 847 NH2 ARG A 56 -10.820 7.377 -3.033 1.00 0.00 N ATOM 0 H ARG A 56 -5.185 10.403 -5.146 1.00 0.00 H new ATOM 0 HA ARG A 56 -5.242 12.867 -3.693 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -7.640 12.486 -3.531 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -7.069 12.245 -5.170 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -7.551 9.998 -5.167 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -7.222 9.809 -3.456 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -9.335 10.979 -2.903 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -9.659 11.225 -4.608 1.00 0.00 H new ATOM 0 HE ARG A 56 -9.976 8.819 -4.877 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -9.701 10.019 -1.567 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -10.451 8.584 -0.860 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -10.927 6.972 -3.963 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -11.143 6.864 -2.213 1.00 0.00 H new ATOM 861 N GLU A 57 -5.557 10.023 -2.026 1.00 0.00 N ATOM 862 CA GLU A 57 -5.532 9.438 -0.686 1.00 0.00 C ATOM 863 C GLU A 57 -4.290 9.865 0.088 1.00 0.00 C ATOM 864 O GLU A 57 -4.380 10.272 1.245 1.00 0.00 O ATOM 865 CB GLU A 57 -5.594 7.910 -0.758 1.00 0.00 C ATOM 866 CG GLU A 57 -6.968 7.367 -1.118 1.00 0.00 C ATOM 867 CD GLU A 57 -7.971 7.511 0.009 1.00 0.00 C ATOM 868 OE1 GLU A 57 -8.276 8.653 0.404 1.00 0.00 O ATOM 869 OE2 GLU A 57 -8.468 6.478 0.508 1.00 0.00 O ATOM 0 H GLU A 57 -5.599 9.340 -2.782 1.00 0.00 H new ATOM 0 HA GLU A 57 -6.411 9.807 -0.157 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -4.871 7.561 -1.495 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -5.292 7.498 0.205 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -7.341 7.890 -1.999 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -6.879 6.314 -1.386 1.00 0.00 H new ATOM 876 N LEU A 58 -3.130 9.785 -0.552 1.00 0.00 N ATOM 877 CA LEU A 58 -1.888 10.166 0.108 1.00 0.00 C ATOM 878 C LEU A 58 -1.853 11.671 0.327 1.00 0.00 C ATOM 879 O LEU A 58 -1.220 12.151 1.254 1.00 0.00 O ATOM 880 CB LEU A 58 -0.662 9.732 -0.693 1.00 0.00 C ATOM 881 CG LEU A 58 -0.656 8.276 -1.172 1.00 0.00 C ATOM 882 CD1 LEU A 58 0.661 7.946 -1.857 1.00 0.00 C ATOM 883 CD2 LEU A 58 -0.917 7.320 -0.020 1.00 0.00 C ATOM 0 H LEU A 58 -3.023 9.464 -1.514 1.00 0.00 H new ATOM 0 HA LEU A 58 -1.857 9.654 1.070 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -0.573 10.381 -1.564 1.00 0.00 H new ATOM 0 HB3 LEU A 58 0.225 9.896 -0.081 1.00 0.00 H new ATOM 0 HG LEU A 58 -1.462 8.155 -1.896 1.00 0.00 H new ATOM 0 HD11 LEU A 58 0.648 6.908 -2.191 1.00 0.00 H new ATOM 0 HD12 LEU A 58 0.798 8.602 -2.717 1.00 0.00 H new ATOM 0 HD13 LEU A 58 1.482 8.091 -1.155 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -0.907 6.294 -0.389 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -0.141 7.441 0.736 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -1.890 7.538 0.420 1.00 0.00 H new ATOM 895 N ARG A 59 -2.519 12.420 -0.540 1.00 0.00 N ATOM 896 CA ARG A 59 -2.653 13.857 -0.343 1.00 0.00 C ATOM 897 C ARG A 59 -3.474 14.160 0.908 1.00 0.00 C ATOM 898 O ARG A 59 -3.185 15.108 1.638 1.00 0.00 O ATOM 899 CB ARG A 59 -3.296 14.507 -1.568 1.00 0.00 C ATOM 900 CG ARG A 59 -3.551 15.995 -1.406 1.00 0.00 C ATOM 901 CD ARG A 59 -4.048 16.612 -2.702 1.00 0.00 C ATOM 902 NE ARG A 59 -4.301 18.048 -2.569 1.00 0.00 N ATOM 903 CZ ARG A 59 -3.832 18.966 -3.413 1.00 0.00 C ATOM 904 NH1 ARG A 59 -3.031 18.605 -4.409 1.00 0.00 N ATOM 905 NH2 ARG A 59 -4.152 20.245 -3.257 1.00 0.00 N ATOM 0 H ARG A 59 -2.972 12.061 -1.380 1.00 0.00 H new ATOM 0 HA ARG A 59 -1.655 14.275 -0.208 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -2.651 14.350 -2.432 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -4.241 14.006 -1.780 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -4.286 16.157 -0.618 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -2.633 16.492 -1.092 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -3.311 16.446 -3.488 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -4.964 16.111 -3.013 1.00 0.00 H new ATOM 0 HE ARG A 59 -4.870 18.364 -1.784 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -2.775 17.625 -4.528 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -2.672 19.308 -5.055 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -4.759 20.529 -2.488 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -3.790 20.944 -3.906 1.00 0.00 H new ATOM 919 N GLU A 60 -4.486 13.342 1.161 1.00 0.00 N ATOM 920 CA GLU A 60 -5.364 13.562 2.298 1.00 0.00 C ATOM 921 C GLU A 60 -4.759 13.002 3.581 1.00 0.00 C ATOM 922 O GLU A 60 -4.770 13.665 4.621 1.00 0.00 O ATOM 923 CB GLU A 60 -6.742 12.942 2.051 1.00 0.00 C ATOM 924 CG GLU A 60 -7.411 13.432 0.776 1.00 0.00 C ATOM 925 CD GLU A 60 -8.889 13.097 0.717 1.00 0.00 C ATOM 926 OE1 GLU A 60 -9.660 13.659 1.529 1.00 0.00 O ATOM 927 OE2 GLU A 60 -9.293 12.293 -0.146 1.00 0.00 O ATOM 0 H GLU A 60 -4.717 12.524 0.597 1.00 0.00 H new ATOM 0 HA GLU A 60 -5.482 14.639 2.417 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -6.640 11.858 2.004 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -7.389 13.165 2.900 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -7.285 14.512 0.698 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -6.909 12.990 -0.084 1.00 0.00 H new ATOM 934 N GLU A 61 -4.210 11.798 3.501 1.00 0.00 N ATOM 935 CA GLU A 61 -3.691 11.118 4.683 1.00 0.00 C ATOM 936 C GLU A 61 -2.222 11.401 4.923 1.00 0.00 C ATOM 937 O GLU A 61 -1.789 11.477 6.071 1.00 0.00 O ATOM 938 CB GLU A 61 -3.885 9.611 4.576 1.00 0.00 C ATOM 939 CG GLU A 61 -5.319 9.189 4.717 1.00 0.00 C ATOM 940 CD GLU A 61 -5.860 9.562 6.078 1.00 0.00 C ATOM 941 OE1 GLU A 61 -5.105 9.435 7.065 1.00 0.00 O ATOM 942 OE2 GLU A 61 -7.020 10.011 6.168 1.00 0.00 O ATOM 0 H GLU A 61 -4.112 11.272 2.633 1.00 0.00 H new ATOM 0 HA GLU A 61 -4.259 11.511 5.526 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -3.505 9.270 3.613 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -3.291 9.119 5.346 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -5.920 9.663 3.940 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -5.401 8.112 4.571 1.00 0.00 H new ATOM 949 N LEU A 62 -1.449 11.518 3.855 1.00 0.00 N ATOM 950 CA LEU A 62 -0.008 11.671 3.994 1.00 0.00 C ATOM 951 C LEU A 62 0.470 13.068 3.608 1.00 0.00 C ATOM 952 O LEU A 62 1.669 13.336 3.629 1.00 0.00 O ATOM 953 CB LEU A 62 0.718 10.627 3.151 1.00 0.00 C ATOM 954 CG LEU A 62 0.361 9.172 3.456 1.00 0.00 C ATOM 955 CD1 LEU A 62 1.228 8.244 2.625 1.00 0.00 C ATOM 956 CD2 LEU A 62 0.529 8.870 4.939 1.00 0.00 C ATOM 0 H LEU A 62 -1.789 11.510 2.893 1.00 0.00 H new ATOM 0 HA LEU A 62 0.227 11.524 5.048 1.00 0.00 H new ATOM 0 HB2 LEU A 62 0.506 10.822 2.100 1.00 0.00 H new ATOM 0 HB3 LEU A 62 1.791 10.756 3.289 1.00 0.00 H new ATOM 0 HG LEU A 62 -0.685 9.010 3.197 1.00 0.00 H new ATOM 0 HD11 LEU A 62 0.969 7.209 2.847 1.00 0.00 H new ATOM 0 HD12 LEU A 62 1.061 8.441 1.566 1.00 0.00 H new ATOM 0 HD13 LEU A 62 2.278 8.415 2.865 1.00 0.00 H new ATOM 0 HD21 LEU A 62 0.269 7.829 5.130 1.00 0.00 H new ATOM 0 HD22 LEU A 62 1.565 9.045 5.231 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -0.126 9.520 5.519 1.00 0.00 H new ATOM 968 N GLY A 63 -0.461 13.964 3.283 1.00 0.00 N ATOM 969 CA GLY A 63 -0.099 15.316 2.889 1.00 0.00 C ATOM 970 C GLY A 63 0.875 15.405 1.721 1.00 0.00 C ATOM 971 O GLY A 63 1.541 16.427 1.558 1.00 0.00 O ATOM 0 H GLY A 63 -1.464 13.776 3.286 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -1.008 15.858 2.627 1.00 0.00 H new ATOM 0 HA3 GLY A 63 0.339 15.824 3.748 1.00 0.00 H new ATOM 975 N ILE A 64 0.964 14.365 0.900 1.00 0.00 N ATOM 976 CA ILE A 64 1.892 14.387 -0.226 1.00 0.00 C ATOM 977 C ILE A 64 1.179 14.163 -1.550 1.00 0.00 C ATOM 978 O ILE A 64 0.211 13.406 -1.635 1.00 0.00 O ATOM 979 CB ILE A 64 3.026 13.340 -0.097 1.00 0.00 C ATOM 980 CG1 ILE A 64 2.467 11.922 0.051 1.00 0.00 C ATOM 981 CG2 ILE A 64 3.942 13.673 1.066 1.00 0.00 C ATOM 982 CD1 ILE A 64 3.541 10.855 0.085 1.00 0.00 C ATOM 0 H ILE A 64 0.416 13.510 0.989 1.00 0.00 H new ATOM 0 HA ILE A 64 2.335 15.383 -0.207 1.00 0.00 H new ATOM 0 HB ILE A 64 3.609 13.376 -1.018 1.00 0.00 H new ATOM 0 HG12 ILE A 64 1.879 11.865 0.967 1.00 0.00 H new ATOM 0 HG13 ILE A 64 1.788 11.718 -0.777 1.00 0.00 H new ATOM 0 HG21 ILE A 64 4.730 12.923 1.135 1.00 0.00 H new ATOM 0 HG22 ILE A 64 4.389 14.655 0.908 1.00 0.00 H new ATOM 0 HG23 ILE A 64 3.367 13.681 1.992 1.00 0.00 H new ATOM 0 HD11 ILE A 64 3.077 9.875 0.191 1.00 0.00 H new ATOM 0 HD12 ILE A 64 4.114 10.886 -0.841 1.00 0.00 H new ATOM 0 HD13 ILE A 64 4.206 11.035 0.930 1.00 0.00 H new ATOM 994 N GLU A 65 1.666 14.835 -2.579 1.00 0.00 N ATOM 995 CA GLU A 65 1.191 14.619 -3.932 1.00 0.00 C ATOM 996 C GLU A 65 2.074 13.569 -4.582 1.00 0.00 C ATOM 997 O GLU A 65 3.143 13.886 -5.101 1.00 0.00 O ATOM 998 CB GLU A 65 1.254 15.912 -4.745 1.00 0.00 C ATOM 999 CG GLU A 65 0.568 17.096 -4.086 1.00 0.00 C ATOM 1000 CD GLU A 65 0.854 18.393 -4.813 1.00 0.00 C ATOM 1001 OE1 GLU A 65 1.879 19.035 -4.502 1.00 0.00 O ATOM 1002 OE2 GLU A 65 0.067 18.765 -5.706 1.00 0.00 O ATOM 0 H GLU A 65 2.398 15.541 -2.500 1.00 0.00 H new ATOM 0 HA GLU A 65 0.153 14.288 -3.903 1.00 0.00 H new ATOM 0 HB2 GLU A 65 2.299 16.165 -4.923 1.00 0.00 H new ATOM 0 HB3 GLU A 65 0.797 15.738 -5.719 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -0.508 16.924 -4.061 1.00 0.00 H new ATOM 0 HG3 GLU A 65 0.902 17.179 -3.052 1.00 0.00 H new ATOM 1009 N ALA A 66 1.653 12.324 -4.515 1.00 0.00 N ATOM 1010 CA ALA A 66 2.485 11.223 -4.967 1.00 0.00 C ATOM 1011 C ALA A 66 2.470 11.084 -6.481 1.00 0.00 C ATOM 1012 O ALA A 66 1.487 11.418 -7.139 1.00 0.00 O ATOM 1013 CB ALA A 66 2.038 9.924 -4.322 1.00 0.00 C ATOM 0 H ALA A 66 0.741 12.046 -4.153 1.00 0.00 H new ATOM 0 HA ALA A 66 3.509 11.444 -4.664 1.00 0.00 H new ATOM 0 HB1 ALA A 66 2.671 9.108 -4.671 1.00 0.00 H new ATOM 0 HB2 ALA A 66 2.119 10.009 -3.238 1.00 0.00 H new ATOM 0 HB3 ALA A 66 1.002 9.721 -4.593 1.00 0.00 H new ATOM 1019 N THR A 67 3.571 10.590 -7.016 1.00 0.00 N ATOM 1020 CA THR A 67 3.661 10.252 -8.418 1.00 0.00 C ATOM 1021 C THR A 67 3.716 8.735 -8.539 1.00 0.00 C ATOM 1022 O THR A 67 4.740 8.119 -8.240 1.00 0.00 O ATOM 1023 CB THR A 67 4.915 10.875 -9.074 1.00 0.00 C ATOM 1024 OG1 THR A 67 4.922 12.298 -8.876 1.00 0.00 O ATOM 1025 CG2 THR A 67 4.957 10.571 -10.566 1.00 0.00 C ATOM 0 H THR A 67 4.426 10.413 -6.488 1.00 0.00 H new ATOM 0 HA THR A 67 2.789 10.651 -8.936 1.00 0.00 H new ATOM 0 HB THR A 67 5.795 10.437 -8.602 1.00 0.00 H new ATOM 0 HG1 THR A 67 5.803 12.579 -8.551 1.00 0.00 H new ATOM 0 HG21 THR A 67 5.848 11.020 -11.004 1.00 0.00 H new ATOM 0 HG22 THR A 67 4.983 9.492 -10.717 1.00 0.00 H new ATOM 0 HG23 THR A 67 4.070 10.983 -11.046 1.00 0.00 H new ATOM 1033 N VAL A 68 2.608 8.133 -8.935 1.00 0.00 N ATOM 1034 CA VAL A 68 2.513 6.685 -8.983 1.00 0.00 C ATOM 1035 C VAL A 68 3.059 6.159 -10.301 1.00 0.00 C ATOM 1036 O VAL A 68 2.756 6.698 -11.361 1.00 0.00 O ATOM 1037 CB VAL A 68 1.057 6.202 -8.813 1.00 0.00 C ATOM 1038 CG1 VAL A 68 1.005 4.683 -8.741 1.00 0.00 C ATOM 1039 CG2 VAL A 68 0.422 6.822 -7.579 1.00 0.00 C ATOM 0 H VAL A 68 1.763 8.624 -9.227 1.00 0.00 H new ATOM 0 HA VAL A 68 3.107 6.298 -8.155 1.00 0.00 H new ATOM 0 HB VAL A 68 0.486 6.524 -9.684 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -0.029 4.360 -8.621 1.00 0.00 H new ATOM 0 HG12 VAL A 68 1.413 4.261 -9.659 1.00 0.00 H new ATOM 0 HG13 VAL A 68 1.594 4.339 -7.891 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -0.604 6.467 -7.480 1.00 0.00 H new ATOM 0 HG22 VAL A 68 0.992 6.537 -6.694 1.00 0.00 H new ATOM 0 HG23 VAL A 68 0.422 7.908 -7.676 1.00 0.00 H new ATOM 1049 N GLY A 69 3.868 5.112 -10.233 1.00 0.00 N ATOM 1050 CA GLY A 69 4.421 4.541 -11.439 1.00 0.00 C ATOM 1051 C GLY A 69 5.367 3.399 -11.159 1.00 0.00 C ATOM 1052 O GLY A 69 6.573 3.573 -11.289 1.00 0.00 O ATOM 0 H GLY A 69 4.149 4.651 -9.368 1.00 0.00 H new ATOM 0 HA2 GLY A 69 3.609 4.188 -12.075 1.00 0.00 H new ATOM 0 HA3 GLY A 69 4.948 5.316 -11.995 1.00 0.00 H new ATOM 1056 N GLU A 70 4.799 2.241 -10.794 1.00 0.00 N ATOM 1057 CA GLU A 70 5.528 0.992 -10.507 1.00 0.00 C ATOM 1058 C GLU A 70 4.555 -0.048 -9.961 1.00 0.00 C ATOM 1059 O GLU A 70 4.146 0.031 -8.801 1.00 0.00 O ATOM 1060 CB GLU A 70 6.645 1.154 -9.475 1.00 0.00 C ATOM 1061 CG GLU A 70 7.981 1.561 -10.049 1.00 0.00 C ATOM 1062 CD GLU A 70 8.410 0.690 -11.214 1.00 0.00 C ATOM 1063 OE1 GLU A 70 8.561 -0.537 -11.025 1.00 0.00 O ATOM 1064 OE2 GLU A 70 8.612 1.234 -12.323 1.00 0.00 O ATOM 0 H GLU A 70 3.790 2.142 -10.686 1.00 0.00 H new ATOM 0 HA GLU A 70 5.981 0.687 -11.450 1.00 0.00 H new ATOM 0 HB2 GLU A 70 6.338 1.899 -8.741 1.00 0.00 H new ATOM 0 HB3 GLU A 70 6.766 0.212 -8.940 1.00 0.00 H new ATOM 0 HG2 GLU A 70 7.929 2.599 -10.377 1.00 0.00 H new ATOM 0 HG3 GLU A 70 8.738 1.512 -9.266 1.00 0.00 H new ATOM 1071 N TYR A 71 4.174 -1.007 -10.787 1.00 0.00 N ATOM 1072 CA TYR A 71 3.300 -2.080 -10.332 1.00 0.00 C ATOM 1073 C TYR A 71 4.136 -3.172 -9.673 1.00 0.00 C ATOM 1074 O TYR A 71 4.950 -3.820 -10.331 1.00 0.00 O ATOM 1075 CB TYR A 71 2.489 -2.651 -11.499 1.00 0.00 C ATOM 1076 CG TYR A 71 1.409 -3.625 -11.075 1.00 0.00 C ATOM 1077 CD1 TYR A 71 0.251 -3.179 -10.452 1.00 0.00 C ATOM 1078 CD2 TYR A 71 1.547 -4.989 -11.299 1.00 0.00 C ATOM 1079 CE1 TYR A 71 -0.741 -4.061 -10.068 1.00 0.00 C ATOM 1080 CE2 TYR A 71 0.558 -5.879 -10.920 1.00 0.00 C ATOM 1081 CZ TYR A 71 -0.583 -5.409 -10.304 1.00 0.00 C ATOM 1082 OH TYR A 71 -1.572 -6.290 -9.926 1.00 0.00 O ATOM 0 H TYR A 71 4.451 -1.067 -11.767 1.00 0.00 H new ATOM 0 HA TYR A 71 2.597 -1.679 -9.602 1.00 0.00 H new ATOM 0 HB2 TYR A 71 2.029 -1.828 -12.046 1.00 0.00 H new ATOM 0 HB3 TYR A 71 3.167 -3.153 -12.189 1.00 0.00 H new ATOM 0 HD1 TYR A 71 0.123 -2.123 -10.264 1.00 0.00 H new ATOM 0 HD2 TYR A 71 2.441 -5.361 -11.777 1.00 0.00 H new ATOM 0 HE1 TYR A 71 -1.635 -3.696 -9.585 1.00 0.00 H new ATOM 0 HE2 TYR A 71 0.679 -6.936 -11.105 1.00 0.00 H new ATOM 0 HH TYR A 71 -1.574 -7.059 -10.533 1.00 0.00 H new ATOM 1092 N VAL A 72 3.956 -3.351 -8.370 1.00 0.00 N ATOM 1093 CA VAL A 72 4.756 -4.314 -7.622 1.00 0.00 C ATOM 1094 C VAL A 72 4.042 -5.653 -7.484 1.00 0.00 C ATOM 1095 O VAL A 72 4.432 -6.642 -8.104 1.00 0.00 O ATOM 1096 CB VAL A 72 5.087 -3.776 -6.214 1.00 0.00 C ATOM 1097 CG1 VAL A 72 5.809 -4.830 -5.380 1.00 0.00 C ATOM 1098 CG2 VAL A 72 5.913 -2.501 -6.313 1.00 0.00 C ATOM 0 H VAL A 72 3.268 -2.846 -7.812 1.00 0.00 H new ATOM 0 HA VAL A 72 5.678 -4.463 -8.185 1.00 0.00 H new ATOM 0 HB VAL A 72 4.150 -3.540 -5.710 1.00 0.00 H new ATOM 0 HG11 VAL A 72 6.030 -4.424 -4.393 1.00 0.00 H new ATOM 0 HG12 VAL A 72 5.174 -5.710 -5.277 1.00 0.00 H new ATOM 0 HG13 VAL A 72 6.739 -5.110 -5.874 1.00 0.00 H new ATOM 0 HG21 VAL A 72 6.138 -2.135 -5.311 1.00 0.00 H new ATOM 0 HG22 VAL A 72 6.844 -2.710 -6.840 1.00 0.00 H new ATOM 0 HG23 VAL A 72 5.350 -1.744 -6.858 1.00 0.00 H new ATOM 1108 N ALA A 73 2.984 -5.678 -6.688 1.00 0.00 N ATOM 1109 CA ALA A 73 2.254 -6.916 -6.459 1.00 0.00 C ATOM 1110 C ALA A 73 0.781 -6.653 -6.206 1.00 0.00 C ATOM 1111 O ALA A 73 0.365 -5.511 -6.019 1.00 0.00 O ATOM 1112 CB ALA A 73 2.858 -7.669 -5.282 1.00 0.00 C ATOM 0 H ALA A 73 2.615 -4.865 -6.195 1.00 0.00 H new ATOM 0 HA ALA A 73 2.337 -7.525 -7.359 1.00 0.00 H new ATOM 0 HB1 ALA A 73 2.304 -8.594 -5.119 1.00 0.00 H new ATOM 0 HB2 ALA A 73 3.901 -7.903 -5.496 1.00 0.00 H new ATOM 0 HB3 ALA A 73 2.802 -7.050 -4.387 1.00 0.00 H new ATOM 1118 N SER A 74 -0.007 -7.713 -6.214 1.00 0.00 N ATOM 1119 CA SER A 74 -1.415 -7.623 -5.890 1.00 0.00 C ATOM 1120 C SER A 74 -1.808 -8.784 -4.986 1.00 0.00 C ATOM 1121 O SER A 74 -1.298 -9.894 -5.139 1.00 0.00 O ATOM 1122 CB SER A 74 -2.249 -7.629 -7.169 1.00 0.00 C ATOM 1123 OG SER A 74 -1.860 -8.689 -8.029 1.00 0.00 O ATOM 0 H SER A 74 0.311 -8.654 -6.444 1.00 0.00 H new ATOM 0 HA SER A 74 -1.605 -6.688 -5.362 1.00 0.00 H new ATOM 0 HB2 SER A 74 -3.305 -7.730 -6.918 1.00 0.00 H new ATOM 0 HB3 SER A 74 -2.134 -6.676 -7.686 1.00 0.00 H new ATOM 0 HG SER A 74 -1.636 -8.328 -8.912 1.00 0.00 H new ATOM 1129 N HIS A 75 -2.699 -8.530 -4.046 1.00 0.00 N ATOM 1130 CA HIS A 75 -3.117 -9.558 -3.106 1.00 0.00 C ATOM 1131 C HIS A 75 -4.626 -9.536 -2.931 1.00 0.00 C ATOM 1132 O HIS A 75 -5.228 -8.471 -2.800 1.00 0.00 O ATOM 1133 CB HIS A 75 -2.420 -9.366 -1.755 1.00 0.00 C ATOM 1134 CG HIS A 75 -2.869 -10.332 -0.698 1.00 0.00 C ATOM 1135 ND1 HIS A 75 -2.529 -11.666 -0.702 1.00 0.00 N ATOM 1136 CD2 HIS A 75 -3.644 -10.147 0.396 1.00 0.00 C ATOM 1137 CE1 HIS A 75 -3.077 -12.261 0.342 1.00 0.00 C ATOM 1138 NE2 HIS A 75 -3.756 -11.360 1.023 1.00 0.00 N ATOM 0 H HIS A 75 -3.147 -7.624 -3.912 1.00 0.00 H new ATOM 0 HA HIS A 75 -2.829 -10.529 -3.508 1.00 0.00 H new ATOM 0 HB2 HIS A 75 -1.344 -9.469 -1.894 1.00 0.00 H new ATOM 0 HB3 HIS A 75 -2.600 -8.350 -1.405 1.00 0.00 H new ATOM 0 HD2 HIS A 75 -4.091 -9.217 0.715 1.00 0.00 H new ATOM 0 HE1 HIS A 75 -2.984 -13.307 0.594 1.00 0.00 H new ATOM 0 HE2 HIS A 75 -4.281 -11.537 1.880 1.00 0.00 H new ATOM 1147 N GLN A 76 -5.231 -10.710 -2.936 1.00 0.00 N ATOM 1148 CA GLN A 76 -6.659 -10.822 -2.721 1.00 0.00 C ATOM 1149 C GLN A 76 -6.961 -11.439 -1.370 1.00 0.00 C ATOM 1150 O GLN A 76 -6.219 -12.284 -0.870 1.00 0.00 O ATOM 1151 CB GLN A 76 -7.331 -11.628 -3.830 1.00 0.00 C ATOM 1152 CG GLN A 76 -7.454 -10.858 -5.129 1.00 0.00 C ATOM 1153 CD GLN A 76 -8.357 -11.545 -6.133 1.00 0.00 C ATOM 1154 OE1 GLN A 76 -9.558 -11.282 -6.182 1.00 0.00 O ATOM 1155 NE2 GLN A 76 -7.791 -12.426 -6.940 1.00 0.00 N ATOM 0 H GLN A 76 -4.754 -11.599 -3.087 1.00 0.00 H new ATOM 0 HA GLN A 76 -7.067 -9.812 -2.741 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -6.760 -12.539 -4.007 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -8.324 -11.933 -3.499 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -7.842 -9.861 -4.920 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -6.464 -10.730 -5.566 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -6.791 -12.616 -6.867 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -8.354 -12.916 -7.635 1.00 0.00 H new ATOM 1164 N ARG A 77 -8.043 -10.976 -0.782 1.00 0.00 N ATOM 1165 CA ARG A 77 -8.523 -11.472 0.495 1.00 0.00 C ATOM 1166 C ARG A 77 -9.979 -11.081 0.620 1.00 0.00 C ATOM 1167 O ARG A 77 -10.493 -10.395 -0.253 1.00 0.00 O ATOM 1168 CB ARG A 77 -7.707 -10.891 1.654 1.00 0.00 C ATOM 1169 CG ARG A 77 -7.822 -9.382 1.795 1.00 0.00 C ATOM 1170 CD ARG A 77 -6.940 -8.855 2.916 1.00 0.00 C ATOM 1171 NE ARG A 77 -7.269 -9.448 4.215 1.00 0.00 N ATOM 1172 CZ ARG A 77 -7.238 -8.780 5.367 1.00 0.00 C ATOM 1173 NH1 ARG A 77 -6.933 -7.486 5.381 1.00 0.00 N ATOM 1174 NH2 ARG A 77 -7.502 -9.410 6.506 1.00 0.00 N ATOM 0 H ARG A 77 -8.622 -10.236 -1.179 1.00 0.00 H new ATOM 0 HA ARG A 77 -8.413 -12.556 0.540 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -8.032 -11.358 2.584 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -6.658 -11.154 1.514 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -7.541 -8.906 0.856 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -8.860 -9.112 1.991 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -5.896 -9.061 2.680 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -7.045 -7.772 2.978 1.00 0.00 H new ATOM 0 HE ARG A 77 -7.538 -10.432 4.238 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -6.722 -7.002 4.508 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -6.910 -6.977 6.265 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -7.728 -10.405 6.498 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -7.478 -8.899 7.389 1.00 0.00 H new ATOM 1188 N GLU A 78 -10.657 -11.506 1.663 1.00 0.00 N ATOM 1189 CA GLU A 78 -12.050 -11.138 1.809 1.00 0.00 C ATOM 1190 C GLU A 78 -12.289 -10.347 3.089 1.00 0.00 C ATOM 1191 O GLU A 78 -11.576 -10.507 4.085 1.00 0.00 O ATOM 1192 CB GLU A 78 -12.961 -12.368 1.772 1.00 0.00 C ATOM 1193 CG GLU A 78 -12.952 -13.174 3.055 1.00 0.00 C ATOM 1194 CD GLU A 78 -14.011 -14.254 3.073 1.00 0.00 C ATOM 1195 OE1 GLU A 78 -15.150 -13.960 3.487 1.00 0.00 O ATOM 1196 OE2 GLU A 78 -13.706 -15.401 2.688 1.00 0.00 O ATOM 0 H GLU A 78 -10.279 -12.093 2.407 1.00 0.00 H new ATOM 0 HA GLU A 78 -12.299 -10.500 0.961 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -13.981 -12.047 1.563 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -12.654 -13.011 0.947 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -11.971 -13.631 3.186 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -13.107 -12.504 3.901 1.00 0.00 H new ATOM 1203 N VAL A 79 -13.288 -9.484 3.033 1.00 0.00 N ATOM 1204 CA VAL A 79 -13.763 -8.761 4.195 1.00 0.00 C ATOM 1205 C VAL A 79 -15.238 -9.097 4.413 1.00 0.00 C ATOM 1206 O VAL A 79 -16.125 -8.523 3.777 1.00 0.00 O ATOM 1207 CB VAL A 79 -13.560 -7.226 4.073 1.00 0.00 C ATOM 1208 CG1 VAL A 79 -14.093 -6.691 2.750 1.00 0.00 C ATOM 1209 CG2 VAL A 79 -14.204 -6.498 5.246 1.00 0.00 C ATOM 0 H VAL A 79 -13.794 -9.265 2.175 1.00 0.00 H new ATOM 0 HA VAL A 79 -13.172 -9.075 5.056 1.00 0.00 H new ATOM 0 HB VAL A 79 -12.487 -7.037 4.097 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -13.933 -5.614 2.702 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -13.569 -7.173 1.925 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -15.160 -6.903 2.675 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -14.048 -5.425 5.138 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -15.273 -6.710 5.263 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -13.752 -6.838 6.178 1.00 0.00 H new ATOM 1219 N SER A 80 -15.478 -10.073 5.280 1.00 0.00 N ATOM 1220 CA SER A 80 -16.825 -10.563 5.562 1.00 0.00 C ATOM 1221 C SER A 80 -17.609 -10.837 4.270 1.00 0.00 C ATOM 1222 O SER A 80 -18.570 -10.133 3.953 1.00 0.00 O ATOM 1223 CB SER A 80 -17.577 -9.563 6.445 1.00 0.00 C ATOM 1224 OG SER A 80 -16.866 -9.312 7.649 1.00 0.00 O ATOM 0 H SER A 80 -14.746 -10.548 5.808 1.00 0.00 H new ATOM 0 HA SER A 80 -16.732 -11.509 6.096 1.00 0.00 H new ATOM 0 HB2 SER A 80 -17.721 -8.629 5.902 1.00 0.00 H new ATOM 0 HB3 SER A 80 -18.568 -9.952 6.678 1.00 0.00 H new ATOM 0 HG SER A 80 -17.365 -8.669 8.196 1.00 0.00 H new ATOM 1230 N GLY A 81 -17.180 -11.846 3.512 1.00 0.00 N ATOM 1231 CA GLY A 81 -17.888 -12.228 2.300 1.00 0.00 C ATOM 1232 C GLY A 81 -17.488 -11.439 1.060 1.00 0.00 C ATOM 1233 O GLY A 81 -17.655 -11.926 -0.059 1.00 0.00 O ATOM 0 H GLY A 81 -16.353 -12.407 3.717 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -17.716 -13.288 2.112 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -18.958 -12.104 2.465 1.00 0.00 H new ATOM 1237 N ARG A 82 -16.958 -10.237 1.237 1.00 0.00 N ATOM 1238 CA ARG A 82 -16.589 -9.399 0.099 1.00 0.00 C ATOM 1239 C ARG A 82 -15.128 -9.619 -0.262 1.00 0.00 C ATOM 1240 O ARG A 82 -14.280 -9.679 0.616 1.00 0.00 O ATOM 1241 CB ARG A 82 -16.825 -7.922 0.415 1.00 0.00 C ATOM 1242 CG ARG A 82 -18.234 -7.616 0.887 1.00 0.00 C ATOM 1243 CD ARG A 82 -18.416 -6.133 1.162 1.00 0.00 C ATOM 1244 NE ARG A 82 -19.679 -5.852 1.841 1.00 0.00 N ATOM 1245 CZ ARG A 82 -20.301 -4.674 1.809 1.00 0.00 C ATOM 1246 NH1 ARG A 82 -19.790 -3.661 1.115 1.00 0.00 N ATOM 1247 NH2 ARG A 82 -21.436 -4.509 2.471 1.00 0.00 N ATOM 0 H ARG A 82 -16.774 -9.820 2.150 1.00 0.00 H new ATOM 0 HA ARG A 82 -17.215 -9.679 -0.748 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -16.118 -7.606 1.182 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -16.614 -7.331 -0.476 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -18.951 -7.938 0.131 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -18.448 -8.184 1.792 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -17.588 -5.774 1.773 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -18.380 -5.583 0.222 1.00 0.00 H new ATOM 0 HE ARG A 82 -20.112 -6.606 2.374 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -18.916 -3.783 0.603 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -20.272 -2.762 1.095 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -21.833 -5.283 3.004 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -21.914 -3.608 2.448 1.00 0.00 H new ATOM 1261 N ILE A 83 -14.829 -9.712 -1.546 1.00 0.00 N ATOM 1262 CA ILE A 83 -13.470 -10.015 -1.982 1.00 0.00 C ATOM 1263 C ILE A 83 -12.707 -8.731 -2.288 1.00 0.00 C ATOM 1264 O ILE A 83 -13.050 -7.994 -3.208 1.00 0.00 O ATOM 1265 CB ILE A 83 -13.446 -10.951 -3.221 1.00 0.00 C ATOM 1266 CG1 ILE A 83 -13.837 -12.387 -2.841 1.00 0.00 C ATOM 1267 CG2 ILE A 83 -12.069 -10.954 -3.874 1.00 0.00 C ATOM 1268 CD1 ILE A 83 -15.280 -12.560 -2.416 1.00 0.00 C ATOM 0 H ILE A 83 -15.501 -9.584 -2.303 1.00 0.00 H new ATOM 0 HA ILE A 83 -12.982 -10.540 -1.161 1.00 0.00 H new ATOM 0 HB ILE A 83 -14.177 -10.566 -3.932 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -13.643 -13.039 -3.693 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -13.191 -12.722 -2.029 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -12.078 -11.617 -4.739 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -11.816 -9.943 -4.194 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -11.327 -11.304 -3.157 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -15.463 -13.605 -2.167 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -15.479 -11.939 -1.543 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -15.938 -12.261 -3.232 1.00 0.00 H new ATOM 1280 N ILE A 84 -11.684 -8.461 -1.495 1.00 0.00 N ATOM 1281 CA ILE A 84 -10.853 -7.287 -1.691 1.00 0.00 C ATOM 1282 C ILE A 84 -9.676 -7.604 -2.599 1.00 0.00 C ATOM 1283 O ILE A 84 -9.041 -8.654 -2.479 1.00 0.00 O ATOM 1284 CB ILE A 84 -10.301 -6.709 -0.371 1.00 0.00 C ATOM 1285 CG1 ILE A 84 -10.897 -7.405 0.847 1.00 0.00 C ATOM 1286 CG2 ILE A 84 -10.581 -5.225 -0.283 1.00 0.00 C ATOM 1287 CD1 ILE A 84 -10.823 -6.553 2.094 1.00 0.00 C ATOM 0 H ILE A 84 -11.408 -9.044 -0.705 1.00 0.00 H new ATOM 0 HA ILE A 84 -11.503 -6.541 -2.148 1.00 0.00 H new ATOM 0 HB ILE A 84 -9.225 -6.882 -0.373 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -11.938 -7.657 0.644 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -10.370 -8.343 1.020 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -10.185 -4.835 0.654 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -10.104 -4.714 -1.119 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -11.657 -5.055 -0.321 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -11.261 -7.096 2.932 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -9.781 -6.322 2.316 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -11.374 -5.626 1.934 1.00 0.00 H new ATOM 1299 N HIS A 85 -9.392 -6.680 -3.493 1.00 0.00 N ATOM 1300 CA HIS A 85 -8.299 -6.814 -4.433 1.00 0.00 C ATOM 1301 C HIS A 85 -7.308 -5.679 -4.203 1.00 0.00 C ATOM 1302 O HIS A 85 -7.545 -4.547 -4.625 1.00 0.00 O ATOM 1303 CB HIS A 85 -8.844 -6.754 -5.864 1.00 0.00 C ATOM 1304 CG HIS A 85 -7.979 -7.421 -6.886 1.00 0.00 C ATOM 1305 ND1 HIS A 85 -8.393 -8.513 -7.618 1.00 0.00 N ATOM 1306 CD2 HIS A 85 -6.729 -7.135 -7.317 1.00 0.00 C ATOM 1307 CE1 HIS A 85 -7.437 -8.868 -8.452 1.00 0.00 C ATOM 1308 NE2 HIS A 85 -6.417 -8.048 -8.291 1.00 0.00 N ATOM 0 H HIS A 85 -9.916 -5.810 -3.588 1.00 0.00 H new ATOM 0 HA HIS A 85 -7.797 -7.770 -4.287 1.00 0.00 H new ATOM 0 HB2 HIS A 85 -9.830 -7.217 -5.883 1.00 0.00 H new ATOM 0 HB3 HIS A 85 -8.977 -5.709 -6.145 1.00 0.00 H new ATOM 0 HD2 HIS A 85 -6.095 -6.337 -6.960 1.00 0.00 H new ATOM 0 HE1 HIS A 85 -7.481 -9.691 -9.150 1.00 0.00 H new ATOM 0 HE2 HIS A 85 -5.538 -8.087 -8.807 1.00 0.00 H new ATOM 1317 N LEU A 86 -6.216 -5.971 -3.512 1.00 0.00 N ATOM 1318 CA LEU A 86 -5.236 -4.947 -3.182 1.00 0.00 C ATOM 1319 C LEU A 86 -4.174 -4.827 -4.268 1.00 0.00 C ATOM 1320 O LEU A 86 -3.589 -5.822 -4.695 1.00 0.00 O ATOM 1321 CB LEU A 86 -4.574 -5.223 -1.826 1.00 0.00 C ATOM 1322 CG LEU A 86 -5.433 -4.901 -0.599 1.00 0.00 C ATOM 1323 CD1 LEU A 86 -6.394 -6.036 -0.289 1.00 0.00 C ATOM 1324 CD2 LEU A 86 -4.551 -4.589 0.596 1.00 0.00 C ATOM 0 H LEU A 86 -5.987 -6.904 -3.170 1.00 0.00 H new ATOM 0 HA LEU A 86 -5.772 -4.000 -3.117 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -4.292 -6.275 -1.786 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -3.653 -4.644 -1.766 1.00 0.00 H new ATOM 0 HG LEU A 86 -6.031 -4.018 -0.823 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -6.990 -5.779 0.587 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -7.053 -6.198 -1.142 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -5.829 -6.947 -0.089 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -5.176 -4.362 1.460 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -3.922 -5.451 0.819 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -3.921 -3.729 0.368 1.00 0.00 H new ATOM 1336 N HIS A 87 -3.958 -3.600 -4.723 1.00 0.00 N ATOM 1337 CA HIS A 87 -2.956 -3.308 -5.741 1.00 0.00 C ATOM 1338 C HIS A 87 -1.803 -2.544 -5.106 1.00 0.00 C ATOM 1339 O HIS A 87 -1.983 -1.404 -4.679 1.00 0.00 O ATOM 1340 CB HIS A 87 -3.553 -2.444 -6.867 1.00 0.00 C ATOM 1341 CG HIS A 87 -4.785 -2.999 -7.523 1.00 0.00 C ATOM 1342 ND1 HIS A 87 -4.977 -2.992 -8.887 1.00 0.00 N ATOM 1343 CD2 HIS A 87 -5.913 -3.534 -6.996 1.00 0.00 C ATOM 1344 CE1 HIS A 87 -6.164 -3.495 -9.167 1.00 0.00 C ATOM 1345 NE2 HIS A 87 -6.752 -3.833 -8.039 1.00 0.00 N ATOM 0 H HIS A 87 -4.471 -2.780 -4.398 1.00 0.00 H new ATOM 0 HA HIS A 87 -2.609 -4.252 -6.161 1.00 0.00 H new ATOM 0 HB2 HIS A 87 -3.791 -1.461 -6.460 1.00 0.00 H new ATOM 0 HB3 HIS A 87 -2.790 -2.297 -7.632 1.00 0.00 H new ATOM 0 HD2 HIS A 87 -6.114 -3.695 -5.947 1.00 0.00 H new ATOM 0 HE1 HIS A 87 -6.583 -3.610 -10.156 1.00 0.00 H new ATOM 0 HE2 HIS A 87 -7.679 -4.249 -7.954 1.00 0.00 H new ATOM 1354 N ALA A 88 -0.631 -3.153 -5.036 1.00 0.00 N ATOM 1355 CA ALA A 88 0.525 -2.495 -4.440 1.00 0.00 C ATOM 1356 C ALA A 88 1.300 -1.714 -5.490 1.00 0.00 C ATOM 1357 O ALA A 88 1.980 -2.295 -6.342 1.00 0.00 O ATOM 1358 CB ALA A 88 1.434 -3.501 -3.747 1.00 0.00 C ATOM 0 H ALA A 88 -0.453 -4.096 -5.381 1.00 0.00 H new ATOM 0 HA ALA A 88 0.159 -1.796 -3.688 1.00 0.00 H new ATOM 0 HB1 ALA A 88 2.287 -2.981 -3.312 1.00 0.00 H new ATOM 0 HB2 ALA A 88 0.879 -4.010 -2.959 1.00 0.00 H new ATOM 0 HB3 ALA A 88 1.787 -4.233 -4.473 1.00 0.00 H new ATOM 1364 N TRP A 89 1.186 -0.401 -5.425 1.00 0.00 N ATOM 1365 CA TRP A 89 1.883 0.474 -6.347 1.00 0.00 C ATOM 1366 C TRP A 89 3.035 1.177 -5.644 1.00 0.00 C ATOM 1367 O TRP A 89 2.871 1.750 -4.567 1.00 0.00 O ATOM 1368 CB TRP A 89 0.931 1.512 -6.943 1.00 0.00 C ATOM 1369 CG TRP A 89 -0.028 0.956 -7.956 1.00 0.00 C ATOM 1370 CD1 TRP A 89 -1.260 0.416 -7.720 1.00 0.00 C ATOM 1371 CD2 TRP A 89 0.168 0.904 -9.374 1.00 0.00 C ATOM 1372 NE1 TRP A 89 -1.839 0.028 -8.906 1.00 0.00 N ATOM 1373 CE2 TRP A 89 -0.981 0.315 -9.934 1.00 0.00 C ATOM 1374 CE3 TRP A 89 1.207 1.296 -10.226 1.00 0.00 C ATOM 1375 CZ2 TRP A 89 -1.120 0.111 -11.305 1.00 0.00 C ATOM 1376 CZ3 TRP A 89 1.067 1.091 -11.585 1.00 0.00 C ATOM 1377 CH2 TRP A 89 -0.088 0.504 -12.114 1.00 0.00 C ATOM 0 H TRP A 89 0.612 0.086 -4.737 1.00 0.00 H new ATOM 0 HA TRP A 89 2.279 -0.140 -7.156 1.00 0.00 H new ATOM 0 HB2 TRP A 89 0.362 1.973 -6.136 1.00 0.00 H new ATOM 0 HB3 TRP A 89 1.519 2.302 -7.411 1.00 0.00 H new ATOM 0 HD1 TRP A 89 -1.713 0.309 -6.745 1.00 0.00 H new ATOM 0 HE1 TRP A 89 -2.758 -0.403 -9.004 1.00 0.00 H new ATOM 0 HE3 TRP A 89 2.102 1.751 -9.828 1.00 0.00 H new ATOM 0 HZ2 TRP A 89 -2.011 -0.341 -11.715 1.00 0.00 H new ATOM 0 HZ3 TRP A 89 1.863 1.389 -12.251 1.00 0.00 H new ATOM 0 HH2 TRP A 89 -0.167 0.358 -13.181 1.00 0.00 H new ATOM 1388 N HIS A 90 4.196 1.124 -6.263 1.00 0.00 N ATOM 1389 CA HIS A 90 5.377 1.791 -5.744 1.00 0.00 C ATOM 1390 C HIS A 90 5.455 3.201 -6.315 1.00 0.00 C ATOM 1391 O HIS A 90 5.541 3.380 -7.529 1.00 0.00 O ATOM 1392 CB HIS A 90 6.634 0.981 -6.103 1.00 0.00 C ATOM 1393 CG HIS A 90 7.943 1.697 -5.902 1.00 0.00 C ATOM 1394 ND1 HIS A 90 8.502 2.528 -6.851 1.00 0.00 N ATOM 1395 CD2 HIS A 90 8.822 1.666 -4.876 1.00 0.00 C ATOM 1396 CE1 HIS A 90 9.667 2.969 -6.417 1.00 0.00 C ATOM 1397 NE2 HIS A 90 9.889 2.459 -5.220 1.00 0.00 N ATOM 0 H HIS A 90 4.350 0.620 -7.136 1.00 0.00 H new ATOM 0 HA HIS A 90 5.315 1.859 -4.658 1.00 0.00 H new ATOM 0 HB2 HIS A 90 6.642 0.070 -5.504 1.00 0.00 H new ATOM 0 HB3 HIS A 90 6.563 0.676 -7.147 1.00 0.00 H new ATOM 0 HD2 HIS A 90 8.706 1.117 -3.953 1.00 0.00 H new ATOM 0 HE1 HIS A 90 10.328 3.635 -6.951 1.00 0.00 H new ATOM 0 HE2 HIS A 90 10.715 2.626 -4.646 1.00 0.00 H new ATOM 1406 N VAL A 91 5.412 4.196 -5.444 1.00 0.00 N ATOM 1407 CA VAL A 91 5.532 5.577 -5.880 1.00 0.00 C ATOM 1408 C VAL A 91 6.996 6.007 -5.853 1.00 0.00 C ATOM 1409 O VAL A 91 7.610 6.116 -4.791 1.00 0.00 O ATOM 1410 CB VAL A 91 4.659 6.541 -5.039 1.00 0.00 C ATOM 1411 CG1 VAL A 91 3.185 6.289 -5.309 1.00 0.00 C ATOM 1412 CG2 VAL A 91 4.949 6.401 -3.556 1.00 0.00 C ATOM 0 H VAL A 91 5.296 4.075 -4.438 1.00 0.00 H new ATOM 0 HA VAL A 91 5.160 5.632 -6.903 1.00 0.00 H new ATOM 0 HB VAL A 91 4.908 7.560 -5.336 1.00 0.00 H new ATOM 0 HG11 VAL A 91 2.583 6.974 -4.711 1.00 0.00 H new ATOM 0 HG12 VAL A 91 2.976 6.451 -6.366 1.00 0.00 H new ATOM 0 HG13 VAL A 91 2.937 5.261 -5.043 1.00 0.00 H new ATOM 0 HG21 VAL A 91 4.319 7.092 -2.995 1.00 0.00 H new ATOM 0 HG22 VAL A 91 4.739 5.379 -3.239 1.00 0.00 H new ATOM 0 HG23 VAL A 91 5.998 6.631 -3.367 1.00 0.00 H new ATOM 1422 N PRO A 92 7.589 6.198 -7.038 1.00 0.00 N ATOM 1423 CA PRO A 92 8.999 6.577 -7.165 1.00 0.00 C ATOM 1424 C PRO A 92 9.256 8.027 -6.759 1.00 0.00 C ATOM 1425 O PRO A 92 10.405 8.439 -6.581 1.00 0.00 O ATOM 1426 CB PRO A 92 9.282 6.372 -8.658 1.00 0.00 C ATOM 1427 CG PRO A 92 7.959 6.528 -9.329 1.00 0.00 C ATOM 1428 CD PRO A 92 6.930 6.046 -8.347 1.00 0.00 C ATOM 0 HA PRO A 92 9.642 5.989 -6.510 1.00 0.00 H new ATOM 0 HB2 PRO A 92 10.000 7.104 -9.027 1.00 0.00 H new ATOM 0 HB3 PRO A 92 9.706 5.386 -8.847 1.00 0.00 H new ATOM 0 HG2 PRO A 92 7.781 7.569 -9.600 1.00 0.00 H new ATOM 0 HG3 PRO A 92 7.919 5.947 -10.251 1.00 0.00 H new ATOM 0 HD2 PRO A 92 6.016 6.636 -8.405 1.00 0.00 H new ATOM 0 HD3 PRO A 92 6.652 5.009 -8.536 1.00 0.00 H new ATOM 1436 N ASP A 93 8.183 8.790 -6.598 1.00 0.00 N ATOM 1437 CA ASP A 93 8.296 10.202 -6.264 1.00 0.00 C ATOM 1438 C ASP A 93 7.040 10.706 -5.565 1.00 0.00 C ATOM 1439 O ASP A 93 5.946 10.180 -5.775 1.00 0.00 O ATOM 1440 CB ASP A 93 8.554 11.020 -7.530 1.00 0.00 C ATOM 1441 CG ASP A 93 8.594 12.511 -7.266 1.00 0.00 C ATOM 1442 OD1 ASP A 93 9.471 12.961 -6.498 1.00 0.00 O ATOM 1443 OD2 ASP A 93 7.753 13.245 -7.833 1.00 0.00 O ATOM 0 H ASP A 93 7.225 8.454 -6.693 1.00 0.00 H new ATOM 0 HA ASP A 93 9.135 10.321 -5.579 1.00 0.00 H new ATOM 0 HB2 ASP A 93 9.500 10.708 -7.972 1.00 0.00 H new ATOM 0 HB3 ASP A 93 7.774 10.806 -8.261 1.00 0.00 H new ATOM 1448 N PHE A 94 7.216 11.707 -4.714 1.00 0.00 N ATOM 1449 CA PHE A 94 6.104 12.384 -4.062 1.00 0.00 C ATOM 1450 C PHE A 94 6.452 13.856 -3.847 1.00 0.00 C ATOM 1451 O PHE A 94 7.588 14.191 -3.499 1.00 0.00 O ATOM 1452 CB PHE A 94 5.743 11.711 -2.727 1.00 0.00 C ATOM 1453 CG PHE A 94 6.862 11.680 -1.722 1.00 0.00 C ATOM 1454 CD1 PHE A 94 7.857 10.718 -1.799 1.00 0.00 C ATOM 1455 CD2 PHE A 94 6.916 12.613 -0.698 1.00 0.00 C ATOM 1456 CE1 PHE A 94 8.881 10.686 -0.875 1.00 0.00 C ATOM 1457 CE2 PHE A 94 7.939 12.585 0.228 1.00 0.00 C ATOM 1458 CZ PHE A 94 8.922 11.623 0.140 1.00 0.00 C ATOM 0 H PHE A 94 8.133 12.072 -4.456 1.00 0.00 H new ATOM 0 HA PHE A 94 5.230 12.314 -4.710 1.00 0.00 H new ATOM 0 HB2 PHE A 94 4.893 12.234 -2.289 1.00 0.00 H new ATOM 0 HB3 PHE A 94 5.421 10.689 -2.925 1.00 0.00 H new ATOM 0 HD1 PHE A 94 7.830 9.985 -2.592 1.00 0.00 H new ATOM 0 HD2 PHE A 94 6.149 13.370 -0.624 1.00 0.00 H new ATOM 0 HE1 PHE A 94 9.649 9.930 -0.945 1.00 0.00 H new ATOM 0 HE2 PHE A 94 7.969 13.317 1.022 1.00 0.00 H new ATOM 0 HZ PHE A 94 9.724 11.601 0.864 1.00 0.00 H new ATOM 1468 N HIS A 95 5.488 14.727 -4.092 1.00 0.00 N ATOM 1469 CA HIS A 95 5.689 16.167 -3.970 1.00 0.00 C ATOM 1470 C HIS A 95 5.098 16.671 -2.654 1.00 0.00 C ATOM 1471 O HIS A 95 3.953 16.364 -2.328 1.00 0.00 O ATOM 1472 CB HIS A 95 5.030 16.866 -5.165 1.00 0.00 C ATOM 1473 CG HIS A 95 5.345 18.323 -5.303 1.00 0.00 C ATOM 1474 ND1 HIS A 95 4.405 19.314 -5.127 1.00 0.00 N ATOM 1475 CD2 HIS A 95 6.492 18.953 -5.653 1.00 0.00 C ATOM 1476 CE1 HIS A 95 4.957 20.488 -5.364 1.00 0.00 C ATOM 1477 NE2 HIS A 95 6.222 20.300 -5.685 1.00 0.00 N ATOM 0 H HIS A 95 4.546 14.461 -4.380 1.00 0.00 H new ATOM 0 HA HIS A 95 6.756 16.392 -3.968 1.00 0.00 H new ATOM 0 HB2 HIS A 95 5.337 16.356 -6.078 1.00 0.00 H new ATOM 0 HB3 HIS A 95 3.949 16.750 -5.083 1.00 0.00 H new ATOM 0 HD1 HIS A 95 3.433 19.163 -4.856 1.00 0.00 H new ATOM 0 HD2 HIS A 95 7.441 18.484 -5.867 1.00 0.00 H new ATOM 0 HE1 HIS A 95 4.457 21.443 -5.305 1.00 0.00 H new ATOM 1486 N GLY A 96 5.880 17.437 -1.904 1.00 0.00 N ATOM 1487 CA GLY A 96 5.426 17.928 -0.614 1.00 0.00 C ATOM 1488 C GLY A 96 6.154 17.256 0.532 1.00 0.00 C ATOM 1489 O GLY A 96 7.269 16.762 0.357 1.00 0.00 O ATOM 0 H GLY A 96 6.822 17.728 -2.165 1.00 0.00 H new ATOM 0 HA2 GLY A 96 5.580 19.006 -0.561 1.00 0.00 H new ATOM 0 HA3 GLY A 96 4.354 17.754 -0.516 1.00 0.00 H new ATOM 1493 N THR A 97 5.539 17.237 1.706 1.00 0.00 N ATOM 1494 CA THR A 97 6.130 16.578 2.853 1.00 0.00 C ATOM 1495 C THR A 97 5.117 15.639 3.486 1.00 0.00 C ATOM 1496 O THR A 97 3.940 15.978 3.606 1.00 0.00 O ATOM 1497 CB THR A 97 6.619 17.592 3.903 1.00 0.00 C ATOM 1498 OG1 THR A 97 7.407 18.607 3.268 1.00 0.00 O ATOM 1499 CG2 THR A 97 7.452 16.902 4.973 1.00 0.00 C ATOM 0 H THR A 97 4.633 17.670 1.885 1.00 0.00 H new ATOM 0 HA THR A 97 6.994 16.013 2.503 1.00 0.00 H new ATOM 0 HB THR A 97 5.747 18.044 4.375 1.00 0.00 H new ATOM 0 HG1 THR A 97 7.714 19.251 3.940 1.00 0.00 H new ATOM 0 HG21 THR A 97 7.787 17.638 5.704 1.00 0.00 H new ATOM 0 HG22 THR A 97 6.848 16.144 5.472 1.00 0.00 H new ATOM 0 HG23 THR A 97 8.319 16.429 4.511 1.00 0.00 H new ATOM 1507 N LEU A 98 5.576 14.466 3.892 1.00 0.00 N ATOM 1508 CA LEU A 98 4.670 13.442 4.374 1.00 0.00 C ATOM 1509 C LEU A 98 4.293 13.675 5.826 1.00 0.00 C ATOM 1510 O LEU A 98 5.146 13.815 6.704 1.00 0.00 O ATOM 1511 CB LEU A 98 5.236 12.038 4.143 1.00 0.00 C ATOM 1512 CG LEU A 98 6.738 11.879 4.357 1.00 0.00 C ATOM 1513 CD1 LEU A 98 7.046 11.489 5.794 1.00 0.00 C ATOM 1514 CD2 LEU A 98 7.284 10.854 3.381 1.00 0.00 C ATOM 0 H LEU A 98 6.561 14.203 3.897 1.00 0.00 H new ATOM 0 HA LEU A 98 3.751 13.512 3.792 1.00 0.00 H new ATOM 0 HB2 LEU A 98 4.719 11.346 4.807 1.00 0.00 H new ATOM 0 HB3 LEU A 98 5.001 11.736 3.122 1.00 0.00 H new ATOM 0 HG LEU A 98 7.226 12.836 4.170 1.00 0.00 H new ATOM 0 HD11 LEU A 98 8.124 11.382 5.919 1.00 0.00 H new ATOM 0 HD12 LEU A 98 6.677 12.262 6.468 1.00 0.00 H new ATOM 0 HD13 LEU A 98 6.558 10.542 6.027 1.00 0.00 H new ATOM 0 HD21 LEU A 98 8.357 10.741 3.535 1.00 0.00 H new ATOM 0 HD22 LEU A 98 6.791 9.896 3.546 1.00 0.00 H new ATOM 0 HD23 LEU A 98 7.097 11.188 2.360 1.00 0.00 H new ATOM 1526 N GLN A 99 2.996 13.739 6.047 1.00 0.00 N ATOM 1527 CA GLN A 99 2.434 14.020 7.349 1.00 0.00 C ATOM 1528 C GLN A 99 1.238 13.102 7.574 1.00 0.00 C ATOM 1529 O GLN A 99 0.450 12.887 6.665 1.00 0.00 O ATOM 1530 CB GLN A 99 2.026 15.496 7.416 1.00 0.00 C ATOM 1531 CG GLN A 99 0.908 15.868 6.455 1.00 0.00 C ATOM 1532 CD GLN A 99 0.770 17.364 6.272 1.00 0.00 C ATOM 1533 OE1 GLN A 99 1.391 17.952 5.386 1.00 0.00 O ATOM 1534 NE2 GLN A 99 -0.040 17.992 7.107 1.00 0.00 N ATOM 0 H GLN A 99 2.296 13.596 5.319 1.00 0.00 H new ATOM 0 HA GLN A 99 3.167 13.836 8.134 1.00 0.00 H new ATOM 0 HB2 GLN A 99 1.711 15.730 8.433 1.00 0.00 H new ATOM 0 HB3 GLN A 99 2.898 16.114 7.201 1.00 0.00 H new ATOM 0 HG2 GLN A 99 1.097 15.403 5.487 1.00 0.00 H new ATOM 0 HG3 GLN A 99 -0.034 15.463 6.825 1.00 0.00 H new ATOM 0 HE21 GLN A 99 -0.536 17.468 7.827 1.00 0.00 H new ATOM 0 HE22 GLN A 99 -0.169 19.001 7.031 1.00 0.00 H new ATOM 1543 N ALA A 100 1.110 12.550 8.766 1.00 0.00 N ATOM 1544 CA ALA A 100 0.110 11.519 9.008 1.00 0.00 C ATOM 1545 C ALA A 100 -1.198 12.095 9.538 1.00 0.00 C ATOM 1546 O ALA A 100 -1.222 12.773 10.568 1.00 0.00 O ATOM 1547 CB ALA A 100 0.661 10.478 9.964 1.00 0.00 C ATOM 0 H ALA A 100 1.679 12.793 9.577 1.00 0.00 H new ATOM 0 HA ALA A 100 -0.116 11.048 8.051 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -0.093 9.710 10.140 1.00 0.00 H new ATOM 0 HB2 ALA A 100 1.550 10.021 9.531 1.00 0.00 H new ATOM 0 HB3 ALA A 100 0.922 10.954 10.909 1.00 0.00 H new ATOM 1553 N HIS A 101 -2.284 11.827 8.820 1.00 0.00 N ATOM 1554 CA HIS A 101 -3.617 12.237 9.247 1.00 0.00 C ATOM 1555 C HIS A 101 -4.221 11.196 10.195 1.00 0.00 C ATOM 1556 O HIS A 101 -4.245 11.396 11.407 1.00 0.00 O ATOM 1557 CB HIS A 101 -4.520 12.448 8.020 1.00 0.00 C ATOM 1558 CG HIS A 101 -5.938 12.815 8.349 1.00 0.00 C ATOM 1559 ND1 HIS A 101 -7.026 12.118 7.866 1.00 0.00 N ATOM 1560 CD2 HIS A 101 -6.443 13.815 9.111 1.00 0.00 C ATOM 1561 CE1 HIS A 101 -8.135 12.672 8.317 1.00 0.00 C ATOM 1562 NE2 HIS A 101 -7.811 13.702 9.075 1.00 0.00 N ATOM 0 H HIS A 101 -2.266 11.324 7.933 1.00 0.00 H new ATOM 0 HA HIS A 101 -3.540 13.180 9.788 1.00 0.00 H new ATOM 0 HB2 HIS A 101 -4.089 13.233 7.398 1.00 0.00 H new ATOM 0 HB3 HIS A 101 -4.523 11.535 7.425 1.00 0.00 H new ATOM 0 HD1 HIS A 101 -6.980 11.302 7.256 1.00 0.00 H new ATOM 0 HD2 HIS A 101 -5.876 14.562 9.647 1.00 0.00 H new ATOM 0 HE1 HIS A 101 -9.139 12.338 8.102 1.00 0.00 H new ATOM 1571 N GLU A 102 -4.701 10.088 9.638 1.00 0.00 N ATOM 1572 CA GLU A 102 -5.282 9.015 10.437 1.00 0.00 C ATOM 1573 C GLU A 102 -4.202 8.149 11.066 1.00 0.00 C ATOM 1574 O GLU A 102 -4.389 7.577 12.138 1.00 0.00 O ATOM 1575 CB GLU A 102 -6.196 8.147 9.574 1.00 0.00 C ATOM 1576 CG GLU A 102 -7.616 8.678 9.465 1.00 0.00 C ATOM 1577 CD GLU A 102 -8.257 8.904 10.821 1.00 0.00 C ATOM 1578 OE1 GLU A 102 -8.262 7.971 11.655 1.00 0.00 O ATOM 1579 OE2 GLU A 102 -8.769 10.018 11.060 1.00 0.00 O ATOM 0 H GLU A 102 -4.699 9.910 8.634 1.00 0.00 H new ATOM 0 HA GLU A 102 -5.865 9.474 11.235 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -5.769 8.067 8.574 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -6.225 7.140 9.990 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -7.608 9.616 8.910 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -8.221 7.974 8.893 1.00 0.00 H new ATOM 1586 N HIS A 103 -3.072 8.056 10.399 1.00 0.00 N ATOM 1587 CA HIS A 103 -1.981 7.235 10.890 1.00 0.00 C ATOM 1588 C HIS A 103 -1.216 8.033 11.939 1.00 0.00 C ATOM 1589 O HIS A 103 -1.290 9.259 11.957 1.00 0.00 O ATOM 1590 CB HIS A 103 -1.064 6.791 9.737 1.00 0.00 C ATOM 1591 CG HIS A 103 -1.814 6.227 8.555 1.00 0.00 C ATOM 1592 ND1 HIS A 103 -1.749 4.908 8.160 1.00 0.00 N ATOM 1593 CD2 HIS A 103 -2.658 6.829 7.679 1.00 0.00 C ATOM 1594 CE1 HIS A 103 -2.515 4.727 7.101 1.00 0.00 C ATOM 1595 NE2 HIS A 103 -3.081 5.877 6.787 1.00 0.00 N ATOM 0 H HIS A 103 -2.883 8.536 9.519 1.00 0.00 H new ATOM 0 HA HIS A 103 -2.374 6.325 11.344 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -0.470 7.643 9.407 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -0.366 6.040 10.107 1.00 0.00 H new ATOM 0 HD1 HIS A 103 -1.194 4.184 8.616 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -2.945 7.870 7.684 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -2.655 3.793 6.578 1.00 0.00 H new ATOM 1604 N GLN A 104 -0.507 7.355 12.821 1.00 0.00 N ATOM 1605 CA GLN A 104 0.123 8.023 13.952 1.00 0.00 C ATOM 1606 C GLN A 104 1.564 8.416 13.633 1.00 0.00 C ATOM 1607 O GLN A 104 1.877 9.600 13.516 1.00 0.00 O ATOM 1608 CB GLN A 104 0.063 7.123 15.191 1.00 0.00 C ATOM 1609 CG GLN A 104 0.504 7.809 16.473 1.00 0.00 C ATOM 1610 CD GLN A 104 0.215 6.978 17.706 1.00 0.00 C ATOM 1611 OE1 GLN A 104 1.040 6.174 18.140 1.00 0.00 O ATOM 1612 NE2 GLN A 104 -0.966 7.162 18.274 1.00 0.00 N ATOM 0 H GLN A 104 -0.351 6.348 12.780 1.00 0.00 H new ATOM 0 HA GLN A 104 -0.427 8.941 14.158 1.00 0.00 H new ATOM 0 HB2 GLN A 104 -0.958 6.762 15.316 1.00 0.00 H new ATOM 0 HB3 GLN A 104 0.692 6.249 15.024 1.00 0.00 H new ATOM 0 HG2 GLN A 104 1.573 8.016 16.421 1.00 0.00 H new ATOM 0 HG3 GLN A 104 -0.003 8.770 16.560 1.00 0.00 H new ATOM 0 HE21 GLN A 104 -1.621 7.839 17.882 1.00 0.00 H new ATOM 0 HE22 GLN A 104 -1.222 6.627 19.104 1.00 0.00 H new ATOM 1621 N ALA A 105 2.429 7.428 13.473 1.00 0.00 N ATOM 1622 CA ALA A 105 3.838 7.692 13.218 1.00 0.00 C ATOM 1623 C ALA A 105 4.242 7.179 11.844 1.00 0.00 C ATOM 1624 O ALA A 105 3.670 6.212 11.348 1.00 0.00 O ATOM 1625 CB ALA A 105 4.700 7.056 14.299 1.00 0.00 C ATOM 0 H ALA A 105 2.183 6.439 13.515 1.00 0.00 H new ATOM 0 HA ALA A 105 3.994 8.771 13.238 1.00 0.00 H new ATOM 0 HB1 ALA A 105 5.751 7.262 14.095 1.00 0.00 H new ATOM 0 HB2 ALA A 105 4.431 7.471 15.270 1.00 0.00 H new ATOM 0 HB3 ALA A 105 4.537 5.978 14.308 1.00 0.00 H new ATOM 1631 N LEU A 106 5.226 7.824 11.237 1.00 0.00 N ATOM 1632 CA LEU A 106 5.704 7.447 9.915 1.00 0.00 C ATOM 1633 C LEU A 106 7.193 7.152 9.982 1.00 0.00 C ATOM 1634 O LEU A 106 7.962 7.945 10.526 1.00 0.00 O ATOM 1635 CB LEU A 106 5.436 8.564 8.898 1.00 0.00 C ATOM 1636 CG LEU A 106 4.240 8.342 7.968 1.00 0.00 C ATOM 1637 CD1 LEU A 106 2.986 8.014 8.760 1.00 0.00 C ATOM 1638 CD2 LEU A 106 4.017 9.568 7.090 1.00 0.00 C ATOM 0 H LEU A 106 5.715 8.621 11.645 1.00 0.00 H new ATOM 0 HA LEU A 106 5.168 6.556 9.589 1.00 0.00 H new ATOM 0 HB2 LEU A 106 5.282 9.496 9.442 1.00 0.00 H new ATOM 0 HB3 LEU A 106 6.329 8.696 8.287 1.00 0.00 H new ATOM 0 HG LEU A 106 4.462 7.490 7.326 1.00 0.00 H new ATOM 0 HD11 LEU A 106 2.152 7.861 8.075 1.00 0.00 H new ATOM 0 HD12 LEU A 106 3.149 7.106 9.341 1.00 0.00 H new ATOM 0 HD13 LEU A 106 2.755 8.839 9.434 1.00 0.00 H new ATOM 0 HD21 LEU A 106 3.164 9.396 6.434 1.00 0.00 H new ATOM 0 HD22 LEU A 106 3.821 10.436 7.720 1.00 0.00 H new ATOM 0 HD23 LEU A 106 4.907 9.751 6.487 1.00 0.00 H new ATOM 1650 N VAL A 107 7.600 6.016 9.445 1.00 0.00 N ATOM 1651 CA VAL A 107 8.991 5.598 9.524 1.00 0.00 C ATOM 1652 C VAL A 107 9.495 5.100 8.171 1.00 0.00 C ATOM 1653 O VAL A 107 8.730 4.558 7.372 1.00 0.00 O ATOM 1654 CB VAL A 107 9.164 4.491 10.593 1.00 0.00 C ATOM 1655 CG1 VAL A 107 8.360 3.250 10.224 1.00 0.00 C ATOM 1656 CG2 VAL A 107 10.635 4.148 10.809 1.00 0.00 C ATOM 0 H VAL A 107 6.989 5.366 8.950 1.00 0.00 H new ATOM 0 HA VAL A 107 9.584 6.466 9.812 1.00 0.00 H new ATOM 0 HB VAL A 107 8.777 4.878 11.536 1.00 0.00 H new ATOM 0 HG11 VAL A 107 8.497 2.486 10.990 1.00 0.00 H new ATOM 0 HG12 VAL A 107 7.303 3.508 10.155 1.00 0.00 H new ATOM 0 HG13 VAL A 107 8.703 2.866 9.263 1.00 0.00 H new ATOM 0 HG21 VAL A 107 10.719 3.368 11.565 1.00 0.00 H new ATOM 0 HG22 VAL A 107 11.067 3.794 9.873 1.00 0.00 H new ATOM 0 HG23 VAL A 107 11.171 5.037 11.143 1.00 0.00 H new ATOM 1666 N TRP A 108 10.776 5.312 7.916 1.00 0.00 N ATOM 1667 CA TRP A 108 11.410 4.808 6.710 1.00 0.00 C ATOM 1668 C TRP A 108 12.287 3.616 7.058 1.00 0.00 C ATOM 1669 O TRP A 108 13.299 3.769 7.745 1.00 0.00 O ATOM 1670 CB TRP A 108 12.269 5.887 6.045 1.00 0.00 C ATOM 1671 CG TRP A 108 11.506 7.101 5.616 1.00 0.00 C ATOM 1672 CD1 TRP A 108 10.812 7.264 4.454 1.00 0.00 C ATOM 1673 CD2 TRP A 108 11.378 8.328 6.339 1.00 0.00 C ATOM 1674 NE1 TRP A 108 10.260 8.522 4.408 1.00 0.00 N ATOM 1675 CE2 TRP A 108 10.592 9.193 5.556 1.00 0.00 C ATOM 1676 CE3 TRP A 108 11.852 8.781 7.574 1.00 0.00 C ATOM 1677 CZ2 TRP A 108 10.271 10.482 5.967 1.00 0.00 C ATOM 1678 CZ3 TRP A 108 11.530 10.060 7.982 1.00 0.00 C ATOM 1679 CH2 TRP A 108 10.747 10.899 7.179 1.00 0.00 C ATOM 0 H TRP A 108 11.400 5.833 8.533 1.00 0.00 H new ATOM 0 HA TRP A 108 10.627 4.509 6.013 1.00 0.00 H new ATOM 0 HB2 TRP A 108 13.053 6.191 6.739 1.00 0.00 H new ATOM 0 HB3 TRP A 108 12.764 5.456 5.175 1.00 0.00 H new ATOM 0 HD1 TRP A 108 10.711 6.515 3.683 1.00 0.00 H new ATOM 0 HE1 TRP A 108 9.696 8.895 3.645 1.00 0.00 H new ATOM 0 HE3 TRP A 108 12.459 8.142 8.198 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 9.667 11.131 5.350 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 11.888 10.419 8.936 1.00 0.00 H new ATOM 0 HH2 TRP A 108 10.515 11.896 7.524 1.00 0.00 H new ATOM 1690 N CYS A 109 11.905 2.439 6.599 1.00 0.00 N ATOM 1691 CA CYS A 109 12.706 1.250 6.849 1.00 0.00 C ATOM 1692 C CYS A 109 12.883 0.445 5.570 1.00 0.00 C ATOM 1693 O CYS A 109 12.063 0.530 4.657 1.00 0.00 O ATOM 1694 CB CYS A 109 12.084 0.391 7.956 1.00 0.00 C ATOM 1695 SG CYS A 109 10.397 -0.153 7.622 1.00 0.00 S ATOM 0 H CYS A 109 11.056 2.279 6.057 1.00 0.00 H new ATOM 0 HA CYS A 109 13.691 1.569 7.189 1.00 0.00 H new ATOM 0 HB2 CYS A 109 12.711 -0.487 8.113 1.00 0.00 H new ATOM 0 HB3 CYS A 109 12.092 0.959 8.887 1.00 0.00 H new ATOM 0 HG CYS A 109 9.968 -0.872 8.617 1.00 0.00 H new ATOM 1701 N SER A 110 13.953 -0.332 5.510 1.00 0.00 N ATOM 1702 CA SER A 110 14.262 -1.124 4.329 1.00 0.00 C ATOM 1703 C SER A 110 13.227 -2.234 4.158 1.00 0.00 C ATOM 1704 O SER A 110 12.635 -2.682 5.139 1.00 0.00 O ATOM 1705 CB SER A 110 15.664 -1.724 4.455 1.00 0.00 C ATOM 1706 OG SER A 110 16.635 -0.716 4.683 1.00 0.00 O ATOM 0 H SER A 110 14.626 -0.432 6.270 1.00 0.00 H new ATOM 0 HA SER A 110 14.233 -0.479 3.451 1.00 0.00 H new ATOM 0 HB2 SER A 110 15.683 -2.442 5.275 1.00 0.00 H new ATOM 0 HB3 SER A 110 15.911 -2.272 3.545 1.00 0.00 H new ATOM 0 HG SER A 110 17.521 -1.127 4.761 1.00 0.00 H new ATOM 1712 N PRO A 111 12.994 -2.696 2.914 1.00 0.00 N ATOM 1713 CA PRO A 111 11.995 -3.732 2.619 1.00 0.00 C ATOM 1714 C PRO A 111 12.118 -4.950 3.533 1.00 0.00 C ATOM 1715 O PRO A 111 11.131 -5.412 4.101 1.00 0.00 O ATOM 1716 CB PRO A 111 12.284 -4.125 1.160 1.00 0.00 C ATOM 1717 CG PRO A 111 13.566 -3.448 0.798 1.00 0.00 C ATOM 1718 CD PRO A 111 13.673 -2.245 1.691 1.00 0.00 C ATOM 0 HA PRO A 111 10.983 -3.361 2.778 1.00 0.00 H new ATOM 0 HB2 PRO A 111 12.371 -5.207 1.057 1.00 0.00 H new ATOM 0 HB3 PRO A 111 11.475 -3.806 0.502 1.00 0.00 H new ATOM 0 HG2 PRO A 111 14.414 -4.117 0.944 1.00 0.00 H new ATOM 0 HG3 PRO A 111 13.568 -3.155 -0.252 1.00 0.00 H new ATOM 0 HD2 PRO A 111 14.711 -1.971 1.880 1.00 0.00 H new ATOM 0 HD3 PRO A 111 13.187 -1.372 1.256 1.00 0.00 H new ATOM 1726 N GLU A 112 13.335 -5.446 3.694 1.00 0.00 N ATOM 1727 CA GLU A 112 13.582 -6.625 4.517 1.00 0.00 C ATOM 1728 C GLU A 112 13.255 -6.352 5.987 1.00 0.00 C ATOM 1729 O GLU A 112 12.753 -7.225 6.695 1.00 0.00 O ATOM 1730 CB GLU A 112 15.038 -7.060 4.369 1.00 0.00 C ATOM 1731 CG GLU A 112 16.030 -5.975 4.750 1.00 0.00 C ATOM 1732 CD GLU A 112 17.460 -6.377 4.482 1.00 0.00 C ATOM 1733 OE1 GLU A 112 17.986 -7.242 5.210 1.00 0.00 O ATOM 1734 OE2 GLU A 112 18.068 -5.822 3.542 1.00 0.00 O ATOM 0 H GLU A 112 14.171 -5.050 3.265 1.00 0.00 H new ATOM 0 HA GLU A 112 12.929 -7.428 4.174 1.00 0.00 H new ATOM 0 HB2 GLU A 112 15.213 -7.938 4.991 1.00 0.00 H new ATOM 0 HB3 GLU A 112 15.217 -7.360 3.337 1.00 0.00 H new ATOM 0 HG2 GLU A 112 15.801 -5.067 4.193 1.00 0.00 H new ATOM 0 HG3 GLU A 112 15.915 -5.738 5.808 1.00 0.00 H new ATOM 1741 N GLU A 113 13.530 -5.130 6.432 1.00 0.00 N ATOM 1742 CA GLU A 113 13.280 -4.733 7.811 1.00 0.00 C ATOM 1743 C GLU A 113 11.790 -4.527 8.044 1.00 0.00 C ATOM 1744 O GLU A 113 11.279 -4.805 9.125 1.00 0.00 O ATOM 1745 CB GLU A 113 14.034 -3.439 8.134 1.00 0.00 C ATOM 1746 CG GLU A 113 15.540 -3.538 7.944 1.00 0.00 C ATOM 1747 CD GLU A 113 16.192 -4.498 8.917 1.00 0.00 C ATOM 1748 OE1 GLU A 113 16.302 -5.695 8.598 1.00 0.00 O ATOM 1749 OE2 GLU A 113 16.606 -4.056 10.010 1.00 0.00 O ATOM 0 H GLU A 113 13.929 -4.393 5.851 1.00 0.00 H new ATOM 0 HA GLU A 113 13.634 -5.529 8.466 1.00 0.00 H new ATOM 0 HB2 GLU A 113 13.650 -2.639 7.501 1.00 0.00 H new ATOM 0 HB3 GLU A 113 13.826 -3.157 9.166 1.00 0.00 H new ATOM 0 HG2 GLU A 113 15.753 -3.861 6.925 1.00 0.00 H new ATOM 0 HG3 GLU A 113 15.983 -2.549 8.064 1.00 0.00 H new ATOM 1756 N ALA A 114 11.104 -4.050 7.013 1.00 0.00 N ATOM 1757 CA ALA A 114 9.677 -3.759 7.089 1.00 0.00 C ATOM 1758 C ALA A 114 8.870 -5.003 7.435 1.00 0.00 C ATOM 1759 O ALA A 114 7.934 -4.945 8.231 1.00 0.00 O ATOM 1760 CB ALA A 114 9.194 -3.172 5.771 1.00 0.00 C ATOM 0 H ALA A 114 11.520 -3.854 6.102 1.00 0.00 H new ATOM 0 HA ALA A 114 9.526 -3.031 7.886 1.00 0.00 H new ATOM 0 HB1 ALA A 114 8.127 -2.958 5.837 1.00 0.00 H new ATOM 0 HB2 ALA A 114 9.737 -2.250 5.563 1.00 0.00 H new ATOM 0 HB3 ALA A 114 9.371 -3.887 4.968 1.00 0.00 H new ATOM 1766 N LEU A 115 9.254 -6.133 6.856 1.00 0.00 N ATOM 1767 CA LEU A 115 8.515 -7.376 7.039 1.00 0.00 C ATOM 1768 C LEU A 115 8.785 -7.966 8.424 1.00 0.00 C ATOM 1769 O LEU A 115 8.091 -8.878 8.870 1.00 0.00 O ATOM 1770 CB LEU A 115 8.891 -8.371 5.933 1.00 0.00 C ATOM 1771 CG LEU A 115 7.728 -9.179 5.328 1.00 0.00 C ATOM 1772 CD1 LEU A 115 7.314 -10.323 6.234 1.00 0.00 C ATOM 1773 CD2 LEU A 115 6.532 -8.279 5.054 1.00 0.00 C ATOM 0 H LEU A 115 10.074 -6.215 6.255 1.00 0.00 H new ATOM 0 HA LEU A 115 7.447 -7.167 6.971 1.00 0.00 H new ATOM 0 HB2 LEU A 115 9.382 -7.822 5.130 1.00 0.00 H new ATOM 0 HB3 LEU A 115 9.623 -9.071 6.335 1.00 0.00 H new ATOM 0 HG LEU A 115 8.081 -9.600 4.386 1.00 0.00 H new ATOM 0 HD11 LEU A 115 6.491 -10.871 5.775 1.00 0.00 H new ATOM 0 HD12 LEU A 115 8.160 -10.995 6.382 1.00 0.00 H new ATOM 0 HD13 LEU A 115 6.993 -9.926 7.197 1.00 0.00 H new ATOM 0 HD21 LEU A 115 5.722 -8.870 4.627 1.00 0.00 H new ATOM 0 HD22 LEU A 115 6.197 -7.825 5.987 1.00 0.00 H new ATOM 0 HD23 LEU A 115 6.819 -7.496 4.352 1.00 0.00 H new ATOM 1785 N GLN A 116 9.789 -7.430 9.111 1.00 0.00 N ATOM 1786 CA GLN A 116 10.108 -7.865 10.466 1.00 0.00 C ATOM 1787 C GLN A 116 9.171 -7.204 11.468 1.00 0.00 C ATOM 1788 O GLN A 116 9.129 -7.572 12.641 1.00 0.00 O ATOM 1789 CB GLN A 116 11.550 -7.506 10.811 1.00 0.00 C ATOM 1790 CG GLN A 116 12.562 -8.032 9.813 1.00 0.00 C ATOM 1791 CD GLN A 116 12.488 -9.531 9.631 1.00 0.00 C ATOM 1792 OE1 GLN A 116 12.150 -10.268 10.557 1.00 0.00 O ATOM 1793 NE2 GLN A 116 12.796 -9.988 8.433 1.00 0.00 N ATOM 0 H GLN A 116 10.396 -6.693 8.751 1.00 0.00 H new ATOM 0 HA GLN A 116 9.984 -8.947 10.516 1.00 0.00 H new ATOM 0 HB2 GLN A 116 11.641 -6.421 10.871 1.00 0.00 H new ATOM 0 HB3 GLN A 116 11.787 -7.901 11.799 1.00 0.00 H new ATOM 0 HG2 GLN A 116 12.401 -7.546 8.851 1.00 0.00 H new ATOM 0 HG3 GLN A 116 13.565 -7.761 10.143 1.00 0.00 H new ATOM 0 HE21 GLN A 116 13.071 -9.340 7.695 1.00 0.00 H new ATOM 0 HE22 GLN A 116 12.759 -10.990 8.244 1.00 0.00 H new ATOM 1802 N TYR A 117 8.415 -6.233 10.987 1.00 0.00 N ATOM 1803 CA TYR A 117 7.565 -5.423 11.839 1.00 0.00 C ATOM 1804 C TYR A 117 6.105 -5.846 11.724 1.00 0.00 C ATOM 1805 O TYR A 117 5.763 -6.647 10.851 1.00 0.00 O ATOM 1806 CB TYR A 117 7.745 -3.954 11.467 1.00 0.00 C ATOM 1807 CG TYR A 117 8.992 -3.356 12.072 1.00 0.00 C ATOM 1808 CD1 TYR A 117 9.083 -3.110 13.436 1.00 0.00 C ATOM 1809 CD2 TYR A 117 10.085 -3.065 11.281 1.00 0.00 C ATOM 1810 CE1 TYR A 117 10.234 -2.579 13.988 1.00 0.00 C ATOM 1811 CE2 TYR A 117 11.242 -2.538 11.821 1.00 0.00 C ATOM 1812 CZ TYR A 117 11.311 -2.298 13.177 1.00 0.00 C ATOM 1813 OH TYR A 117 12.464 -1.777 13.721 1.00 0.00 O ATOM 0 H TYR A 117 8.373 -5.985 9.998 1.00 0.00 H new ATOM 0 HA TYR A 117 7.856 -5.568 12.879 1.00 0.00 H new ATOM 0 HB2 TYR A 117 7.790 -3.860 10.382 1.00 0.00 H new ATOM 0 HB3 TYR A 117 6.875 -3.388 11.801 1.00 0.00 H new ATOM 0 HD1 TYR A 117 8.242 -3.337 14.075 1.00 0.00 H new ATOM 0 HD2 TYR A 117 10.035 -3.253 10.219 1.00 0.00 H new ATOM 0 HE1 TYR A 117 10.288 -2.386 15.049 1.00 0.00 H new ATOM 0 HE2 TYR A 117 12.087 -2.316 11.186 1.00 0.00 H new ATOM 0 HH TYR A 117 13.126 -1.638 13.012 1.00 0.00 H new ATOM 1823 N PRO A 118 5.222 -5.326 12.603 1.00 0.00 N ATOM 1824 CA PRO A 118 3.809 -5.703 12.605 1.00 0.00 C ATOM 1825 C PRO A 118 3.043 -5.102 11.431 1.00 0.00 C ATOM 1826 O PRO A 118 2.278 -4.150 11.592 1.00 0.00 O ATOM 1827 CB PRO A 118 3.290 -5.143 13.930 1.00 0.00 C ATOM 1828 CG PRO A 118 4.170 -3.982 14.222 1.00 0.00 C ATOM 1829 CD PRO A 118 5.525 -4.333 13.659 1.00 0.00 C ATOM 0 HA PRO A 118 3.677 -6.780 12.504 1.00 0.00 H new ATOM 0 HB2 PRO A 118 2.247 -4.838 13.849 1.00 0.00 H new ATOM 0 HB3 PRO A 118 3.343 -5.889 14.723 1.00 0.00 H new ATOM 0 HG2 PRO A 118 3.781 -3.073 13.764 1.00 0.00 H new ATOM 0 HG3 PRO A 118 4.229 -3.798 15.295 1.00 0.00 H new ATOM 0 HD2 PRO A 118 6.028 -3.456 13.251 1.00 0.00 H new ATOM 0 HD3 PRO A 118 6.180 -4.750 14.424 1.00 0.00 H new ATOM 1837 N LEU A 119 3.279 -5.650 10.252 1.00 0.00 N ATOM 1838 CA LEU A 119 2.556 -5.251 9.059 1.00 0.00 C ATOM 1839 C LEU A 119 1.204 -5.950 9.021 1.00 0.00 C ATOM 1840 O LEU A 119 1.058 -7.063 9.534 1.00 0.00 O ATOM 1841 CB LEU A 119 3.368 -5.596 7.808 1.00 0.00 C ATOM 1842 CG LEU A 119 4.495 -4.620 7.458 1.00 0.00 C ATOM 1843 CD1 LEU A 119 5.257 -5.108 6.239 1.00 0.00 C ATOM 1844 CD2 LEU A 119 3.941 -3.229 7.205 1.00 0.00 C ATOM 0 H LEU A 119 3.974 -6.380 10.096 1.00 0.00 H new ATOM 0 HA LEU A 119 2.398 -4.173 9.081 1.00 0.00 H new ATOM 0 HB2 LEU A 119 3.799 -6.588 7.939 1.00 0.00 H new ATOM 0 HB3 LEU A 119 2.686 -5.655 6.959 1.00 0.00 H new ATOM 0 HG LEU A 119 5.179 -4.571 8.305 1.00 0.00 H new ATOM 0 HD11 LEU A 119 6.055 -4.404 6.003 1.00 0.00 H new ATOM 0 HD12 LEU A 119 5.687 -6.088 6.447 1.00 0.00 H new ATOM 0 HD13 LEU A 119 4.577 -5.184 5.391 1.00 0.00 H new ATOM 0 HD21 LEU A 119 4.758 -2.551 6.958 1.00 0.00 H new ATOM 0 HD22 LEU A 119 3.235 -3.264 6.375 1.00 0.00 H new ATOM 0 HD23 LEU A 119 3.431 -2.872 8.100 1.00 0.00 H new ATOM 1856 N ALA A 120 0.214 -5.290 8.433 1.00 0.00 N ATOM 1857 CA ALA A 120 -1.128 -5.849 8.343 1.00 0.00 C ATOM 1858 C ALA A 120 -1.139 -7.101 7.463 1.00 0.00 C ATOM 1859 O ALA A 120 -0.278 -7.268 6.596 1.00 0.00 O ATOM 1860 CB ALA A 120 -2.099 -4.797 7.821 1.00 0.00 C ATOM 0 H ALA A 120 0.316 -4.367 8.011 1.00 0.00 H new ATOM 0 HA ALA A 120 -1.451 -6.147 9.340 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -3.099 -5.225 7.757 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -2.111 -3.945 8.500 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -1.782 -4.468 6.832 1.00 0.00 H new ATOM 1866 N PRO A 121 -2.116 -8.001 7.685 1.00 0.00 N ATOM 1867 CA PRO A 121 -2.206 -9.295 6.990 1.00 0.00 C ATOM 1868 C PRO A 121 -2.095 -9.196 5.465 1.00 0.00 C ATOM 1869 O PRO A 121 -1.549 -10.093 4.822 1.00 0.00 O ATOM 1870 CB PRO A 121 -3.594 -9.830 7.385 1.00 0.00 C ATOM 1871 CG PRO A 121 -4.290 -8.697 8.063 1.00 0.00 C ATOM 1872 CD PRO A 121 -3.208 -7.844 8.653 1.00 0.00 C ATOM 0 HA PRO A 121 -1.376 -9.940 7.278 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -4.149 -10.161 6.508 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -3.507 -10.689 8.050 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -4.893 -8.129 7.354 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -4.966 -9.061 8.837 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -3.519 -6.804 8.749 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -2.920 -8.184 9.648 1.00 0.00 H new ATOM 1880 N ALA A 122 -2.603 -8.114 4.893 1.00 0.00 N ATOM 1881 CA ALA A 122 -2.609 -7.957 3.443 1.00 0.00 C ATOM 1882 C ALA A 122 -1.294 -7.375 2.941 1.00 0.00 C ATOM 1883 O ALA A 122 -0.926 -7.559 1.782 1.00 0.00 O ATOM 1884 CB ALA A 122 -3.768 -7.073 3.013 1.00 0.00 C ATOM 0 H ALA A 122 -3.015 -7.335 5.406 1.00 0.00 H new ATOM 0 HA ALA A 122 -2.730 -8.946 3.002 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -3.760 -6.965 1.928 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -4.708 -7.528 3.325 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -3.668 -6.091 3.476 1.00 0.00 H new ATOM 1890 N ASP A 123 -0.582 -6.707 3.834 1.00 0.00 N ATOM 1891 CA ASP A 123 0.623 -5.966 3.478 1.00 0.00 C ATOM 1892 C ASP A 123 1.823 -6.893 3.399 1.00 0.00 C ATOM 1893 O ASP A 123 2.798 -6.609 2.702 1.00 0.00 O ATOM 1894 CB ASP A 123 0.887 -4.871 4.518 1.00 0.00 C ATOM 1895 CG ASP A 123 -0.235 -3.854 4.592 1.00 0.00 C ATOM 1896 OD1 ASP A 123 -1.372 -4.246 4.935 1.00 0.00 O ATOM 1897 OD2 ASP A 123 0.019 -2.664 4.323 1.00 0.00 O ATOM 0 H ASP A 123 -0.820 -6.661 4.825 1.00 0.00 H new ATOM 0 HA ASP A 123 0.470 -5.511 2.499 1.00 0.00 H new ATOM 0 HB2 ASP A 123 1.021 -5.330 5.497 1.00 0.00 H new ATOM 0 HB3 ASP A 123 1.819 -4.361 4.275 1.00 0.00 H new ATOM 1902 N ILE A 124 1.734 -8.013 4.098 1.00 0.00 N ATOM 1903 CA ILE A 124 2.832 -8.969 4.161 1.00 0.00 C ATOM 1904 C ILE A 124 3.146 -9.548 2.773 1.00 0.00 C ATOM 1905 O ILE A 124 4.267 -9.402 2.291 1.00 0.00 O ATOM 1906 CB ILE A 124 2.529 -10.107 5.162 1.00 0.00 C ATOM 1907 CG1 ILE A 124 2.316 -9.530 6.565 1.00 0.00 C ATOM 1908 CG2 ILE A 124 3.653 -11.137 5.168 1.00 0.00 C ATOM 1909 CD1 ILE A 124 1.924 -10.563 7.598 1.00 0.00 C ATOM 0 H ILE A 124 0.909 -8.285 4.633 1.00 0.00 H new ATOM 0 HA ILE A 124 3.711 -8.430 4.514 1.00 0.00 H new ATOM 0 HB ILE A 124 1.614 -10.611 4.849 1.00 0.00 H new ATOM 0 HG12 ILE A 124 3.233 -9.037 6.888 1.00 0.00 H new ATOM 0 HG13 ILE A 124 1.542 -8.764 6.519 1.00 0.00 H new ATOM 0 HG21 ILE A 124 3.418 -11.928 5.880 1.00 0.00 H new ATOM 0 HG22 ILE A 124 3.759 -11.565 4.171 1.00 0.00 H new ATOM 0 HG23 ILE A 124 4.587 -10.655 5.457 1.00 0.00 H new ATOM 0 HD11 ILE A 124 1.791 -10.078 8.565 1.00 0.00 H new ATOM 0 HD12 ILE A 124 0.990 -11.040 7.300 1.00 0.00 H new ATOM 0 HD13 ILE A 124 2.708 -11.317 7.674 1.00 0.00 H new ATOM 1921 N PRO A 125 2.163 -10.189 2.097 1.00 0.00 N ATOM 1922 CA PRO A 125 2.366 -10.752 0.753 1.00 0.00 C ATOM 1923 C PRO A 125 2.770 -9.693 -0.273 1.00 0.00 C ATOM 1924 O PRO A 125 3.405 -9.999 -1.283 1.00 0.00 O ATOM 1925 CB PRO A 125 0.998 -11.349 0.390 1.00 0.00 C ATOM 1926 CG PRO A 125 0.031 -10.712 1.324 1.00 0.00 C ATOM 1927 CD PRO A 125 0.794 -10.435 2.582 1.00 0.00 C ATOM 0 HA PRO A 125 3.177 -11.480 0.747 1.00 0.00 H new ATOM 0 HB2 PRO A 125 0.740 -11.138 -0.648 1.00 0.00 H new ATOM 0 HB3 PRO A 125 0.999 -12.433 0.504 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -0.371 -9.792 0.901 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -0.816 -11.370 1.518 1.00 0.00 H new ATOM 0 HD2 PRO A 125 0.394 -9.572 3.114 1.00 0.00 H new ATOM 0 HD3 PRO A 125 0.756 -11.279 3.270 1.00 0.00 H new ATOM 1935 N LEU A 126 2.408 -8.444 -0.007 1.00 0.00 N ATOM 1936 CA LEU A 126 2.743 -7.352 -0.908 1.00 0.00 C ATOM 1937 C LEU A 126 4.209 -6.979 -0.752 1.00 0.00 C ATOM 1938 O LEU A 126 4.926 -6.794 -1.735 1.00 0.00 O ATOM 1939 CB LEU A 126 1.852 -6.137 -0.634 1.00 0.00 C ATOM 1940 CG LEU A 126 0.354 -6.364 -0.859 1.00 0.00 C ATOM 1941 CD1 LEU A 126 -0.435 -5.109 -0.518 1.00 0.00 C ATOM 1942 CD2 LEU A 126 0.089 -6.788 -2.295 1.00 0.00 C ATOM 0 H LEU A 126 1.884 -8.164 0.822 1.00 0.00 H new ATOM 0 HA LEU A 126 2.570 -7.680 -1.933 1.00 0.00 H new ATOM 0 HB2 LEU A 126 2.004 -5.820 0.398 1.00 0.00 H new ATOM 0 HB3 LEU A 126 2.179 -5.316 -1.272 1.00 0.00 H new ATOM 0 HG LEU A 126 0.025 -7.165 -0.197 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -1.497 -5.290 -0.684 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -0.271 -4.849 0.528 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -0.104 -4.287 -1.153 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -0.980 -6.945 -2.437 1.00 0.00 H new ATOM 0 HD22 LEU A 126 0.435 -6.009 -2.974 1.00 0.00 H new ATOM 0 HD23 LEU A 126 0.623 -7.715 -2.505 1.00 0.00 H new ATOM 1954 N LEU A 127 4.654 -6.890 0.495 1.00 0.00 N ATOM 1955 CA LEU A 127 6.038 -6.557 0.784 1.00 0.00 C ATOM 1956 C LEU A 127 6.946 -7.726 0.414 1.00 0.00 C ATOM 1957 O LEU A 127 8.049 -7.517 -0.096 1.00 0.00 O ATOM 1958 CB LEU A 127 6.193 -6.179 2.265 1.00 0.00 C ATOM 1959 CG LEU A 127 7.519 -5.507 2.660 1.00 0.00 C ATOM 1960 CD1 LEU A 127 8.651 -6.517 2.753 1.00 0.00 C ATOM 1961 CD2 LEU A 127 7.872 -4.406 1.669 1.00 0.00 C ATOM 0 H LEU A 127 4.075 -7.044 1.320 1.00 0.00 H new ATOM 0 HA LEU A 127 6.333 -5.696 0.184 1.00 0.00 H new ATOM 0 HB2 LEU A 127 5.376 -5.510 2.535 1.00 0.00 H new ATOM 0 HB3 LEU A 127 6.076 -7.083 2.863 1.00 0.00 H new ATOM 0 HG LEU A 127 7.385 -5.065 3.648 1.00 0.00 H new ATOM 0 HD11 LEU A 127 9.572 -6.006 3.034 1.00 0.00 H new ATOM 0 HD12 LEU A 127 8.408 -7.268 3.505 1.00 0.00 H new ATOM 0 HD13 LEU A 127 8.786 -7.002 1.786 1.00 0.00 H new ATOM 0 HD21 LEU A 127 8.813 -3.940 1.962 1.00 0.00 H new ATOM 0 HD22 LEU A 127 7.974 -4.833 0.672 1.00 0.00 H new ATOM 0 HD23 LEU A 127 7.082 -3.655 1.663 1.00 0.00 H new ATOM 1973 N GLU A 128 6.474 -8.950 0.655 1.00 0.00 N ATOM 1974 CA GLU A 128 7.211 -10.150 0.266 1.00 0.00 C ATOM 1975 C GLU A 128 7.634 -10.082 -1.197 1.00 0.00 C ATOM 1976 O GLU A 128 8.786 -10.355 -1.529 1.00 0.00 O ATOM 1977 CB GLU A 128 6.362 -11.404 0.497 1.00 0.00 C ATOM 1978 CG GLU A 128 6.325 -11.865 1.944 1.00 0.00 C ATOM 1979 CD GLU A 128 7.662 -12.397 2.424 1.00 0.00 C ATOM 1980 OE1 GLU A 128 8.579 -12.564 1.592 1.00 0.00 O ATOM 1981 OE2 GLU A 128 7.805 -12.664 3.636 1.00 0.00 O ATOM 0 H GLU A 128 5.584 -9.135 1.118 1.00 0.00 H new ATOM 0 HA GLU A 128 8.105 -10.204 0.887 1.00 0.00 H new ATOM 0 HB2 GLU A 128 5.343 -11.208 0.162 1.00 0.00 H new ATOM 0 HB3 GLU A 128 6.751 -12.213 -0.122 1.00 0.00 H new ATOM 0 HG2 GLU A 128 6.021 -11.032 2.578 1.00 0.00 H new ATOM 0 HG3 GLU A 128 5.569 -12.642 2.054 1.00 0.00 H new ATOM 1988 N ALA A 129 6.715 -9.683 -2.067 1.00 0.00 N ATOM 1989 CA ALA A 129 7.015 -9.608 -3.487 1.00 0.00 C ATOM 1990 C ALA A 129 7.762 -8.332 -3.836 1.00 0.00 C ATOM 1991 O ALA A 129 8.376 -8.244 -4.894 1.00 0.00 O ATOM 1992 CB ALA A 129 5.764 -9.709 -4.329 1.00 0.00 C ATOM 0 H ALA A 129 5.765 -9.409 -1.816 1.00 0.00 H new ATOM 0 HA ALA A 129 7.656 -10.460 -3.712 1.00 0.00 H new ATOM 0 HB1 ALA A 129 6.030 -9.649 -5.384 1.00 0.00 H new ATOM 0 HB2 ALA A 129 5.269 -10.660 -4.133 1.00 0.00 H new ATOM 0 HB3 ALA A 129 5.089 -8.891 -4.078 1.00 0.00 H new ATOM 1998 N PHE A 130 7.729 -7.346 -2.953 1.00 0.00 N ATOM 1999 CA PHE A 130 8.440 -6.107 -3.201 1.00 0.00 C ATOM 2000 C PHE A 130 9.920 -6.334 -2.969 1.00 0.00 C ATOM 2001 O PHE A 130 10.760 -5.969 -3.791 1.00 0.00 O ATOM 2002 CB PHE A 130 7.929 -4.991 -2.290 1.00 0.00 C ATOM 2003 CG PHE A 130 8.589 -3.669 -2.553 1.00 0.00 C ATOM 2004 CD1 PHE A 130 8.106 -2.832 -3.542 1.00 0.00 C ATOM 2005 CD2 PHE A 130 9.693 -3.266 -1.819 1.00 0.00 C ATOM 2006 CE1 PHE A 130 8.710 -1.619 -3.800 1.00 0.00 C ATOM 2007 CE2 PHE A 130 10.301 -2.052 -2.072 1.00 0.00 C ATOM 2008 CZ PHE A 130 9.809 -1.228 -3.064 1.00 0.00 C ATOM 0 H PHE A 130 7.223 -7.380 -2.068 1.00 0.00 H new ATOM 0 HA PHE A 130 8.269 -5.799 -4.233 1.00 0.00 H new ATOM 0 HB2 PHE A 130 6.852 -4.886 -2.423 1.00 0.00 H new ATOM 0 HB3 PHE A 130 8.096 -5.273 -1.251 1.00 0.00 H new ATOM 0 HD1 PHE A 130 7.244 -3.132 -4.120 1.00 0.00 H new ATOM 0 HD2 PHE A 130 10.082 -3.907 -1.042 1.00 0.00 H new ATOM 0 HE1 PHE A 130 8.323 -0.976 -4.577 1.00 0.00 H new ATOM 0 HE2 PHE A 130 11.161 -1.748 -1.494 1.00 0.00 H new ATOM 0 HZ PHE A 130 10.284 -0.279 -3.264 1.00 0.00 H new ATOM 2018 N MET A 131 10.233 -6.955 -1.842 1.00 0.00 N ATOM 2019 CA MET A 131 11.602 -7.324 -1.547 1.00 0.00 C ATOM 2020 C MET A 131 12.056 -8.408 -2.521 1.00 0.00 C ATOM 2021 O MET A 131 13.219 -8.444 -2.909 1.00 0.00 O ATOM 2022 CB MET A 131 11.753 -7.784 -0.089 1.00 0.00 C ATOM 2023 CG MET A 131 10.954 -9.028 0.264 1.00 0.00 C ATOM 2024 SD MET A 131 11.151 -9.517 1.990 1.00 0.00 S ATOM 2025 CE MET A 131 12.903 -9.891 2.042 1.00 0.00 C ATOM 0 H MET A 131 9.558 -7.212 -1.122 1.00 0.00 H new ATOM 0 HA MET A 131 12.239 -6.449 -1.671 1.00 0.00 H new ATOM 0 HB2 MET A 131 12.807 -7.975 0.111 1.00 0.00 H new ATOM 0 HB3 MET A 131 11.446 -6.971 0.569 1.00 0.00 H new ATOM 0 HG2 MET A 131 9.899 -8.847 0.060 1.00 0.00 H new ATOM 0 HG3 MET A 131 11.266 -9.850 -0.380 1.00 0.00 H new ATOM 0 HE1 MET A 131 13.114 -10.528 2.901 1.00 0.00 H new ATOM 0 HE2 MET A 131 13.192 -10.408 1.127 1.00 0.00 H new ATOM 0 HE3 MET A 131 13.470 -8.964 2.129 1.00 0.00 H new ATOM 2035 N ALA A 132 11.128 -9.279 -2.929 1.00 0.00 N ATOM 2036 CA ALA A 132 11.395 -10.255 -3.983 1.00 0.00 C ATOM 2037 C ALA A 132 11.761 -9.558 -5.288 1.00 0.00 C ATOM 2038 O ALA A 132 12.660 -9.994 -6.008 1.00 0.00 O ATOM 2039 CB ALA A 132 10.179 -11.152 -4.195 1.00 0.00 C ATOM 0 H ALA A 132 10.185 -9.326 -2.543 1.00 0.00 H new ATOM 0 HA ALA A 132 12.240 -10.869 -3.670 1.00 0.00 H new ATOM 0 HB1 ALA A 132 10.393 -11.874 -4.983 1.00 0.00 H new ATOM 0 HB2 ALA A 132 9.952 -11.681 -3.270 1.00 0.00 H new ATOM 0 HB3 ALA A 132 9.323 -10.542 -4.484 1.00 0.00 H new ATOM 2045 N LEU A 133 11.071 -8.463 -5.577 1.00 0.00 N ATOM 2046 CA LEU A 133 11.302 -7.711 -6.800 1.00 0.00 C ATOM 2047 C LEU A 133 12.679 -7.073 -6.782 1.00 0.00 C ATOM 2048 O LEU A 133 13.348 -7.011 -7.803 1.00 0.00 O ATOM 2049 CB LEU A 133 10.235 -6.631 -6.979 1.00 0.00 C ATOM 2050 CG LEU A 133 9.352 -6.788 -8.217 1.00 0.00 C ATOM 2051 CD1 LEU A 133 8.575 -8.094 -8.164 1.00 0.00 C ATOM 2052 CD2 LEU A 133 8.403 -5.609 -8.339 1.00 0.00 C ATOM 0 H LEU A 133 10.343 -8.075 -4.977 1.00 0.00 H new ATOM 0 HA LEU A 133 11.245 -8.406 -7.638 1.00 0.00 H new ATOM 0 HB2 LEU A 133 9.597 -6.623 -6.096 1.00 0.00 H new ATOM 0 HB3 LEU A 133 10.728 -5.660 -7.025 1.00 0.00 H new ATOM 0 HG LEU A 133 9.995 -6.811 -9.097 1.00 0.00 H new ATOM 0 HD11 LEU A 133 7.954 -8.184 -9.055 1.00 0.00 H new ATOM 0 HD12 LEU A 133 9.272 -8.931 -8.122 1.00 0.00 H new ATOM 0 HD13 LEU A 133 7.941 -8.105 -7.277 1.00 0.00 H new ATOM 0 HD21 LEU A 133 7.780 -5.733 -9.225 1.00 0.00 H new ATOM 0 HD22 LEU A 133 7.769 -5.559 -7.454 1.00 0.00 H new ATOM 0 HD23 LEU A 133 8.978 -4.687 -8.426 1.00 0.00 H new ATOM 2064 N ARG A 134 13.098 -6.601 -5.616 1.00 0.00 N ATOM 2065 CA ARG A 134 14.410 -5.983 -5.473 1.00 0.00 C ATOM 2066 C ARG A 134 15.520 -7.025 -5.372 1.00 0.00 C ATOM 2067 O ARG A 134 16.686 -6.718 -5.615 1.00 0.00 O ATOM 2068 CB ARG A 134 14.451 -5.089 -4.233 1.00 0.00 C ATOM 2069 CG ARG A 134 13.662 -3.799 -4.365 1.00 0.00 C ATOM 2070 CD ARG A 134 13.809 -2.943 -3.115 1.00 0.00 C ATOM 2071 NE ARG A 134 15.217 -2.749 -2.748 1.00 0.00 N ATOM 2072 CZ ARG A 134 15.668 -1.794 -1.929 1.00 0.00 C ATOM 2073 NH1 ARG A 134 14.868 -0.822 -1.502 1.00 0.00 N ATOM 2074 NH2 ARG A 134 16.947 -1.784 -1.583 1.00 0.00 N ATOM 0 H ARG A 134 12.550 -6.634 -4.756 1.00 0.00 H new ATOM 0 HA ARG A 134 14.578 -5.383 -6.368 1.00 0.00 H new ATOM 0 HB2 ARG A 134 14.066 -5.651 -3.382 1.00 0.00 H new ATOM 0 HB3 ARG A 134 15.490 -4.844 -4.010 1.00 0.00 H new ATOM 0 HG2 ARG A 134 14.010 -3.242 -5.235 1.00 0.00 H new ATOM 0 HG3 ARG A 134 12.609 -4.027 -4.533 1.00 0.00 H new ATOM 0 HD2 ARG A 134 13.340 -1.973 -3.282 1.00 0.00 H new ATOM 0 HD3 ARG A 134 13.280 -3.415 -2.287 1.00 0.00 H new ATOM 0 HE ARG A 134 15.902 -3.391 -3.148 1.00 0.00 H new ATOM 0 HH11 ARG A 134 13.893 -0.797 -1.799 1.00 0.00 H new ATOM 0 HH12 ARG A 134 15.230 -0.101 -0.877 1.00 0.00 H new ATOM 0 HH21 ARG A 134 17.578 -2.501 -1.941 1.00 0.00 H new ATOM 0 HH22 ARG A 134 17.301 -1.059 -0.958 1.00 0.00 H new ATOM 2088 N ALA A 135 15.165 -8.249 -5.001 1.00 0.00 N ATOM 2089 CA ALA A 135 16.156 -9.305 -4.834 1.00 0.00 C ATOM 2090 C ALA A 135 16.408 -10.016 -6.154 1.00 0.00 C ATOM 2091 O ALA A 135 17.538 -10.395 -6.464 1.00 0.00 O ATOM 2092 CB ALA A 135 15.711 -10.302 -3.776 1.00 0.00 C ATOM 0 H ALA A 135 14.204 -8.534 -4.811 1.00 0.00 H new ATOM 0 HA ALA A 135 17.087 -8.845 -4.503 1.00 0.00 H new ATOM 0 HB1 ALA A 135 16.466 -11.081 -3.669 1.00 0.00 H new ATOM 0 HB2 ALA A 135 15.582 -9.788 -2.823 1.00 0.00 H new ATOM 0 HB3 ALA A 135 14.765 -10.753 -4.076 1.00 0.00 H new ATOM 2098 N ALA A 136 15.349 -10.191 -6.929 1.00 0.00 N ATOM 2099 CA ALA A 136 15.454 -10.841 -8.225 1.00 0.00 C ATOM 2100 C ALA A 136 15.662 -9.809 -9.323 1.00 0.00 C ATOM 2101 O ALA A 136 16.551 -9.957 -10.161 1.00 0.00 O ATOM 2102 CB ALA A 136 14.215 -11.674 -8.511 1.00 0.00 C ATOM 0 H ALA A 136 14.406 -9.891 -6.682 1.00 0.00 H new ATOM 0 HA ALA A 136 16.318 -11.506 -8.204 1.00 0.00 H new ATOM 0 HB1 ALA A 136 14.315 -12.152 -9.486 1.00 0.00 H new ATOM 0 HB2 ALA A 136 14.105 -12.439 -7.742 1.00 0.00 H new ATOM 0 HB3 ALA A 136 13.336 -11.030 -8.511 1.00 0.00 H new ATOM 2108 N ARG A 137 14.850 -8.752 -9.280 1.00 0.00 N ATOM 2109 CA ARG A 137 14.865 -7.686 -10.287 1.00 0.00 C ATOM 2110 C ARG A 137 14.561 -8.236 -11.679 1.00 0.00 C ATOM 2111 O ARG A 137 15.423 -8.818 -12.335 1.00 0.00 O ATOM 2112 CB ARG A 137 16.197 -6.932 -10.267 1.00 0.00 C ATOM 2113 CG ARG A 137 16.372 -6.050 -9.043 1.00 0.00 C ATOM 2114 CD ARG A 137 17.801 -5.556 -8.905 1.00 0.00 C ATOM 2115 NE ARG A 137 18.722 -6.644 -8.579 1.00 0.00 N ATOM 2116 CZ ARG A 137 19.833 -6.486 -7.865 1.00 0.00 C ATOM 2117 NH1 ARG A 137 20.225 -5.273 -7.502 1.00 0.00 N ATOM 2118 NH2 ARG A 137 20.567 -7.539 -7.542 1.00 0.00 N ATOM 0 H ARG A 137 14.160 -8.609 -8.543 1.00 0.00 H new ATOM 0 HA ARG A 137 14.077 -6.977 -10.034 1.00 0.00 H new ATOM 0 HB2 ARG A 137 17.014 -7.652 -10.307 1.00 0.00 H new ATOM 0 HB3 ARG A 137 16.271 -6.316 -11.163 1.00 0.00 H new ATOM 0 HG2 ARG A 137 15.697 -5.197 -9.110 1.00 0.00 H new ATOM 0 HG3 ARG A 137 16.092 -6.608 -8.150 1.00 0.00 H new ATOM 0 HD2 ARG A 137 18.113 -5.082 -9.835 1.00 0.00 H new ATOM 0 HD3 ARG A 137 17.849 -4.794 -8.127 1.00 0.00 H new ATOM 0 HE ARG A 137 18.499 -7.579 -8.919 1.00 0.00 H new ATOM 0 HH11 ARG A 137 19.674 -4.457 -7.770 1.00 0.00 H new ATOM 0 HH12 ARG A 137 21.077 -5.155 -6.954 1.00 0.00 H new ATOM 0 HH21 ARG A 137 20.281 -8.471 -7.841 1.00 0.00 H new ATOM 0 HH22 ARG A 137 21.419 -7.418 -6.994 1.00 0.00 H new ATOM 2132 N PRO A 138 13.307 -8.057 -12.133 1.00 0.00 N ATOM 2133 CA PRO A 138 12.820 -8.606 -13.406 1.00 0.00 C ATOM 2134 C PRO A 138 13.721 -8.278 -14.588 1.00 0.00 C ATOM 2135 O PRO A 138 13.774 -7.140 -15.058 1.00 0.00 O ATOM 2136 CB PRO A 138 11.457 -7.949 -13.576 1.00 0.00 C ATOM 2137 CG PRO A 138 11.014 -7.680 -12.187 1.00 0.00 C ATOM 2138 CD PRO A 138 12.256 -7.296 -11.436 1.00 0.00 C ATOM 0 HA PRO A 138 12.790 -9.695 -13.383 1.00 0.00 H new ATOM 0 HB2 PRO A 138 11.526 -7.030 -14.158 1.00 0.00 H new ATOM 0 HB3 PRO A 138 10.760 -8.605 -14.098 1.00 0.00 H new ATOM 0 HG2 PRO A 138 10.275 -6.879 -12.159 1.00 0.00 H new ATOM 0 HG3 PRO A 138 10.546 -8.561 -11.747 1.00 0.00 H new ATOM 0 HD2 PRO A 138 12.439 -6.222 -11.478 1.00 0.00 H new ATOM 0 HD3 PRO A 138 12.192 -7.567 -10.382 1.00 0.00 H new ATOM 2146 N ALA A 139 14.423 -9.295 -15.045 1.00 0.00 N ATOM 2147 CA ALA A 139 15.353 -9.180 -16.160 1.00 0.00 C ATOM 2148 C ALA A 139 15.869 -10.560 -16.532 1.00 0.00 C ATOM 2149 O ALA A 139 16.993 -10.711 -17.014 1.00 0.00 O ATOM 2150 CB ALA A 139 16.517 -8.262 -15.801 1.00 0.00 C ATOM 0 H ALA A 139 14.367 -10.235 -14.652 1.00 0.00 H new ATOM 0 HA ALA A 139 14.830 -8.746 -17.012 1.00 0.00 H new ATOM 0 HB1 ALA A 139 17.199 -8.191 -16.648 1.00 0.00 H new ATOM 0 HB2 ALA A 139 16.136 -7.270 -15.557 1.00 0.00 H new ATOM 0 HB3 ALA A 139 17.049 -8.668 -14.941 1.00 0.00 H new ATOM 2156 N ASP A 140 15.029 -11.564 -16.322 1.00 0.00 N ATOM 2157 CA ASP A 140 15.438 -12.946 -16.507 1.00 0.00 C ATOM 2158 C ASP A 140 15.319 -13.354 -17.967 1.00 0.00 C ATOM 2159 O ASP A 140 14.195 -13.660 -18.415 1.00 0.00 O ATOM 2160 CB ASP A 140 14.599 -13.872 -15.628 1.00 0.00 C ATOM 2161 CG ASP A 140 15.098 -15.299 -15.659 1.00 0.00 C ATOM 2162 OD1 ASP A 140 16.260 -15.530 -15.263 1.00 0.00 O ATOM 2163 OD2 ASP A 140 14.336 -16.196 -16.072 1.00 0.00 O ATOM 2164 OXT ASP A 140 16.355 -13.369 -18.663 1.00 0.00 O ATOM 0 H ASP A 140 14.061 -11.446 -16.024 1.00 0.00 H new ATOM 0 HA ASP A 140 16.483 -13.034 -16.211 1.00 0.00 H new ATOM 0 HB2 ASP A 140 14.613 -13.506 -14.601 1.00 0.00 H new ATOM 0 HB3 ASP A 140 13.562 -13.845 -15.961 1.00 0.00 H new TER 2169 ASP A 140