USER MOD reduce.3.24.130724 H: found=0, std=0, add=871, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 872 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 116 GLN : amide:sc= 1.17 K(o=2.5,f=1.2) USER MOD Set 1.2: A 120 THR OG1 : rot -112:sc= 1.33 USER MOD Set 2.1: A 111 ASN : amide:sc= -0.179 X(o=1.1,f=1.3) USER MOD Set 2.2: A 112 SER OG : rot 73:sc= 1.26 USER MOD Set 3.1: A 56 THR OG1 : rot 152:sc= 1.4 USER MOD Set 3.2: A 92 SER OG : rot 180:sc= 0.989 USER MOD Set 4.1: A 70 TYR OH : rot 180:sc= 0 USER MOD Set 4.2: A 74 GLN : amide:sc= 0.518 K(o=0.52,f=0) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -168:sc= 1.15 (180deg=1.06) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 71:sc= 0.0887 USER MOD Single : A 10 SER OG : rot 160:sc= 0.14 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 HIS : no HD1:sc= -0.161 X(o=-0.16,f=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 33 THR OG1 : rot -164:sc= 0.204 USER MOD Single : A 35 THR OG1 : rot 150:sc= 0 USER MOD Single : A 37 HIS : no HE2:sc= 0.0101 K(o=0.01,f=-0.66) USER MOD Single : A 47 SER OG : rot 2:sc= 0.483 USER MOD Single : A 54 SER OG : rot 130:sc= -0.103 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 65 ASN : amide:sc= 0.602 K(o=0.6,f=-4.1!) USER MOD Single : A 67 SER OG : rot 180:sc= -0.225 USER MOD Single : A 76 GLN : amide:sc= 1.05 K(o=1,f=-0.46) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 SER OG : rot 137:sc= 1.31 USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 THR OG1 : rot -30:sc= 0.847 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 1.12 (180deg=1.12) USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 144 ASN : amide:sc= 0.826 K(o=0.83,f=0) USER MOD Single : A 147 LYS NZ :NH3+ 171:sc= 1.03 (180deg=0.95) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 2.437 -1.797 1.366 1.00 0.00 N ATOM 2 CA MET A 1 2.668 -1.006 0.137 1.00 0.00 C ATOM 3 C MET A 1 3.840 -0.052 0.369 1.00 0.00 C ATOM 4 O MET A 1 3.892 0.640 1.390 1.00 0.00 O ATOM 5 CB MET A 1 1.397 -0.262 -0.321 1.00 0.00 C ATOM 6 CG MET A 1 1.612 0.511 -1.630 1.00 0.00 C ATOM 7 SD MET A 1 2.249 -0.483 -3.011 1.00 0.00 S ATOM 8 CE MET A 1 2.514 0.829 -4.233 1.00 0.00 C ATOM 0 H1 MET A 1 1.786 -2.581 1.157 1.00 0.00 H new ATOM 0 H2 MET A 1 3.342 -2.180 1.708 1.00 0.00 H new ATOM 0 H3 MET A 1 2.021 -1.187 2.098 1.00 0.00 H new ATOM 0 HA MET A 1 2.922 -1.685 -0.677 1.00 0.00 H new ATOM 0 HB2 MET A 1 0.587 -0.979 -0.455 1.00 0.00 H new ATOM 0 HB3 MET A 1 1.083 0.431 0.460 1.00 0.00 H new ATOM 0 HG2 MET A 1 0.664 0.958 -1.930 1.00 0.00 H new ATOM 0 HG3 MET A 1 2.306 1.330 -1.441 1.00 0.00 H new ATOM 0 HE1 MET A 1 2.907 0.396 -5.153 1.00 0.00 H new ATOM 0 HE2 MET A 1 1.568 1.328 -4.442 1.00 0.00 H new ATOM 0 HE3 MET A 1 3.227 1.554 -3.840 1.00 0.00 H new ATOM 20 N ALA A 2 4.789 -0.015 -0.572 1.00 0.00 N ATOM 21 CA ALA A 2 6.051 0.692 -0.436 1.00 0.00 C ATOM 22 C ALA A 2 6.561 1.125 -1.811 1.00 0.00 C ATOM 23 O ALA A 2 6.137 0.593 -2.838 1.00 0.00 O ATOM 24 CB ALA A 2 7.064 -0.258 0.210 1.00 0.00 C ATOM 0 H ALA A 2 4.691 -0.490 -1.469 1.00 0.00 H new ATOM 0 HA ALA A 2 5.915 1.581 0.180 1.00 0.00 H new ATOM 0 HB1 ALA A 2 8.021 0.252 0.322 1.00 0.00 H new ATOM 0 HB2 ALA A 2 6.700 -0.566 1.190 1.00 0.00 H new ATOM 0 HB3 ALA A 2 7.193 -1.137 -0.422 1.00 0.00 H new ATOM 30 N ASP A 3 7.517 2.051 -1.809 1.00 0.00 N ATOM 31 CA ASP A 3 8.293 2.466 -2.969 1.00 0.00 C ATOM 32 C ASP A 3 9.600 1.673 -3.065 1.00 0.00 C ATOM 33 O ASP A 3 10.152 1.524 -4.156 1.00 0.00 O ATOM 34 CB ASP A 3 8.633 3.955 -2.847 1.00 0.00 C ATOM 35 CG ASP A 3 9.269 4.488 -4.143 1.00 0.00 C ATOM 36 OD1 ASP A 3 8.576 4.516 -5.186 1.00 0.00 O ATOM 37 OD2 ASP A 3 10.436 4.930 -4.111 1.00 0.00 O ATOM 0 H ASP A 3 7.781 2.553 -0.961 1.00 0.00 H new ATOM 0 HA ASP A 3 7.697 2.280 -3.863 1.00 0.00 H new ATOM 0 HB2 ASP A 3 7.728 4.520 -2.623 1.00 0.00 H new ATOM 0 HB3 ASP A 3 9.318 4.107 -2.013 1.00 0.00 H new ATOM 42 N ILE A 4 10.083 1.150 -1.928 1.00 0.00 N ATOM 43 CA ILE A 4 11.367 0.469 -1.808 1.00 0.00 C ATOM 44 C ILE A 4 11.157 -0.814 -0.999 1.00 0.00 C ATOM 45 O ILE A 4 10.659 -0.759 0.130 1.00 0.00 O ATOM 46 CB ILE A 4 12.414 1.391 -1.123 1.00 0.00 C ATOM 47 CG1 ILE A 4 12.531 2.790 -1.779 1.00 0.00 C ATOM 48 CG2 ILE A 4 13.784 0.693 -1.123 1.00 0.00 C ATOM 49 CD1 ILE A 4 13.392 3.798 -1.005 1.00 0.00 C ATOM 0 H ILE A 4 9.572 1.194 -1.046 1.00 0.00 H new ATOM 0 HA ILE A 4 11.751 0.221 -2.798 1.00 0.00 H new ATOM 0 HB ILE A 4 12.068 1.561 -0.103 1.00 0.00 H new ATOM 0 HG12 ILE A 4 12.947 2.672 -2.780 1.00 0.00 H new ATOM 0 HG13 ILE A 4 11.530 3.205 -1.897 1.00 0.00 H new ATOM 0 HG21 ILE A 4 14.521 1.337 -0.643 1.00 0.00 H new ATOM 0 HG22 ILE A 4 13.713 -0.247 -0.576 1.00 0.00 H new ATOM 0 HG23 ILE A 4 14.091 0.493 -2.150 1.00 0.00 H new ATOM 0 HD11 ILE A 4 13.414 4.746 -1.542 1.00 0.00 H new ATOM 0 HD12 ILE A 4 12.968 3.953 -0.013 1.00 0.00 H new ATOM 0 HD13 ILE A 4 14.407 3.412 -0.910 1.00 0.00 H new ATOM 61 N THR A 5 11.538 -1.961 -1.562 1.00 0.00 N ATOM 62 CA THR A 5 11.613 -3.225 -0.837 1.00 0.00 C ATOM 63 C THR A 5 13.005 -3.248 -0.177 1.00 0.00 C ATOM 64 O THR A 5 13.997 -2.924 -0.839 1.00 0.00 O ATOM 65 CB THR A 5 11.349 -4.404 -1.819 1.00 0.00 C ATOM 66 OG1 THR A 5 11.375 -5.653 -1.164 1.00 0.00 O ATOM 67 CG2 THR A 5 12.307 -4.494 -3.011 1.00 0.00 C ATOM 0 H THR A 5 11.805 -2.037 -2.543 1.00 0.00 H new ATOM 0 HA THR A 5 10.855 -3.329 -0.061 1.00 0.00 H new ATOM 0 HB THR A 5 10.356 -4.176 -2.206 1.00 0.00 H new ATOM 0 HG1 THR A 5 11.203 -6.367 -1.813 1.00 0.00 H new ATOM 0 HG21 THR A 5 12.036 -5.348 -3.632 1.00 0.00 H new ATOM 0 HG22 THR A 5 12.240 -3.580 -3.602 1.00 0.00 H new ATOM 0 HG23 THR A 5 13.328 -4.618 -2.649 1.00 0.00 H new ATOM 75 N LEU A 6 13.100 -3.592 1.112 1.00 0.00 N ATOM 76 CA LEU A 6 14.366 -3.755 1.827 1.00 0.00 C ATOM 77 C LEU A 6 14.519 -5.242 2.088 1.00 0.00 C ATOM 78 O LEU A 6 14.010 -5.776 3.076 1.00 0.00 O ATOM 79 CB LEU A 6 14.418 -2.970 3.145 1.00 0.00 C ATOM 80 CG LEU A 6 14.771 -1.482 2.965 1.00 0.00 C ATOM 81 CD1 LEU A 6 13.535 -0.644 2.629 1.00 0.00 C ATOM 82 CD2 LEU A 6 15.435 -0.935 4.231 1.00 0.00 C ATOM 0 H LEU A 6 12.283 -3.768 1.696 1.00 0.00 H new ATOM 0 HA LEU A 6 15.181 -3.357 1.223 1.00 0.00 H new ATOM 0 HB2 LEU A 6 13.451 -3.047 3.642 1.00 0.00 H new ATOM 0 HB3 LEU A 6 15.153 -3.432 3.804 1.00 0.00 H new ATOM 0 HG LEU A 6 15.467 -1.411 2.129 1.00 0.00 H new ATOM 0 HD11 LEU A 6 13.825 0.400 2.510 1.00 0.00 H new ATOM 0 HD12 LEU A 6 13.091 -1.006 1.701 1.00 0.00 H new ATOM 0 HD13 LEU A 6 12.808 -0.729 3.436 1.00 0.00 H new ATOM 0 HD21 LEU A 6 15.679 0.118 4.088 1.00 0.00 H new ATOM 0 HD22 LEU A 6 14.752 -1.038 5.074 1.00 0.00 H new ATOM 0 HD23 LEU A 6 16.348 -1.494 4.434 1.00 0.00 H new ATOM 94 N ILE A 7 15.188 -5.900 1.153 1.00 0.00 N ATOM 95 CA ILE A 7 15.359 -7.336 1.119 1.00 0.00 C ATOM 96 C ILE A 7 16.449 -7.672 2.143 1.00 0.00 C ATOM 97 O ILE A 7 17.621 -7.333 1.955 1.00 0.00 O ATOM 98 CB ILE A 7 15.692 -7.805 -0.320 1.00 0.00 C ATOM 99 CG1 ILE A 7 14.669 -7.264 -1.355 1.00 0.00 C ATOM 100 CG2 ILE A 7 15.710 -9.343 -0.346 1.00 0.00 C ATOM 101 CD1 ILE A 7 14.994 -7.615 -2.813 1.00 0.00 C ATOM 0 H ILE A 7 15.641 -5.427 0.371 1.00 0.00 H new ATOM 0 HA ILE A 7 14.446 -7.868 1.387 1.00 0.00 H new ATOM 0 HB ILE A 7 16.669 -7.410 -0.598 1.00 0.00 H new ATOM 0 HG12 ILE A 7 13.682 -7.657 -1.111 1.00 0.00 H new ATOM 0 HG13 ILE A 7 14.613 -6.180 -1.259 1.00 0.00 H new ATOM 0 HG21 ILE A 7 15.943 -9.687 -1.354 1.00 0.00 H new ATOM 0 HG22 ILE A 7 16.467 -9.710 0.347 1.00 0.00 H new ATOM 0 HG23 ILE A 7 14.732 -9.723 -0.050 1.00 0.00 H new ATOM 0 HD11 ILE A 7 14.228 -7.198 -3.467 1.00 0.00 H new ATOM 0 HD12 ILE A 7 15.965 -7.198 -3.080 1.00 0.00 H new ATOM 0 HD13 ILE A 7 15.020 -8.698 -2.929 1.00 0.00 H new ATOM 113 N SER A 8 16.047 -8.336 3.220 1.00 0.00 N ATOM 114 CA SER A 8 16.874 -8.717 4.354 1.00 0.00 C ATOM 115 C SER A 8 16.673 -10.227 4.576 1.00 0.00 C ATOM 116 O SER A 8 16.166 -10.921 3.690 1.00 0.00 O ATOM 117 CB SER A 8 16.474 -7.864 5.574 1.00 0.00 C ATOM 118 OG SER A 8 16.127 -6.534 5.217 1.00 0.00 O ATOM 0 H SER A 8 15.079 -8.639 3.330 1.00 0.00 H new ATOM 0 HA SER A 8 17.935 -8.534 4.181 1.00 0.00 H new ATOM 0 HB2 SER A 8 15.630 -8.333 6.080 1.00 0.00 H new ATOM 0 HB3 SER A 8 17.300 -7.842 6.285 1.00 0.00 H new ATOM 0 HG SER A 8 15.270 -6.536 4.743 1.00 0.00 H new ATOM 124 N GLY A 9 17.032 -10.765 5.744 1.00 0.00 N ATOM 125 CA GLY A 9 16.820 -12.172 6.054 1.00 0.00 C ATOM 126 C GLY A 9 17.838 -13.076 5.364 1.00 0.00 C ATOM 127 O GLY A 9 17.506 -14.223 5.073 1.00 0.00 O ATOM 0 H GLY A 9 17.475 -10.236 6.495 1.00 0.00 H new ATOM 0 HA2 GLY A 9 16.880 -12.317 7.133 1.00 0.00 H new ATOM 0 HA3 GLY A 9 15.814 -12.462 5.749 1.00 0.00 H new ATOM 131 N SER A 10 19.045 -12.566 5.105 1.00 0.00 N ATOM 132 CA SER A 10 20.131 -13.133 4.307 1.00 0.00 C ATOM 133 C SER A 10 20.236 -14.665 4.343 1.00 0.00 C ATOM 134 O SER A 10 20.302 -15.303 3.290 1.00 0.00 O ATOM 135 CB SER A 10 21.441 -12.486 4.793 1.00 0.00 C ATOM 136 OG SER A 10 21.246 -11.126 5.157 1.00 0.00 O ATOM 0 H SER A 10 19.310 -11.658 5.487 1.00 0.00 H new ATOM 0 HA SER A 10 19.922 -12.909 3.261 1.00 0.00 H new ATOM 0 HB2 SER A 10 21.827 -13.041 5.648 1.00 0.00 H new ATOM 0 HB3 SER A 10 22.193 -12.549 4.006 1.00 0.00 H new ATOM 0 HG SER A 10 21.975 -10.837 5.745 1.00 0.00 H new ATOM 142 N THR A 11 20.212 -15.262 5.534 1.00 0.00 N ATOM 143 CA THR A 11 20.384 -16.693 5.759 1.00 0.00 C ATOM 144 C THR A 11 19.181 -17.195 6.572 1.00 0.00 C ATOM 145 O THR A 11 19.328 -17.797 7.637 1.00 0.00 O ATOM 146 CB THR A 11 21.766 -16.944 6.403 1.00 0.00 C ATOM 147 OG1 THR A 11 21.997 -16.092 7.514 1.00 0.00 O ATOM 148 CG2 THR A 11 22.908 -16.680 5.413 1.00 0.00 C ATOM 0 H THR A 11 20.067 -14.741 6.399 1.00 0.00 H new ATOM 0 HA THR A 11 20.392 -17.268 4.833 1.00 0.00 H new ATOM 0 HB THR A 11 21.752 -17.988 6.715 1.00 0.00 H new ATOM 0 HG1 THR A 11 22.880 -16.282 7.894 1.00 0.00 H new ATOM 0 HG21 THR A 11 23.864 -16.867 5.902 1.00 0.00 H new ATOM 0 HG22 THR A 11 22.805 -17.342 4.553 1.00 0.00 H new ATOM 0 HG23 THR A 11 22.868 -15.643 5.079 1.00 0.00 H new ATOM 156 N LEU A 12 17.971 -16.876 6.084 1.00 0.00 N ATOM 157 CA LEU A 12 16.690 -17.037 6.782 1.00 0.00 C ATOM 158 C LEU A 12 16.698 -16.237 8.100 1.00 0.00 C ATOM 159 O LEU A 12 16.090 -16.612 9.103 1.00 0.00 O ATOM 160 CB LEU A 12 16.307 -18.528 6.896 1.00 0.00 C ATOM 161 CG LEU A 12 14.824 -18.814 7.228 1.00 0.00 C ATOM 162 CD1 LEU A 12 13.853 -18.225 6.194 1.00 0.00 C ATOM 163 CD2 LEU A 12 14.610 -20.331 7.297 1.00 0.00 C ATOM 0 H LEU A 12 17.857 -16.481 5.150 1.00 0.00 H new ATOM 0 HA LEU A 12 15.879 -16.602 6.198 1.00 0.00 H new ATOM 0 HB2 LEU A 12 16.551 -19.020 5.955 1.00 0.00 H new ATOM 0 HB3 LEU A 12 16.928 -18.986 7.666 1.00 0.00 H new ATOM 0 HG LEU A 12 14.612 -18.337 8.185 1.00 0.00 H new ATOM 0 HD11 LEU A 12 12.828 -18.459 6.482 1.00 0.00 H new ATOM 0 HD12 LEU A 12 13.980 -17.143 6.151 1.00 0.00 H new ATOM 0 HD13 LEU A 12 14.061 -18.654 5.214 1.00 0.00 H new ATOM 0 HD21 LEU A 12 13.566 -20.541 7.531 1.00 0.00 H new ATOM 0 HD22 LEU A 12 14.864 -20.778 6.336 1.00 0.00 H new ATOM 0 HD23 LEU A 12 15.248 -20.753 8.073 1.00 0.00 H new ATOM 175 N GLY A 13 17.434 -15.126 8.086 1.00 0.00 N ATOM 176 CA GLY A 13 17.664 -14.191 9.174 1.00 0.00 C ATOM 177 C GLY A 13 18.839 -13.298 8.775 1.00 0.00 C ATOM 178 O GLY A 13 19.654 -13.700 7.940 1.00 0.00 O ATOM 0 H GLY A 13 17.924 -14.838 7.239 1.00 0.00 H new ATOM 0 HA2 GLY A 13 16.773 -13.591 9.359 1.00 0.00 H new ATOM 0 HA3 GLY A 13 17.886 -14.725 10.098 1.00 0.00 H new ATOM 182 N GLY A 14 18.917 -12.087 9.319 1.00 0.00 N ATOM 183 CA GLY A 14 19.905 -11.094 8.931 1.00 0.00 C ATOM 184 C GLY A 14 19.795 -9.844 9.805 1.00 0.00 C ATOM 185 O GLY A 14 19.261 -9.890 10.918 1.00 0.00 O ATOM 0 H GLY A 14 18.285 -11.766 10.052 1.00 0.00 H new ATOM 0 HA2 GLY A 14 20.906 -11.517 9.019 1.00 0.00 H new ATOM 0 HA3 GLY A 14 19.764 -10.824 7.884 1.00 0.00 H new ATOM 189 N ALA A 15 20.336 -8.728 9.310 1.00 0.00 N ATOM 190 CA ALA A 15 20.423 -7.445 10.003 1.00 0.00 C ATOM 191 C ALA A 15 19.080 -6.686 10.013 1.00 0.00 C ATOM 192 O ALA A 15 19.056 -5.474 9.797 1.00 0.00 O ATOM 193 CB ALA A 15 21.548 -6.618 9.357 1.00 0.00 C ATOM 0 H ALA A 15 20.742 -8.695 8.375 1.00 0.00 H new ATOM 0 HA ALA A 15 20.658 -7.624 11.052 1.00 0.00 H new ATOM 0 HB1 ALA A 15 21.628 -5.655 9.862 1.00 0.00 H new ATOM 0 HB2 ALA A 15 22.492 -7.155 9.448 1.00 0.00 H new ATOM 0 HB3 ALA A 15 21.322 -6.457 8.303 1.00 0.00 H new ATOM 199 N GLU A 16 17.954 -7.372 10.233 1.00 0.00 N ATOM 200 CA GLU A 16 16.614 -6.791 10.119 1.00 0.00 C ATOM 201 C GLU A 16 16.424 -5.568 11.026 1.00 0.00 C ATOM 202 O GLU A 16 15.708 -4.646 10.648 1.00 0.00 O ATOM 203 CB GLU A 16 15.515 -7.822 10.430 1.00 0.00 C ATOM 204 CG GLU A 16 15.223 -8.805 9.287 1.00 0.00 C ATOM 205 CD GLU A 16 16.351 -9.820 9.075 1.00 0.00 C ATOM 206 OE1 GLU A 16 16.348 -10.876 9.750 1.00 0.00 O ATOM 207 OE2 GLU A 16 17.230 -9.559 8.225 1.00 0.00 O ATOM 0 H GLU A 16 17.948 -8.357 10.498 1.00 0.00 H new ATOM 0 HA GLU A 16 16.523 -6.470 9.081 1.00 0.00 H new ATOM 0 HB2 GLU A 16 15.806 -8.389 11.314 1.00 0.00 H new ATOM 0 HB3 GLU A 16 14.596 -7.291 10.679 1.00 0.00 H new ATOM 0 HG2 GLU A 16 14.296 -9.338 9.500 1.00 0.00 H new ATOM 0 HG3 GLU A 16 15.065 -8.246 8.365 1.00 0.00 H new ATOM 214 N TYR A 17 17.076 -5.523 12.195 1.00 0.00 N ATOM 215 CA TYR A 17 17.022 -4.358 13.078 1.00 0.00 C ATOM 216 C TYR A 17 17.586 -3.114 12.376 1.00 0.00 C ATOM 217 O TYR A 17 17.004 -2.029 12.453 1.00 0.00 O ATOM 218 CB TYR A 17 17.803 -4.662 14.365 1.00 0.00 C ATOM 219 CG TYR A 17 17.886 -3.494 15.332 1.00 0.00 C ATOM 220 CD1 TYR A 17 16.790 -3.188 16.163 1.00 0.00 C ATOM 221 CD2 TYR A 17 19.050 -2.703 15.389 1.00 0.00 C ATOM 222 CE1 TYR A 17 16.856 -2.098 17.049 1.00 0.00 C ATOM 223 CE2 TYR A 17 19.123 -1.610 16.272 1.00 0.00 C ATOM 224 CZ TYR A 17 18.024 -1.303 17.108 1.00 0.00 C ATOM 225 OH TYR A 17 18.075 -0.248 17.970 1.00 0.00 O ATOM 0 H TYR A 17 17.650 -6.288 12.550 1.00 0.00 H new ATOM 0 HA TYR A 17 15.983 -4.148 13.332 1.00 0.00 H new ATOM 0 HB2 TYR A 17 17.334 -5.506 14.871 1.00 0.00 H new ATOM 0 HB3 TYR A 17 18.814 -4.972 14.099 1.00 0.00 H new ATOM 0 HD1 TYR A 17 15.896 -3.793 16.119 1.00 0.00 H new ATOM 0 HD2 TYR A 17 19.890 -2.937 14.752 1.00 0.00 H new ATOM 0 HE1 TYR A 17 16.014 -1.868 17.685 1.00 0.00 H new ATOM 0 HE2 TYR A 17 20.017 -1.006 16.311 1.00 0.00 H new ATOM 0 HH TYR A 17 18.945 0.197 17.892 1.00 0.00 H new ATOM 235 N VAL A 18 18.700 -3.273 11.657 1.00 0.00 N ATOM 236 CA VAL A 18 19.332 -2.185 10.926 1.00 0.00 C ATOM 237 C VAL A 18 18.472 -1.860 9.704 1.00 0.00 C ATOM 238 O VAL A 18 18.267 -0.685 9.403 1.00 0.00 O ATOM 239 CB VAL A 18 20.780 -2.563 10.541 1.00 0.00 C ATOM 240 CG1 VAL A 18 21.535 -1.340 10.007 1.00 0.00 C ATOM 241 CG2 VAL A 18 21.577 -3.127 11.732 1.00 0.00 C ATOM 0 H VAL A 18 19.186 -4.165 11.569 1.00 0.00 H new ATOM 0 HA VAL A 18 19.400 -1.294 11.550 1.00 0.00 H new ATOM 0 HB VAL A 18 20.697 -3.333 9.774 1.00 0.00 H new ATOM 0 HG11 VAL A 18 22.552 -1.628 9.742 1.00 0.00 H new ATOM 0 HG12 VAL A 18 21.025 -0.954 9.124 1.00 0.00 H new ATOM 0 HG13 VAL A 18 21.565 -0.567 10.775 1.00 0.00 H new ATOM 0 HG21 VAL A 18 22.587 -3.377 11.408 1.00 0.00 H new ATOM 0 HG22 VAL A 18 21.624 -2.380 12.525 1.00 0.00 H new ATOM 0 HG23 VAL A 18 21.084 -4.024 12.107 1.00 0.00 H new ATOM 251 N ALA A 19 17.918 -2.876 9.031 1.00 0.00 N ATOM 252 CA ALA A 19 17.018 -2.673 7.903 1.00 0.00 C ATOM 253 C ALA A 19 15.792 -1.856 8.323 1.00 0.00 C ATOM 254 O ALA A 19 15.380 -0.971 7.582 1.00 0.00 O ATOM 255 CB ALA A 19 16.615 -4.014 7.289 1.00 0.00 C ATOM 0 H ALA A 19 18.084 -3.857 9.257 1.00 0.00 H new ATOM 0 HA ALA A 19 17.545 -2.102 7.139 1.00 0.00 H new ATOM 0 HB1 ALA A 19 15.943 -3.842 6.448 1.00 0.00 H new ATOM 0 HB2 ALA A 19 17.506 -4.537 6.940 1.00 0.00 H new ATOM 0 HB3 ALA A 19 16.109 -4.621 8.040 1.00 0.00 H new ATOM 261 N GLU A 20 15.233 -2.096 9.512 1.00 0.00 N ATOM 262 CA GLU A 20 14.097 -1.329 10.013 1.00 0.00 C ATOM 263 C GLU A 20 14.490 0.135 10.262 1.00 0.00 C ATOM 264 O GLU A 20 13.726 1.042 9.929 1.00 0.00 O ATOM 265 CB GLU A 20 13.546 -2.000 11.281 1.00 0.00 C ATOM 266 CG GLU A 20 12.192 -1.406 11.687 1.00 0.00 C ATOM 267 CD GLU A 20 11.613 -2.115 12.924 1.00 0.00 C ATOM 268 OE1 GLU A 20 11.894 -1.686 14.066 1.00 0.00 O ATOM 269 OE2 GLU A 20 10.849 -3.096 12.770 1.00 0.00 O ATOM 0 H GLU A 20 15.555 -2.824 10.149 1.00 0.00 H new ATOM 0 HA GLU A 20 13.308 -1.318 9.261 1.00 0.00 H new ATOM 0 HB2 GLU A 20 13.438 -3.071 11.110 1.00 0.00 H new ATOM 0 HB3 GLU A 20 14.258 -1.878 12.097 1.00 0.00 H new ATOM 0 HG2 GLU A 20 12.308 -0.343 11.897 1.00 0.00 H new ATOM 0 HG3 GLU A 20 11.492 -1.492 10.856 1.00 0.00 H new ATOM 276 N HIS A 21 15.685 0.388 10.809 1.00 0.00 N ATOM 277 CA HIS A 21 16.172 1.750 11.015 1.00 0.00 C ATOM 278 C HIS A 21 16.361 2.457 9.667 1.00 0.00 C ATOM 279 O HIS A 21 15.948 3.603 9.497 1.00 0.00 O ATOM 280 CB HIS A 21 17.475 1.720 11.825 1.00 0.00 C ATOM 281 CG HIS A 21 17.946 3.096 12.233 1.00 0.00 C ATOM 282 ND1 HIS A 21 17.735 3.707 13.450 1.00 0.00 N ATOM 283 CD2 HIS A 21 18.643 3.981 11.453 1.00 0.00 C ATOM 284 CE1 HIS A 21 18.295 4.928 13.405 1.00 0.00 C ATOM 285 NE2 HIS A 21 18.865 5.144 12.204 1.00 0.00 N ATOM 0 H HIS A 21 16.332 -0.338 11.117 1.00 0.00 H new ATOM 0 HA HIS A 21 15.434 2.317 11.583 1.00 0.00 H new ATOM 0 HB2 HIS A 21 17.328 1.112 12.718 1.00 0.00 H new ATOM 0 HB3 HIS A 21 18.253 1.236 11.235 1.00 0.00 H new ATOM 0 HD2 HIS A 21 18.965 3.812 10.436 1.00 0.00 H new ATOM 0 HE1 HIS A 21 18.289 5.638 14.219 1.00 0.00 H new ATOM 0 HE2 HIS A 21 19.358 5.984 11.902 1.00 0.00 H new ATOM 293 N LEU A 22 16.962 1.769 8.695 1.00 0.00 N ATOM 294 CA LEU A 22 17.184 2.267 7.342 1.00 0.00 C ATOM 295 C LEU A 22 15.858 2.629 6.682 1.00 0.00 C ATOM 296 O LEU A 22 15.704 3.732 6.158 1.00 0.00 O ATOM 297 CB LEU A 22 17.888 1.173 6.528 1.00 0.00 C ATOM 298 CG LEU A 22 19.406 1.131 6.777 1.00 0.00 C ATOM 299 CD1 LEU A 22 19.960 -0.241 6.391 1.00 0.00 C ATOM 300 CD2 LEU A 22 20.139 2.224 5.990 1.00 0.00 C ATOM 0 H LEU A 22 17.317 0.823 8.834 1.00 0.00 H new ATOM 0 HA LEU A 22 17.802 3.164 7.381 1.00 0.00 H new ATOM 0 HB2 LEU A 22 17.456 0.204 6.779 1.00 0.00 H new ATOM 0 HB3 LEU A 22 17.703 1.339 5.467 1.00 0.00 H new ATOM 0 HG LEU A 22 19.573 1.311 7.839 1.00 0.00 H new ATOM 0 HD11 LEU A 22 21.035 -0.263 6.570 1.00 0.00 H new ATOM 0 HD12 LEU A 22 19.476 -1.011 6.992 1.00 0.00 H new ATOM 0 HD13 LEU A 22 19.764 -0.429 5.335 1.00 0.00 H new ATOM 0 HD21 LEU A 22 21.208 2.162 6.192 1.00 0.00 H new ATOM 0 HD22 LEU A 22 19.962 2.085 4.923 1.00 0.00 H new ATOM 0 HD23 LEU A 22 19.768 3.203 6.295 1.00 0.00 H new ATOM 312 N ALA A 23 14.899 1.706 6.736 1.00 0.00 N ATOM 313 CA ALA A 23 13.538 1.912 6.271 1.00 0.00 C ATOM 314 C ALA A 23 12.943 3.184 6.878 1.00 0.00 C ATOM 315 O ALA A 23 12.408 3.995 6.128 1.00 0.00 O ATOM 316 CB ALA A 23 12.677 0.692 6.611 1.00 0.00 C ATOM 0 H ALA A 23 15.056 0.772 7.115 1.00 0.00 H new ATOM 0 HA ALA A 23 13.555 2.035 5.188 1.00 0.00 H new ATOM 0 HB1 ALA A 23 11.659 0.856 6.259 1.00 0.00 H new ATOM 0 HB2 ALA A 23 13.091 -0.192 6.126 1.00 0.00 H new ATOM 0 HB3 ALA A 23 12.668 0.543 7.691 1.00 0.00 H new ATOM 322 N GLU A 24 13.067 3.386 8.195 1.00 0.00 N ATOM 323 CA GLU A 24 12.533 4.559 8.887 1.00 0.00 C ATOM 324 C GLU A 24 13.101 5.844 8.284 1.00 0.00 C ATOM 325 O GLU A 24 12.351 6.731 7.870 1.00 0.00 O ATOM 326 CB GLU A 24 12.880 4.480 10.384 1.00 0.00 C ATOM 327 CG GLU A 24 12.027 5.403 11.264 1.00 0.00 C ATOM 328 CD GLU A 24 10.570 4.921 11.391 1.00 0.00 C ATOM 329 OE1 GLU A 24 10.281 4.066 12.260 1.00 0.00 O ATOM 330 OE2 GLU A 24 9.693 5.415 10.648 1.00 0.00 O ATOM 0 H GLU A 24 13.546 2.732 8.814 1.00 0.00 H new ATOM 0 HA GLU A 24 11.450 4.573 8.768 1.00 0.00 H new ATOM 0 HB2 GLU A 24 12.755 3.452 10.723 1.00 0.00 H new ATOM 0 HB3 GLU A 24 13.931 4.734 10.518 1.00 0.00 H new ATOM 0 HG2 GLU A 24 12.473 5.466 12.257 1.00 0.00 H new ATOM 0 HG3 GLU A 24 12.038 6.409 10.845 1.00 0.00 H new ATOM 337 N LYS A 25 14.431 5.932 8.186 1.00 0.00 N ATOM 338 CA LYS A 25 15.107 7.075 7.581 1.00 0.00 C ATOM 339 C LYS A 25 14.632 7.331 6.152 1.00 0.00 C ATOM 340 O LYS A 25 14.498 8.479 5.740 1.00 0.00 O ATOM 341 CB LYS A 25 16.612 6.805 7.573 1.00 0.00 C ATOM 342 CG LYS A 25 17.246 6.755 8.971 1.00 0.00 C ATOM 343 CD LYS A 25 17.145 8.021 9.829 1.00 0.00 C ATOM 344 CE LYS A 25 17.435 9.353 9.126 1.00 0.00 C ATOM 345 NZ LYS A 25 18.776 9.413 8.488 1.00 0.00 N ATOM 0 H LYS A 25 15.067 5.210 8.525 1.00 0.00 H new ATOM 0 HA LYS A 25 14.872 7.962 8.170 1.00 0.00 H new ATOM 0 HB2 LYS A 25 16.798 5.858 7.067 1.00 0.00 H new ATOM 0 HB3 LYS A 25 17.107 7.581 6.989 1.00 0.00 H new ATOM 0 HG2 LYS A 25 16.785 5.935 9.522 1.00 0.00 H new ATOM 0 HG3 LYS A 25 18.301 6.508 8.855 1.00 0.00 H new ATOM 0 HD2 LYS A 25 16.140 8.069 10.248 1.00 0.00 H new ATOM 0 HD3 LYS A 25 17.835 7.921 10.667 1.00 0.00 H new ATOM 0 HE2 LYS A 25 16.673 9.526 8.366 1.00 0.00 H new ATOM 0 HE3 LYS A 25 17.351 10.162 9.851 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 18.903 10.340 8.033 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 19.511 9.279 9.211 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 18.854 8.662 7.772 1.00 0.00 H new ATOM 359 N LEU A 26 14.398 6.276 5.381 1.00 0.00 N ATOM 360 CA LEU A 26 13.921 6.401 4.012 1.00 0.00 C ATOM 361 C LEU A 26 12.449 6.812 3.942 1.00 0.00 C ATOM 362 O LEU A 26 12.063 7.458 2.969 1.00 0.00 O ATOM 363 CB LEU A 26 14.172 5.098 3.248 1.00 0.00 C ATOM 364 CG LEU A 26 15.660 4.837 2.957 1.00 0.00 C ATOM 365 CD1 LEU A 26 15.820 3.430 2.381 1.00 0.00 C ATOM 366 CD2 LEU A 26 16.250 5.873 1.992 1.00 0.00 C ATOM 0 H LEU A 26 14.534 5.313 5.687 1.00 0.00 H new ATOM 0 HA LEU A 26 14.486 7.203 3.537 1.00 0.00 H new ATOM 0 HB2 LEU A 26 13.771 4.264 3.824 1.00 0.00 H new ATOM 0 HB3 LEU A 26 13.625 5.127 2.306 1.00 0.00 H new ATOM 0 HG LEU A 26 16.209 4.923 3.895 1.00 0.00 H new ATOM 0 HD11 LEU A 26 16.873 3.240 2.173 1.00 0.00 H new ATOM 0 HD12 LEU A 26 15.454 2.698 3.101 1.00 0.00 H new ATOM 0 HD13 LEU A 26 15.247 3.348 1.457 1.00 0.00 H new ATOM 0 HD21 LEU A 26 17.302 5.649 1.816 1.00 0.00 H new ATOM 0 HD22 LEU A 26 15.709 5.839 1.047 1.00 0.00 H new ATOM 0 HD23 LEU A 26 16.159 6.868 2.427 1.00 0.00 H new ATOM 378 N GLU A 27 11.615 6.521 4.942 1.00 0.00 N ATOM 379 CA GLU A 27 10.283 7.084 4.992 1.00 0.00 C ATOM 380 C GLU A 27 10.370 8.578 5.317 1.00 0.00 C ATOM 381 O GLU A 27 9.677 9.379 4.688 1.00 0.00 O ATOM 382 CB GLU A 27 9.404 6.315 5.983 1.00 0.00 C ATOM 383 CG GLU A 27 9.182 4.856 5.547 1.00 0.00 C ATOM 384 CD GLU A 27 7.827 4.258 5.964 1.00 0.00 C ATOM 385 OE1 GLU A 27 7.399 4.425 7.131 1.00 0.00 O ATOM 386 OE2 GLU A 27 7.189 3.588 5.119 1.00 0.00 O ATOM 0 H GLU A 27 11.845 5.902 5.719 1.00 0.00 H new ATOM 0 HA GLU A 27 9.806 6.984 4.017 1.00 0.00 H new ATOM 0 HB2 GLU A 27 9.869 6.332 6.969 1.00 0.00 H new ATOM 0 HB3 GLU A 27 8.440 6.816 6.077 1.00 0.00 H new ATOM 0 HG2 GLU A 27 9.271 4.798 4.462 1.00 0.00 H new ATOM 0 HG3 GLU A 27 9.979 4.241 5.965 1.00 0.00 H new ATOM 393 N GLU A 28 11.283 8.988 6.207 1.00 0.00 N ATOM 394 CA GLU A 28 11.564 10.389 6.484 1.00 0.00 C ATOM 395 C GLU A 28 12.099 11.113 5.234 1.00 0.00 C ATOM 396 O GLU A 28 11.900 12.322 5.101 1.00 0.00 O ATOM 397 CB GLU A 28 12.572 10.489 7.641 1.00 0.00 C ATOM 398 CG GLU A 28 12.052 10.052 9.016 1.00 0.00 C ATOM 399 CD GLU A 28 11.002 11.025 9.584 1.00 0.00 C ATOM 400 OE1 GLU A 28 11.384 12.022 10.238 1.00 0.00 O ATOM 401 OE2 GLU A 28 9.784 10.798 9.402 1.00 0.00 O ATOM 0 H GLU A 28 11.850 8.343 6.757 1.00 0.00 H new ATOM 0 HA GLU A 28 10.634 10.880 6.770 1.00 0.00 H new ATOM 0 HB2 GLU A 28 13.443 9.883 7.393 1.00 0.00 H new ATOM 0 HB3 GLU A 28 12.913 11.522 7.713 1.00 0.00 H new ATOM 0 HG2 GLU A 28 11.615 9.057 8.936 1.00 0.00 H new ATOM 0 HG3 GLU A 28 12.888 9.978 9.711 1.00 0.00 H new ATOM 408 N ALA A 29 12.733 10.391 4.297 1.00 0.00 N ATOM 409 CA ALA A 29 13.187 10.932 3.017 1.00 0.00 C ATOM 410 C ALA A 29 12.022 11.240 2.060 1.00 0.00 C ATOM 411 O ALA A 29 12.249 11.863 1.020 1.00 0.00 O ATOM 412 CB ALA A 29 14.201 9.983 2.362 1.00 0.00 C ATOM 0 H ALA A 29 12.945 9.400 4.414 1.00 0.00 H new ATOM 0 HA ALA A 29 13.678 11.882 3.226 1.00 0.00 H new ATOM 0 HB1 ALA A 29 14.528 10.401 1.410 1.00 0.00 H new ATOM 0 HB2 ALA A 29 15.062 9.860 3.020 1.00 0.00 H new ATOM 0 HB3 ALA A 29 13.734 9.013 2.191 1.00 0.00 H new ATOM 418 N GLY A 30 10.788 10.841 2.386 1.00 0.00 N ATOM 419 CA GLY A 30 9.588 11.237 1.656 1.00 0.00 C ATOM 420 C GLY A 30 8.992 10.110 0.815 1.00 0.00 C ATOM 421 O GLY A 30 8.299 10.390 -0.165 1.00 0.00 O ATOM 0 H GLY A 30 10.596 10.225 3.176 1.00 0.00 H new ATOM 0 HA2 GLY A 30 8.838 11.587 2.366 1.00 0.00 H new ATOM 0 HA3 GLY A 30 9.828 12.078 1.006 1.00 0.00 H new ATOM 425 N PHE A 31 9.263 8.855 1.175 1.00 0.00 N ATOM 426 CA PHE A 31 8.766 7.668 0.476 1.00 0.00 C ATOM 427 C PHE A 31 8.091 6.731 1.486 1.00 0.00 C ATOM 428 O PHE A 31 7.881 7.099 2.644 1.00 0.00 O ATOM 429 CB PHE A 31 9.916 6.963 -0.268 1.00 0.00 C ATOM 430 CG PHE A 31 10.872 7.868 -1.025 1.00 0.00 C ATOM 431 CD1 PHE A 31 10.474 8.465 -2.236 1.00 0.00 C ATOM 432 CD2 PHE A 31 12.167 8.105 -0.524 1.00 0.00 C ATOM 433 CE1 PHE A 31 11.368 9.286 -2.947 1.00 0.00 C ATOM 434 CE2 PHE A 31 13.060 8.928 -1.232 1.00 0.00 C ATOM 435 CZ PHE A 31 12.662 9.515 -2.446 1.00 0.00 C ATOM 0 H PHE A 31 9.848 8.630 1.980 1.00 0.00 H new ATOM 0 HA PHE A 31 8.028 7.963 -0.270 1.00 0.00 H new ATOM 0 HB2 PHE A 31 10.490 6.385 0.456 1.00 0.00 H new ATOM 0 HB3 PHE A 31 9.485 6.252 -0.973 1.00 0.00 H new ATOM 0 HD1 PHE A 31 9.480 8.292 -2.620 1.00 0.00 H new ATOM 0 HD2 PHE A 31 12.475 7.653 0.407 1.00 0.00 H new ATOM 0 HE1 PHE A 31 11.061 9.740 -3.877 1.00 0.00 H new ATOM 0 HE2 PHE A 31 14.051 9.109 -0.844 1.00 0.00 H new ATOM 0 HZ PHE A 31 13.350 10.142 -2.994 1.00 0.00 H new ATOM 445 N THR A 32 7.774 5.509 1.063 1.00 0.00 N ATOM 446 CA THR A 32 7.336 4.434 1.939 1.00 0.00 C ATOM 447 C THR A 32 8.207 3.226 1.636 1.00 0.00 C ATOM 448 O THR A 32 8.672 3.054 0.506 1.00 0.00 O ATOM 449 CB THR A 32 5.842 4.127 1.765 1.00 0.00 C ATOM 450 OG1 THR A 32 5.472 4.136 0.395 1.00 0.00 O ATOM 451 CG2 THR A 32 4.996 5.151 2.521 1.00 0.00 C ATOM 0 H THR A 32 7.817 5.237 0.081 1.00 0.00 H new ATOM 0 HA THR A 32 7.449 4.726 2.983 1.00 0.00 H new ATOM 0 HB THR A 32 5.661 3.132 2.171 1.00 0.00 H new ATOM 0 HG1 THR A 32 4.516 3.936 0.313 1.00 0.00 H new ATOM 0 HG21 THR A 32 3.939 4.919 2.388 1.00 0.00 H new ATOM 0 HG22 THR A 32 5.244 5.116 3.582 1.00 0.00 H new ATOM 0 HG23 THR A 32 5.200 6.149 2.133 1.00 0.00 H new ATOM 459 N THR A 33 8.452 2.391 2.635 1.00 0.00 N ATOM 460 CA THR A 33 9.444 1.331 2.533 1.00 0.00 C ATOM 461 C THR A 33 8.966 0.056 3.231 1.00 0.00 C ATOM 462 O THR A 33 8.126 0.105 4.136 1.00 0.00 O ATOM 463 CB THR A 33 10.770 1.854 3.100 1.00 0.00 C ATOM 464 OG1 THR A 33 10.612 2.220 4.453 1.00 0.00 O ATOM 465 CG2 THR A 33 11.269 3.093 2.355 1.00 0.00 C ATOM 0 H THR A 33 7.972 2.428 3.534 1.00 0.00 H new ATOM 0 HA THR A 33 9.595 1.056 1.489 1.00 0.00 H new ATOM 0 HB THR A 33 11.492 1.045 2.986 1.00 0.00 H new ATOM 0 HG1 THR A 33 11.369 2.777 4.732 1.00 0.00 H new ATOM 0 HG21 THR A 33 12.210 3.426 2.792 1.00 0.00 H new ATOM 0 HG22 THR A 33 11.424 2.848 1.304 1.00 0.00 H new ATOM 0 HG23 THR A 33 10.529 3.889 2.437 1.00 0.00 H new ATOM 473 N GLU A 34 9.485 -1.097 2.802 1.00 0.00 N ATOM 474 CA GLU A 34 9.030 -2.401 3.228 1.00 0.00 C ATOM 475 C GLU A 34 10.220 -3.157 3.826 1.00 0.00 C ATOM 476 O GLU A 34 11.015 -3.744 3.090 1.00 0.00 O ATOM 477 CB GLU A 34 8.412 -3.081 2.003 1.00 0.00 C ATOM 478 CG GLU A 34 7.127 -3.812 2.348 1.00 0.00 C ATOM 479 CD GLU A 34 5.923 -2.922 2.712 1.00 0.00 C ATOM 480 OE1 GLU A 34 5.758 -2.582 3.905 1.00 0.00 O ATOM 481 OE2 GLU A 34 5.089 -2.629 1.826 1.00 0.00 O ATOM 0 H GLU A 34 10.253 -1.139 2.132 1.00 0.00 H new ATOM 0 HA GLU A 34 8.269 -2.362 4.007 1.00 0.00 H new ATOM 0 HB2 GLU A 34 8.209 -2.333 1.237 1.00 0.00 H new ATOM 0 HB3 GLU A 34 9.128 -3.786 1.579 1.00 0.00 H new ATOM 0 HG2 GLU A 34 6.849 -4.437 1.500 1.00 0.00 H new ATOM 0 HG3 GLU A 34 7.326 -4.481 3.185 1.00 0.00 H new ATOM 488 N THR A 35 10.386 -3.107 5.152 1.00 0.00 N ATOM 489 CA THR A 35 11.372 -3.944 5.834 1.00 0.00 C ATOM 490 C THR A 35 10.898 -5.394 5.740 1.00 0.00 C ATOM 491 O THR A 35 9.795 -5.710 6.196 1.00 0.00 O ATOM 492 CB THR A 35 11.564 -3.542 7.307 1.00 0.00 C ATOM 493 OG1 THR A 35 11.622 -2.139 7.466 1.00 0.00 O ATOM 494 CG2 THR A 35 12.883 -4.132 7.814 1.00 0.00 C ATOM 0 H THR A 35 9.851 -2.497 5.770 1.00 0.00 H new ATOM 0 HA THR A 35 12.340 -3.814 5.351 1.00 0.00 H new ATOM 0 HB THR A 35 10.711 -3.922 7.870 1.00 0.00 H new ATOM 0 HG1 THR A 35 11.270 -1.895 8.347 1.00 0.00 H new ATOM 0 HG21 THR A 35 13.029 -3.853 8.858 1.00 0.00 H new ATOM 0 HG22 THR A 35 12.852 -5.218 7.730 1.00 0.00 H new ATOM 0 HG23 THR A 35 13.708 -3.745 7.216 1.00 0.00 H new ATOM 502 N LEU A 36 11.706 -6.270 5.140 1.00 0.00 N ATOM 503 CA LEU A 36 11.283 -7.627 4.804 1.00 0.00 C ATOM 504 C LEU A 36 12.433 -8.609 4.940 1.00 0.00 C ATOM 505 O LEU A 36 13.545 -8.323 4.512 1.00 0.00 O ATOM 506 CB LEU A 36 10.856 -7.656 3.327 1.00 0.00 C ATOM 507 CG LEU A 36 9.567 -6.886 3.012 1.00 0.00 C ATOM 508 CD1 LEU A 36 9.520 -6.646 1.508 1.00 0.00 C ATOM 509 CD2 LEU A 36 8.310 -7.633 3.471 1.00 0.00 C ATOM 0 H LEU A 36 12.668 -6.058 4.875 1.00 0.00 H new ATOM 0 HA LEU A 36 10.473 -7.904 5.479 1.00 0.00 H new ATOM 0 HB2 LEU A 36 11.664 -7.245 2.722 1.00 0.00 H new ATOM 0 HB3 LEU A 36 10.726 -8.694 3.022 1.00 0.00 H new ATOM 0 HG LEU A 36 9.579 -5.943 3.559 1.00 0.00 H new ATOM 0 HD11 LEU A 36 8.612 -6.099 1.255 1.00 0.00 H new ATOM 0 HD12 LEU A 36 10.390 -6.064 1.205 1.00 0.00 H new ATOM 0 HD13 LEU A 36 9.524 -7.603 0.987 1.00 0.00 H new ATOM 0 HD21 LEU A 36 7.426 -7.044 3.224 1.00 0.00 H new ATOM 0 HD22 LEU A 36 8.256 -8.598 2.967 1.00 0.00 H new ATOM 0 HD23 LEU A 36 8.353 -7.789 4.549 1.00 0.00 H new ATOM 521 N HIS A 37 12.145 -9.827 5.399 1.00 0.00 N ATOM 522 CA HIS A 37 13.098 -10.937 5.362 1.00 0.00 C ATOM 523 C HIS A 37 12.969 -11.681 4.012 1.00 0.00 C ATOM 524 O HIS A 37 13.083 -12.906 3.947 1.00 0.00 O ATOM 525 CB HIS A 37 12.913 -11.824 6.605 1.00 0.00 C ATOM 526 CG HIS A 37 11.551 -12.464 6.744 1.00 0.00 C ATOM 527 ND1 HIS A 37 11.058 -13.495 5.978 1.00 0.00 N ATOM 528 CD2 HIS A 37 10.603 -12.176 7.690 1.00 0.00 C ATOM 529 CE1 HIS A 37 9.845 -13.824 6.449 1.00 0.00 C ATOM 530 NE2 HIS A 37 9.517 -13.042 7.496 1.00 0.00 N ATOM 0 H HIS A 37 11.243 -10.072 5.808 1.00 0.00 H new ATOM 0 HA HIS A 37 14.126 -10.577 5.409 1.00 0.00 H new ATOM 0 HB2 HIS A 37 13.666 -12.612 6.584 1.00 0.00 H new ATOM 0 HB3 HIS A 37 13.106 -11.222 7.493 1.00 0.00 H new ATOM 0 HD1 HIS A 37 11.532 -13.934 5.189 1.00 0.00 H new ATOM 0 HD2 HIS A 37 10.679 -11.415 8.452 1.00 0.00 H new ATOM 0 HE1 HIS A 37 9.219 -14.606 6.045 1.00 0.00 H new ATOM 538 N GLY A 38 12.650 -10.933 2.946 1.00 0.00 N ATOM 539 CA GLY A 38 12.324 -11.419 1.608 1.00 0.00 C ATOM 540 C GLY A 38 11.340 -12.596 1.584 1.00 0.00 C ATOM 541 O GLY A 38 11.676 -13.624 0.995 1.00 0.00 O ATOM 0 H GLY A 38 12.612 -9.915 3.003 1.00 0.00 H new ATOM 0 HA2 GLY A 38 11.903 -10.597 1.029 1.00 0.00 H new ATOM 0 HA3 GLY A 38 13.245 -11.721 1.110 1.00 0.00 H new ATOM 545 N PRO A 39 10.136 -12.485 2.183 1.00 0.00 N ATOM 546 CA PRO A 39 9.197 -13.601 2.299 1.00 0.00 C ATOM 547 C PRO A 39 8.683 -14.117 0.949 1.00 0.00 C ATOM 548 O PRO A 39 8.226 -15.258 0.866 1.00 0.00 O ATOM 549 CB PRO A 39 8.045 -13.082 3.168 1.00 0.00 C ATOM 550 CG PRO A 39 8.070 -11.574 2.942 1.00 0.00 C ATOM 551 CD PRO A 39 9.555 -11.277 2.752 1.00 0.00 C ATOM 0 HA PRO A 39 9.698 -14.462 2.741 1.00 0.00 H new ATOM 0 HB2 PRO A 39 7.091 -13.516 2.868 1.00 0.00 H new ATOM 0 HB3 PRO A 39 8.193 -13.332 4.219 1.00 0.00 H new ATOM 0 HG2 PRO A 39 7.487 -11.288 2.067 1.00 0.00 H new ATOM 0 HG3 PRO A 39 7.656 -11.032 3.792 1.00 0.00 H new ATOM 0 HD2 PRO A 39 9.701 -10.424 2.089 1.00 0.00 H new ATOM 0 HD3 PRO A 39 10.028 -11.027 3.702 1.00 0.00 H new ATOM 559 N LEU A 40 8.771 -13.303 -0.108 1.00 0.00 N ATOM 560 CA LEU A 40 8.338 -13.606 -1.455 1.00 0.00 C ATOM 561 C LEU A 40 9.523 -13.430 -2.414 1.00 0.00 C ATOM 562 O LEU A 40 9.309 -13.244 -3.611 1.00 0.00 O ATOM 563 CB LEU A 40 7.190 -12.633 -1.785 1.00 0.00 C ATOM 564 CG LEU A 40 5.868 -12.882 -1.029 1.00 0.00 C ATOM 565 CD1 LEU A 40 4.856 -11.794 -1.406 1.00 0.00 C ATOM 566 CD2 LEU A 40 5.261 -14.257 -1.333 1.00 0.00 C ATOM 0 H LEU A 40 9.169 -12.367 -0.031 1.00 0.00 H new ATOM 0 HA LEU A 40 7.987 -14.633 -1.554 1.00 0.00 H new ATOM 0 HB2 LEU A 40 7.525 -11.618 -1.571 1.00 0.00 H new ATOM 0 HB3 LEU A 40 6.991 -12.684 -2.855 1.00 0.00 H new ATOM 0 HG LEU A 40 6.095 -12.853 0.037 1.00 0.00 H new ATOM 0 HD11 LEU A 40 3.921 -11.967 -0.874 1.00 0.00 H new ATOM 0 HD12 LEU A 40 5.254 -10.817 -1.133 1.00 0.00 H new ATOM 0 HD13 LEU A 40 4.673 -11.824 -2.480 1.00 0.00 H new ATOM 0 HD21 LEU A 40 4.333 -14.377 -0.774 1.00 0.00 H new ATOM 0 HD22 LEU A 40 5.054 -14.336 -2.400 1.00 0.00 H new ATOM 0 HD23 LEU A 40 5.964 -15.037 -1.041 1.00 0.00 H new ATOM 578 N LEU A 41 10.763 -13.414 -1.891 1.00 0.00 N ATOM 579 CA LEU A 41 12.026 -13.060 -2.550 1.00 0.00 C ATOM 580 C LEU A 41 12.100 -11.590 -3.002 1.00 0.00 C ATOM 581 O LEU A 41 13.178 -10.999 -2.989 1.00 0.00 O ATOM 582 CB LEU A 41 12.294 -14.031 -3.718 1.00 0.00 C ATOM 583 CG LEU A 41 13.738 -13.988 -4.247 1.00 0.00 C ATOM 584 CD1 LEU A 41 14.687 -14.779 -3.344 1.00 0.00 C ATOM 585 CD2 LEU A 41 13.790 -14.579 -5.656 1.00 0.00 C ATOM 0 H LEU A 41 10.916 -13.670 -0.916 1.00 0.00 H new ATOM 0 HA LEU A 41 12.816 -13.164 -1.806 1.00 0.00 H new ATOM 0 HB2 LEU A 41 12.067 -15.046 -3.393 1.00 0.00 H new ATOM 0 HB3 LEU A 41 11.611 -13.798 -4.535 1.00 0.00 H new ATOM 0 HG LEU A 41 14.056 -12.946 -4.261 1.00 0.00 H new ATOM 0 HD11 LEU A 41 15.699 -14.728 -3.746 1.00 0.00 H new ATOM 0 HD12 LEU A 41 14.674 -14.353 -2.341 1.00 0.00 H new ATOM 0 HD13 LEU A 41 14.365 -15.820 -3.301 1.00 0.00 H new ATOM 0 HD21 LEU A 41 14.815 -14.546 -6.027 1.00 0.00 H new ATOM 0 HD22 LEU A 41 13.446 -15.613 -5.630 1.00 0.00 H new ATOM 0 HD23 LEU A 41 13.146 -13.999 -6.318 1.00 0.00 H new ATOM 597 N GLU A 42 10.968 -10.985 -3.353 1.00 0.00 N ATOM 598 CA GLU A 42 10.847 -9.689 -4.009 1.00 0.00 C ATOM 599 C GLU A 42 9.384 -9.265 -3.869 1.00 0.00 C ATOM 600 O GLU A 42 8.529 -9.611 -4.684 1.00 0.00 O ATOM 601 CB GLU A 42 11.352 -9.778 -5.474 1.00 0.00 C ATOM 602 CG GLU A 42 10.860 -10.980 -6.311 1.00 0.00 C ATOM 603 CD GLU A 42 11.487 -11.014 -7.716 1.00 0.00 C ATOM 604 OE1 GLU A 42 11.005 -10.287 -8.615 1.00 0.00 O ATOM 605 OE2 GLU A 42 12.425 -11.815 -7.939 1.00 0.00 O ATOM 0 H GLU A 42 10.059 -11.412 -3.176 1.00 0.00 H new ATOM 0 HA GLU A 42 11.473 -8.924 -3.549 1.00 0.00 H new ATOM 0 HB2 GLU A 42 11.060 -8.863 -5.990 1.00 0.00 H new ATOM 0 HB3 GLU A 42 12.442 -9.800 -5.457 1.00 0.00 H new ATOM 0 HG2 GLU A 42 11.099 -11.906 -5.787 1.00 0.00 H new ATOM 0 HG3 GLU A 42 9.775 -10.936 -6.402 1.00 0.00 H new ATOM 612 N ASP A 43 9.069 -8.588 -2.757 1.00 0.00 N ATOM 613 CA ASP A 43 7.714 -8.093 -2.519 1.00 0.00 C ATOM 614 C ASP A 43 7.337 -7.047 -3.565 1.00 0.00 C ATOM 615 O ASP A 43 6.218 -7.092 -4.084 1.00 0.00 O ATOM 616 CB ASP A 43 7.576 -7.489 -1.125 1.00 0.00 C ATOM 617 CG ASP A 43 6.153 -6.942 -0.915 1.00 0.00 C ATOM 618 OD1 ASP A 43 5.239 -7.739 -0.607 1.00 0.00 O ATOM 619 OD2 ASP A 43 5.949 -5.716 -1.044 1.00 0.00 O ATOM 0 H ASP A 43 9.733 -8.373 -2.013 1.00 0.00 H new ATOM 0 HA ASP A 43 7.038 -8.945 -2.594 1.00 0.00 H new ATOM 0 HB2 ASP A 43 7.797 -8.245 -0.371 1.00 0.00 H new ATOM 0 HB3 ASP A 43 8.303 -6.687 -0.996 1.00 0.00 H new ATOM 624 N LEU A 44 8.268 -6.142 -3.915 1.00 0.00 N ATOM 625 CA LEU A 44 8.053 -5.260 -5.065 1.00 0.00 C ATOM 626 C LEU A 44 8.590 -5.961 -6.322 1.00 0.00 C ATOM 627 O LEU A 44 9.538 -6.744 -6.219 1.00 0.00 O ATOM 628 CB LEU A 44 8.696 -3.875 -4.885 1.00 0.00 C ATOM 629 CG LEU A 44 8.162 -3.066 -3.687 1.00 0.00 C ATOM 630 CD1 LEU A 44 8.839 -1.694 -3.663 1.00 0.00 C ATOM 631 CD2 LEU A 44 6.642 -2.860 -3.728 1.00 0.00 C ATOM 0 H LEU A 44 9.154 -6.007 -3.429 1.00 0.00 H new ATOM 0 HA LEU A 44 6.983 -5.076 -5.163 1.00 0.00 H new ATOM 0 HB2 LEU A 44 9.772 -4.002 -4.769 1.00 0.00 H new ATOM 0 HB3 LEU A 44 8.539 -3.296 -5.795 1.00 0.00 H new ATOM 0 HG LEU A 44 8.391 -3.642 -2.790 1.00 0.00 H new ATOM 0 HD11 LEU A 44 8.464 -1.118 -2.817 1.00 0.00 H new ATOM 0 HD12 LEU A 44 9.917 -1.822 -3.566 1.00 0.00 H new ATOM 0 HD13 LEU A 44 8.619 -1.163 -4.589 1.00 0.00 H new ATOM 0 HD21 LEU A 44 6.329 -2.284 -2.857 1.00 0.00 H new ATOM 0 HD22 LEU A 44 6.372 -2.321 -4.636 1.00 0.00 H new ATOM 0 HD23 LEU A 44 6.143 -3.829 -3.720 1.00 0.00 H new ATOM 643 N PRO A 45 8.004 -5.690 -7.500 1.00 0.00 N ATOM 644 CA PRO A 45 8.347 -6.346 -8.754 1.00 0.00 C ATOM 645 C PRO A 45 9.743 -5.984 -9.258 1.00 0.00 C ATOM 646 O PRO A 45 10.489 -5.208 -8.653 1.00 0.00 O ATOM 647 CB PRO A 45 7.269 -5.919 -9.761 1.00 0.00 C ATOM 648 CG PRO A 45 6.727 -4.608 -9.197 1.00 0.00 C ATOM 649 CD PRO A 45 6.921 -4.742 -7.692 1.00 0.00 C ATOM 0 HA PRO A 45 8.374 -7.427 -8.615 1.00 0.00 H new ATOM 0 HB2 PRO A 45 7.688 -5.781 -10.758 1.00 0.00 H new ATOM 0 HB3 PRO A 45 6.484 -6.670 -9.846 1.00 0.00 H new ATOM 0 HG2 PRO A 45 7.269 -3.749 -9.594 1.00 0.00 H new ATOM 0 HG3 PRO A 45 5.677 -4.468 -9.453 1.00 0.00 H new ATOM 0 HD2 PRO A 45 7.165 -3.778 -7.245 1.00 0.00 H new ATOM 0 HD3 PRO A 45 6.007 -5.094 -7.213 1.00 0.00 H new ATOM 657 N ALA A 46 10.045 -6.503 -10.447 1.00 0.00 N ATOM 658 CA ALA A 46 11.230 -6.179 -11.238 1.00 0.00 C ATOM 659 C ALA A 46 11.163 -4.761 -11.846 1.00 0.00 C ATOM 660 O ALA A 46 11.612 -4.528 -12.969 1.00 0.00 O ATOM 661 CB ALA A 46 11.421 -7.263 -12.311 1.00 0.00 C ATOM 0 H ALA A 46 9.445 -7.190 -10.904 1.00 0.00 H new ATOM 0 HA ALA A 46 12.100 -6.169 -10.582 1.00 0.00 H new ATOM 0 HB1 ALA A 46 12.303 -7.032 -12.908 1.00 0.00 H new ATOM 0 HB2 ALA A 46 11.552 -8.232 -11.830 1.00 0.00 H new ATOM 0 HB3 ALA A 46 10.543 -7.294 -12.957 1.00 0.00 H new ATOM 667 N SER A 47 10.547 -3.812 -11.149 1.00 0.00 N ATOM 668 CA SER A 47 10.388 -2.418 -11.526 1.00 0.00 C ATOM 669 C SER A 47 10.120 -1.649 -10.230 1.00 0.00 C ATOM 670 O SER A 47 9.334 -2.115 -9.401 1.00 0.00 O ATOM 671 CB SER A 47 9.221 -2.254 -12.504 1.00 0.00 C ATOM 672 OG SER A 47 9.430 -2.999 -13.692 1.00 0.00 O ATOM 0 H SER A 47 10.118 -4.013 -10.246 1.00 0.00 H new ATOM 0 HA SER A 47 11.279 -2.041 -12.029 1.00 0.00 H new ATOM 0 HB2 SER A 47 8.297 -2.580 -12.027 1.00 0.00 H new ATOM 0 HB3 SER A 47 9.098 -1.200 -12.751 1.00 0.00 H new ATOM 0 HG SER A 47 10.276 -3.489 -13.626 1.00 0.00 H new ATOM 678 N GLY A 48 10.783 -0.510 -10.030 1.00 0.00 N ATOM 679 CA GLY A 48 10.719 0.240 -8.781 1.00 0.00 C ATOM 680 C GLY A 48 12.131 0.497 -8.286 1.00 0.00 C ATOM 681 O GLY A 48 13.043 0.716 -9.089 1.00 0.00 O ATOM 0 H GLY A 48 11.382 -0.081 -10.735 1.00 0.00 H new ATOM 0 HA2 GLY A 48 10.196 1.184 -8.935 1.00 0.00 H new ATOM 0 HA3 GLY A 48 10.154 -0.319 -8.035 1.00 0.00 H new ATOM 685 N ILE A 49 12.314 0.441 -6.969 1.00 0.00 N ATOM 686 CA ILE A 49 13.602 0.566 -6.303 1.00 0.00 C ATOM 687 C ILE A 49 13.717 -0.620 -5.345 1.00 0.00 C ATOM 688 O ILE A 49 12.743 -1.011 -4.693 1.00 0.00 O ATOM 689 CB ILE A 49 13.690 1.946 -5.613 1.00 0.00 C ATOM 690 CG1 ILE A 49 13.500 3.047 -6.685 1.00 0.00 C ATOM 691 CG2 ILE A 49 15.002 2.108 -4.821 1.00 0.00 C ATOM 692 CD1 ILE A 49 13.818 4.476 -6.246 1.00 0.00 C ATOM 0 H ILE A 49 11.542 0.303 -6.317 1.00 0.00 H new ATOM 0 HA ILE A 49 14.445 0.531 -6.993 1.00 0.00 H new ATOM 0 HB ILE A 49 12.895 2.037 -4.873 1.00 0.00 H new ATOM 0 HG12 ILE A 49 14.128 2.804 -7.542 1.00 0.00 H new ATOM 0 HG13 ILE A 49 12.466 3.016 -7.029 1.00 0.00 H new ATOM 0 HG21 ILE A 49 15.024 3.091 -4.351 1.00 0.00 H new ATOM 0 HG22 ILE A 49 15.061 1.337 -4.052 1.00 0.00 H new ATOM 0 HG23 ILE A 49 15.850 2.010 -5.498 1.00 0.00 H new ATOM 0 HD11 ILE A 49 13.648 5.159 -7.079 1.00 0.00 H new ATOM 0 HD12 ILE A 49 13.172 4.753 -5.413 1.00 0.00 H new ATOM 0 HD13 ILE A 49 14.860 4.537 -5.933 1.00 0.00 H new ATOM 704 N TRP A 50 14.912 -1.198 -5.265 1.00 0.00 N ATOM 705 CA TRP A 50 15.232 -2.334 -4.426 1.00 0.00 C ATOM 706 C TRP A 50 16.391 -1.904 -3.534 1.00 0.00 C ATOM 707 O TRP A 50 17.223 -1.079 -3.920 1.00 0.00 O ATOM 708 CB TRP A 50 15.661 -3.523 -5.312 1.00 0.00 C ATOM 709 CG TRP A 50 14.610 -4.434 -5.900 1.00 0.00 C ATOM 710 CD1 TRP A 50 13.331 -4.122 -6.223 1.00 0.00 C ATOM 711 CD2 TRP A 50 14.771 -5.828 -6.319 1.00 0.00 C ATOM 712 NE1 TRP A 50 12.706 -5.198 -6.819 1.00 0.00 N ATOM 713 CE2 TRP A 50 13.548 -6.283 -6.900 1.00 0.00 C ATOM 714 CE3 TRP A 50 15.842 -6.750 -6.286 1.00 0.00 C ATOM 715 CZ2 TRP A 50 13.398 -7.578 -7.420 1.00 0.00 C ATOM 716 CZ3 TRP A 50 15.699 -8.055 -6.796 1.00 0.00 C ATOM 717 CH2 TRP A 50 14.479 -8.471 -7.359 1.00 0.00 C ATOM 0 H TRP A 50 15.711 -0.870 -5.807 1.00 0.00 H new ATOM 0 HA TRP A 50 14.374 -2.645 -3.830 1.00 0.00 H new ATOM 0 HB2 TRP A 50 16.242 -3.119 -6.141 1.00 0.00 H new ATOM 0 HB3 TRP A 50 16.336 -4.143 -4.721 1.00 0.00 H new ATOM 0 HD1 TRP A 50 12.866 -3.165 -6.039 1.00 0.00 H new ATOM 0 HE1 TRP A 50 11.743 -5.190 -7.156 1.00 0.00 H new ATOM 0 HE3 TRP A 50 16.788 -6.448 -5.862 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 12.461 -7.884 -7.862 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 16.532 -8.741 -6.755 1.00 0.00 H new ATOM 0 HH2 TRP A 50 14.374 -9.475 -7.743 1.00 0.00 H new ATOM 728 N LEU A 51 16.478 -2.500 -2.354 1.00 0.00 N ATOM 729 CA LEU A 51 17.619 -2.395 -1.466 1.00 0.00 C ATOM 730 C LEU A 51 17.839 -3.796 -0.937 1.00 0.00 C ATOM 731 O LEU A 51 16.874 -4.516 -0.672 1.00 0.00 O ATOM 732 CB LEU A 51 17.360 -1.421 -0.307 1.00 0.00 C ATOM 733 CG LEU A 51 17.496 0.069 -0.665 1.00 0.00 C ATOM 734 CD1 LEU A 51 17.222 0.899 0.590 1.00 0.00 C ATOM 735 CD2 LEU A 51 18.892 0.422 -1.197 1.00 0.00 C ATOM 0 H LEU A 51 15.732 -3.087 -1.980 1.00 0.00 H new ATOM 0 HA LEU A 51 18.489 -2.004 -1.994 1.00 0.00 H new ATOM 0 HB2 LEU A 51 16.355 -1.596 0.077 1.00 0.00 H new ATOM 0 HB3 LEU A 51 18.054 -1.649 0.501 1.00 0.00 H new ATOM 0 HG LEU A 51 16.778 0.288 -1.455 1.00 0.00 H new ATOM 0 HD11 LEU A 51 17.315 1.959 0.353 1.00 0.00 H new ATOM 0 HD12 LEU A 51 16.213 0.694 0.949 1.00 0.00 H new ATOM 0 HD13 LEU A 51 17.943 0.636 1.364 1.00 0.00 H new ATOM 0 HD21 LEU A 51 18.933 1.485 -1.434 1.00 0.00 H new ATOM 0 HD22 LEU A 51 19.640 0.190 -0.439 1.00 0.00 H new ATOM 0 HD23 LEU A 51 19.096 -0.158 -2.097 1.00 0.00 H new ATOM 747 N VAL A 52 19.097 -4.177 -0.771 1.00 0.00 N ATOM 748 CA VAL A 52 19.465 -5.500 -0.296 1.00 0.00 C ATOM 749 C VAL A 52 20.467 -5.302 0.837 1.00 0.00 C ATOM 750 O VAL A 52 21.447 -4.563 0.698 1.00 0.00 O ATOM 751 CB VAL A 52 19.910 -6.384 -1.483 1.00 0.00 C ATOM 752 CG1 VAL A 52 20.966 -5.735 -2.393 1.00 0.00 C ATOM 753 CG2 VAL A 52 20.382 -7.766 -1.014 1.00 0.00 C ATOM 0 H VAL A 52 19.895 -3.572 -0.964 1.00 0.00 H new ATOM 0 HA VAL A 52 18.633 -6.063 0.128 1.00 0.00 H new ATOM 0 HB VAL A 52 19.015 -6.502 -2.094 1.00 0.00 H new ATOM 0 HG11 VAL A 52 21.222 -6.422 -3.200 1.00 0.00 H new ATOM 0 HG12 VAL A 52 20.566 -4.813 -2.815 1.00 0.00 H new ATOM 0 HG13 VAL A 52 21.859 -5.510 -1.811 1.00 0.00 H new ATOM 0 HG21 VAL A 52 20.687 -8.359 -1.877 1.00 0.00 H new ATOM 0 HG22 VAL A 52 21.228 -7.651 -0.336 1.00 0.00 H new ATOM 0 HG23 VAL A 52 19.568 -8.272 -0.496 1.00 0.00 H new ATOM 763 N ILE A 53 20.179 -5.913 1.983 1.00 0.00 N ATOM 764 CA ILE A 53 20.870 -5.690 3.238 1.00 0.00 C ATOM 765 C ILE A 53 21.371 -7.061 3.667 1.00 0.00 C ATOM 766 O ILE A 53 20.572 -7.937 4.011 1.00 0.00 O ATOM 767 CB ILE A 53 19.939 -5.009 4.279 1.00 0.00 C ATOM 768 CG1 ILE A 53 19.233 -3.731 3.758 1.00 0.00 C ATOM 769 CG2 ILE A 53 20.770 -4.630 5.519 1.00 0.00 C ATOM 770 CD1 ILE A 53 17.890 -3.984 3.061 1.00 0.00 C ATOM 0 H ILE A 53 19.430 -6.601 2.060 1.00 0.00 H new ATOM 0 HA ILE A 53 21.707 -4.999 3.141 1.00 0.00 H new ATOM 0 HB ILE A 53 19.157 -5.733 4.509 1.00 0.00 H new ATOM 0 HG12 ILE A 53 19.071 -3.054 4.596 1.00 0.00 H new ATOM 0 HG13 ILE A 53 19.899 -3.222 3.061 1.00 0.00 H new ATOM 0 HG21 ILE A 53 20.126 -4.151 6.256 1.00 0.00 H new ATOM 0 HG22 ILE A 53 21.210 -5.529 5.951 1.00 0.00 H new ATOM 0 HG23 ILE A 53 21.563 -3.941 5.229 1.00 0.00 H new ATOM 0 HD11 ILE A 53 17.468 -3.035 2.729 1.00 0.00 H new ATOM 0 HD12 ILE A 53 18.044 -4.634 2.199 1.00 0.00 H new ATOM 0 HD13 ILE A 53 17.203 -4.463 3.758 1.00 0.00 H new ATOM 782 N SER A 54 22.685 -7.270 3.577 1.00 0.00 N ATOM 783 CA SER A 54 23.320 -8.560 3.818 1.00 0.00 C ATOM 784 C SER A 54 24.693 -8.336 4.459 1.00 0.00 C ATOM 785 O SER A 54 24.980 -7.226 4.919 1.00 0.00 O ATOM 786 CB SER A 54 23.355 -9.391 2.525 1.00 0.00 C ATOM 787 OG SER A 54 22.131 -9.295 1.817 1.00 0.00 O ATOM 0 H SER A 54 23.346 -6.534 3.330 1.00 0.00 H new ATOM 0 HA SER A 54 22.738 -9.150 4.526 1.00 0.00 H new ATOM 0 HB2 SER A 54 24.172 -9.047 1.891 1.00 0.00 H new ATOM 0 HB3 SER A 54 23.557 -10.435 2.766 1.00 0.00 H new ATOM 0 HG SER A 54 22.312 -9.071 0.880 1.00 0.00 H new ATOM 793 N SER A 55 25.550 -9.357 4.521 1.00 0.00 N ATOM 794 CA SER A 55 26.760 -9.283 5.325 1.00 0.00 C ATOM 795 C SER A 55 27.835 -10.239 4.834 1.00 0.00 C ATOM 796 O SER A 55 28.220 -11.194 5.507 1.00 0.00 O ATOM 797 CB SER A 55 26.357 -9.542 6.790 1.00 0.00 C ATOM 798 OG SER A 55 25.435 -10.619 6.915 1.00 0.00 O ATOM 0 H SER A 55 25.425 -10.239 4.024 1.00 0.00 H new ATOM 0 HA SER A 55 27.210 -8.294 5.238 1.00 0.00 H new ATOM 0 HB2 SER A 55 27.249 -9.761 7.377 1.00 0.00 H new ATOM 0 HB3 SER A 55 25.915 -8.638 7.208 1.00 0.00 H new ATOM 0 HG SER A 55 25.209 -10.748 7.860 1.00 0.00 H new ATOM 804 N THR A 56 28.340 -9.979 3.637 1.00 0.00 N ATOM 805 CA THR A 56 29.343 -10.811 2.997 1.00 0.00 C ATOM 806 C THR A 56 30.657 -10.840 3.799 1.00 0.00 C ATOM 807 O THR A 56 31.271 -11.898 3.928 1.00 0.00 O ATOM 808 CB THR A 56 29.487 -10.267 1.574 1.00 0.00 C ATOM 809 OG1 THR A 56 29.676 -8.868 1.673 1.00 0.00 O ATOM 810 CG2 THR A 56 28.249 -10.503 0.704 1.00 0.00 C ATOM 0 H THR A 56 28.060 -9.174 3.077 1.00 0.00 H new ATOM 0 HA THR A 56 29.047 -11.859 2.960 1.00 0.00 H new ATOM 0 HB THR A 56 30.322 -10.787 1.105 1.00 0.00 H new ATOM 0 HG1 THR A 56 30.198 -8.553 0.905 1.00 0.00 H new ATOM 0 HG21 THR A 56 28.420 -10.092 -0.291 1.00 0.00 H new ATOM 0 HG22 THR A 56 28.057 -11.573 0.627 1.00 0.00 H new ATOM 0 HG23 THR A 56 27.388 -10.012 1.156 1.00 0.00 H new ATOM 916 N ASN A 65 26.884 -15.512 0.337 1.00 0.00 N ATOM 917 CA ASN A 65 26.615 -15.083 1.713 1.00 0.00 C ATOM 918 C ASN A 65 25.159 -15.373 2.047 1.00 0.00 C ATOM 919 O ASN A 65 24.881 -16.102 2.994 1.00 0.00 O ATOM 920 CB ASN A 65 26.885 -13.579 1.862 1.00 0.00 C ATOM 921 CG ASN A 65 26.281 -12.911 3.086 1.00 0.00 C ATOM 922 OD1 ASN A 65 25.642 -11.871 2.984 1.00 0.00 O ATOM 923 ND2 ASN A 65 26.489 -13.433 4.269 1.00 0.00 N ATOM 0 HA ASN A 65 27.269 -15.627 2.394 1.00 0.00 H new ATOM 0 HB2 ASN A 65 27.964 -13.424 1.884 1.00 0.00 H new ATOM 0 HB3 ASN A 65 26.508 -13.073 0.973 1.00 0.00 H new ATOM 0 HD21 ASN A 65 26.119 -12.974 5.101 1.00 0.00 H new ATOM 0 HD22 ASN A 65 27.021 -14.299 4.358 1.00 0.00 H new ATOM 930 N LEU A 66 24.241 -14.841 1.236 1.00 0.00 N ATOM 931 CA LEU A 66 22.830 -15.185 1.302 1.00 0.00 C ATOM 932 C LEU A 66 22.709 -16.616 0.786 1.00 0.00 C ATOM 933 O LEU A 66 23.340 -16.936 -0.226 1.00 0.00 O ATOM 934 CB LEU A 66 21.961 -14.246 0.444 1.00 0.00 C ATOM 935 CG LEU A 66 22.044 -12.726 0.710 1.00 0.00 C ATOM 936 CD1 LEU A 66 23.338 -12.098 0.174 1.00 0.00 C ATOM 937 CD2 LEU A 66 20.863 -12.022 0.031 1.00 0.00 C ATOM 0 H LEU A 66 24.463 -14.156 0.513 1.00 0.00 H new ATOM 0 HA LEU A 66 22.473 -15.085 2.327 1.00 0.00 H new ATOM 0 HB2 LEU A 66 22.220 -14.415 -0.601 1.00 0.00 H new ATOM 0 HB3 LEU A 66 20.921 -14.549 0.568 1.00 0.00 H new ATOM 0 HG LEU A 66 22.023 -12.597 1.792 1.00 0.00 H new ATOM 0 HD11 LEU A 66 23.340 -11.030 0.390 1.00 0.00 H new ATOM 0 HD12 LEU A 66 24.196 -12.567 0.655 1.00 0.00 H new ATOM 0 HD13 LEU A 66 23.397 -12.251 -0.904 1.00 0.00 H new ATOM 0 HD21 LEU A 66 20.922 -10.950 0.219 1.00 0.00 H new ATOM 0 HD22 LEU A 66 20.899 -12.205 -1.043 1.00 0.00 H new ATOM 0 HD23 LEU A 66 19.928 -12.410 0.434 1.00 0.00 H new ATOM 949 N SER A 67 21.916 -17.468 1.434 1.00 0.00 N ATOM 950 CA SER A 67 21.798 -18.863 1.032 1.00 0.00 C ATOM 951 C SER A 67 20.687 -19.019 -0.016 1.00 0.00 C ATOM 952 O SER A 67 21.005 -19.353 -1.157 1.00 0.00 O ATOM 953 CB SER A 67 21.654 -19.784 2.258 1.00 0.00 C ATOM 954 OG SER A 67 21.215 -19.103 3.427 1.00 0.00 O ATOM 0 H SER A 67 21.346 -17.213 2.241 1.00 0.00 H new ATOM 0 HA SER A 67 22.718 -19.186 0.545 1.00 0.00 H new ATOM 0 HB2 SER A 67 20.948 -20.581 2.024 1.00 0.00 H new ATOM 0 HB3 SER A 67 22.614 -20.258 2.462 1.00 0.00 H new ATOM 0 HG SER A 67 21.142 -19.740 4.168 1.00 0.00 H new ATOM 960 N PRO A 68 19.407 -18.728 0.290 1.00 0.00 N ATOM 961 CA PRO A 68 18.319 -18.961 -0.656 1.00 0.00 C ATOM 962 C PRO A 68 18.315 -17.930 -1.776 1.00 0.00 C ATOM 963 O PRO A 68 18.068 -18.269 -2.932 1.00 0.00 O ATOM 964 CB PRO A 68 17.044 -18.869 0.184 1.00 0.00 C ATOM 965 CG PRO A 68 17.411 -17.952 1.349 1.00 0.00 C ATOM 966 CD PRO A 68 18.889 -18.245 1.564 1.00 0.00 C ATOM 0 HA PRO A 68 18.417 -19.926 -1.152 1.00 0.00 H new ATOM 0 HB2 PRO A 68 16.217 -18.460 -0.396 1.00 0.00 H new ATOM 0 HB3 PRO A 68 16.731 -19.852 0.537 1.00 0.00 H new ATOM 0 HG2 PRO A 68 17.239 -16.903 1.107 1.00 0.00 H new ATOM 0 HG3 PRO A 68 16.822 -18.175 2.239 1.00 0.00 H new ATOM 0 HD2 PRO A 68 19.420 -17.348 1.883 1.00 0.00 H new ATOM 0 HD3 PRO A 68 19.026 -18.992 2.346 1.00 0.00 H new ATOM 974 N PHE A 69 18.590 -16.671 -1.429 1.00 0.00 N ATOM 975 CA PHE A 69 18.441 -15.555 -2.339 1.00 0.00 C ATOM 976 C PHE A 69 19.391 -15.697 -3.517 1.00 0.00 C ATOM 977 O PHE A 69 18.967 -15.516 -4.652 1.00 0.00 O ATOM 978 CB PHE A 69 18.725 -14.251 -1.601 1.00 0.00 C ATOM 979 CG PHE A 69 17.679 -13.858 -0.581 1.00 0.00 C ATOM 980 CD1 PHE A 69 16.577 -13.085 -0.986 1.00 0.00 C ATOM 981 CD2 PHE A 69 17.794 -14.266 0.763 1.00 0.00 C ATOM 982 CE1 PHE A 69 15.572 -12.755 -0.064 1.00 0.00 C ATOM 983 CE2 PHE A 69 16.786 -13.934 1.682 1.00 0.00 C ATOM 984 CZ PHE A 69 15.675 -13.181 1.271 1.00 0.00 C ATOM 0 H PHE A 69 18.923 -16.405 -0.502 1.00 0.00 H new ATOM 0 HA PHE A 69 17.419 -15.545 -2.717 1.00 0.00 H new ATOM 0 HB2 PHE A 69 19.688 -14.337 -1.098 1.00 0.00 H new ATOM 0 HB3 PHE A 69 18.818 -13.449 -2.333 1.00 0.00 H new ATOM 0 HD1 PHE A 69 16.504 -12.745 -2.008 1.00 0.00 H new ATOM 0 HD2 PHE A 69 18.655 -14.833 1.085 1.00 0.00 H new ATOM 0 HE1 PHE A 69 14.719 -12.173 -0.381 1.00 0.00 H new ATOM 0 HE2 PHE A 69 16.866 -14.259 2.709 1.00 0.00 H new ATOM 0 HZ PHE A 69 14.900 -12.929 1.980 1.00 0.00 H new ATOM 994 N TYR A 70 20.661 -16.029 -3.261 1.00 0.00 N ATOM 995 CA TYR A 70 21.656 -16.141 -4.315 1.00 0.00 C ATOM 996 C TYR A 70 21.246 -17.220 -5.315 1.00 0.00 C ATOM 997 O TYR A 70 21.219 -16.957 -6.516 1.00 0.00 O ATOM 998 CB TYR A 70 23.041 -16.411 -3.727 1.00 0.00 C ATOM 999 CG TYR A 70 24.115 -16.515 -4.792 1.00 0.00 C ATOM 1000 CD1 TYR A 70 24.563 -15.351 -5.447 1.00 0.00 C ATOM 1001 CD2 TYR A 70 24.611 -17.773 -5.183 1.00 0.00 C ATOM 1002 CE1 TYR A 70 25.500 -15.443 -6.490 1.00 0.00 C ATOM 1003 CE2 TYR A 70 25.570 -17.869 -6.207 1.00 0.00 C ATOM 1004 CZ TYR A 70 26.018 -16.704 -6.868 1.00 0.00 C ATOM 1005 OH TYR A 70 26.928 -16.814 -7.877 1.00 0.00 O ATOM 0 H TYR A 70 21.018 -16.224 -2.326 1.00 0.00 H new ATOM 0 HA TYR A 70 21.711 -15.193 -4.850 1.00 0.00 H new ATOM 0 HB2 TYR A 70 23.299 -15.612 -3.032 1.00 0.00 H new ATOM 0 HB3 TYR A 70 23.014 -17.337 -3.152 1.00 0.00 H new ATOM 0 HD1 TYR A 70 24.185 -14.385 -5.147 1.00 0.00 H new ATOM 0 HD2 TYR A 70 24.254 -18.668 -4.695 1.00 0.00 H new ATOM 0 HE1 TYR A 70 25.825 -14.550 -7.004 1.00 0.00 H new ATOM 0 HE2 TYR A 70 25.964 -18.834 -6.488 1.00 0.00 H new ATOM 0 HH TYR A 70 27.172 -17.756 -7.996 1.00 0.00 H new ATOM 1015 N GLU A 71 20.865 -18.410 -4.838 1.00 0.00 N ATOM 1016 CA GLU A 71 20.447 -19.488 -5.726 1.00 0.00 C ATOM 1017 C GLU A 71 19.199 -19.075 -6.510 1.00 0.00 C ATOM 1018 O GLU A 71 19.165 -19.233 -7.731 1.00 0.00 O ATOM 1019 CB GLU A 71 20.214 -20.783 -4.935 1.00 0.00 C ATOM 1020 CG GLU A 71 21.480 -21.227 -4.193 1.00 0.00 C ATOM 1021 CD GLU A 71 21.412 -22.704 -3.766 1.00 0.00 C ATOM 1022 OE1 GLU A 71 20.749 -23.029 -2.755 1.00 0.00 O ATOM 1023 OE2 GLU A 71 22.035 -23.561 -4.434 1.00 0.00 O ATOM 0 H GLU A 71 20.839 -18.646 -3.846 1.00 0.00 H new ATOM 0 HA GLU A 71 21.244 -19.682 -6.443 1.00 0.00 H new ATOM 0 HB2 GLU A 71 19.406 -20.632 -4.219 1.00 0.00 H new ATOM 0 HB3 GLU A 71 19.894 -21.573 -5.615 1.00 0.00 H new ATOM 0 HG2 GLU A 71 22.348 -21.075 -4.835 1.00 0.00 H new ATOM 0 HG3 GLU A 71 21.622 -20.601 -3.312 1.00 0.00 H new ATOM 1030 N ALA A 72 18.202 -18.490 -5.835 1.00 0.00 N ATOM 1031 CA ALA A 72 16.986 -18.022 -6.491 1.00 0.00 C ATOM 1032 C ALA A 72 17.267 -16.937 -7.534 1.00 0.00 C ATOM 1033 O ALA A 72 16.607 -16.923 -8.571 1.00 0.00 O ATOM 1034 CB ALA A 72 15.991 -17.507 -5.452 1.00 0.00 C ATOM 0 H ALA A 72 18.219 -18.331 -4.828 1.00 0.00 H new ATOM 0 HA ALA A 72 16.556 -18.874 -7.018 1.00 0.00 H new ATOM 0 HB1 ALA A 72 15.088 -17.160 -5.954 1.00 0.00 H new ATOM 0 HB2 ALA A 72 15.737 -18.311 -4.762 1.00 0.00 H new ATOM 0 HB3 ALA A 72 16.438 -16.681 -4.898 1.00 0.00 H new ATOM 1040 N LEU A 73 18.235 -16.042 -7.302 1.00 0.00 N ATOM 1041 CA LEU A 73 18.617 -15.023 -8.266 1.00 0.00 C ATOM 1042 C LEU A 73 19.084 -15.701 -9.540 1.00 0.00 C ATOM 1043 O LEU A 73 18.516 -15.444 -10.594 1.00 0.00 O ATOM 1044 CB LEU A 73 19.736 -14.124 -7.716 1.00 0.00 C ATOM 1045 CG LEU A 73 19.284 -12.971 -6.804 1.00 0.00 C ATOM 1046 CD1 LEU A 73 20.514 -12.172 -6.360 1.00 0.00 C ATOM 1047 CD2 LEU A 73 18.282 -12.022 -7.477 1.00 0.00 C ATOM 0 H LEU A 73 18.772 -16.011 -6.436 1.00 0.00 H new ATOM 0 HA LEU A 73 17.751 -14.392 -8.469 1.00 0.00 H new ATOM 0 HB2 LEU A 73 20.437 -14.748 -7.161 1.00 0.00 H new ATOM 0 HB3 LEU A 73 20.284 -13.702 -8.559 1.00 0.00 H new ATOM 0 HG LEU A 73 18.774 -13.419 -5.951 1.00 0.00 H new ATOM 0 HD11 LEU A 73 20.201 -11.352 -5.713 1.00 0.00 H new ATOM 0 HD12 LEU A 73 21.195 -12.825 -5.815 1.00 0.00 H new ATOM 0 HD13 LEU A 73 21.022 -11.769 -7.236 1.00 0.00 H new ATOM 0 HD21 LEU A 73 18.004 -11.232 -6.779 1.00 0.00 H new ATOM 0 HD22 LEU A 73 18.738 -11.580 -8.363 1.00 0.00 H new ATOM 0 HD23 LEU A 73 17.391 -12.579 -7.767 1.00 0.00 H new ATOM 1059 N GLN A 74 20.072 -16.592 -9.449 1.00 0.00 N ATOM 1060 CA GLN A 74 20.604 -17.278 -10.633 1.00 0.00 C ATOM 1061 C GLN A 74 19.547 -18.119 -11.343 1.00 0.00 C ATOM 1062 O GLN A 74 19.641 -18.339 -12.551 1.00 0.00 O ATOM 1063 CB GLN A 74 21.819 -18.161 -10.315 1.00 0.00 C ATOM 1064 CG GLN A 74 22.847 -17.488 -9.409 1.00 0.00 C ATOM 1065 CD GLN A 74 24.246 -18.043 -9.655 1.00 0.00 C ATOM 1066 OE1 GLN A 74 24.622 -19.103 -9.159 1.00 0.00 O ATOM 1067 NE2 GLN A 74 25.025 -17.348 -10.464 1.00 0.00 N ATOM 0 H GLN A 74 20.521 -16.857 -8.572 1.00 0.00 H new ATOM 0 HA GLN A 74 20.924 -16.477 -11.299 1.00 0.00 H new ATOM 0 HB2 GLN A 74 21.475 -19.079 -9.839 1.00 0.00 H new ATOM 0 HB3 GLN A 74 22.303 -18.447 -11.249 1.00 0.00 H new ATOM 0 HG2 GLN A 74 22.843 -16.413 -9.586 1.00 0.00 H new ATOM 0 HG3 GLN A 74 22.571 -17.640 -8.366 1.00 0.00 H new ATOM 0 HE21 GLN A 74 24.692 -16.471 -10.864 1.00 0.00 H new ATOM 0 HE22 GLN A 74 25.960 -17.688 -10.689 1.00 0.00 H new ATOM 1076 N GLU A 75 18.551 -18.594 -10.599 1.00 0.00 N ATOM 1077 CA GLU A 75 17.540 -19.500 -11.124 1.00 0.00 C ATOM 1078 C GLU A 75 16.616 -18.797 -12.127 1.00 0.00 C ATOM 1079 O GLU A 75 16.157 -19.431 -13.080 1.00 0.00 O ATOM 1080 CB GLU A 75 16.757 -20.133 -9.968 1.00 0.00 C ATOM 1081 CG GLU A 75 15.839 -21.279 -10.414 1.00 0.00 C ATOM 1082 CD GLU A 75 15.190 -21.987 -9.211 1.00 0.00 C ATOM 1083 OE1 GLU A 75 14.134 -21.523 -8.720 1.00 0.00 O ATOM 1084 OE2 GLU A 75 15.710 -23.032 -8.759 1.00 0.00 O ATOM 0 H GLU A 75 18.425 -18.360 -9.614 1.00 0.00 H new ATOM 0 HA GLU A 75 18.040 -20.297 -11.674 1.00 0.00 H new ATOM 0 HB2 GLU A 75 17.460 -20.508 -9.224 1.00 0.00 H new ATOM 0 HB3 GLU A 75 16.157 -19.365 -9.481 1.00 0.00 H new ATOM 0 HG2 GLU A 75 15.061 -20.888 -11.070 1.00 0.00 H new ATOM 0 HG3 GLU A 75 16.413 -22.001 -10.995 1.00 0.00 H new ATOM 1091 N GLN A 76 16.377 -17.492 -11.946 1.00 0.00 N ATOM 1092 CA GLN A 76 15.447 -16.720 -12.779 1.00 0.00 C ATOM 1093 C GLN A 76 16.082 -15.509 -13.476 1.00 0.00 C ATOM 1094 O GLN A 76 15.574 -15.113 -14.526 1.00 0.00 O ATOM 1095 CB GLN A 76 14.190 -16.305 -11.983 1.00 0.00 C ATOM 1096 CG GLN A 76 14.467 -15.782 -10.561 1.00 0.00 C ATOM 1097 CD GLN A 76 13.458 -14.751 -10.036 1.00 0.00 C ATOM 1098 OE1 GLN A 76 12.377 -14.544 -10.583 1.00 0.00 O ATOM 1099 NE2 GLN A 76 13.814 -14.064 -8.963 1.00 0.00 N ATOM 0 H GLN A 76 16.825 -16.940 -11.215 1.00 0.00 H new ATOM 0 HA GLN A 76 15.150 -17.397 -13.580 1.00 0.00 H new ATOM 0 HB2 GLN A 76 13.662 -15.533 -12.542 1.00 0.00 H new ATOM 0 HB3 GLN A 76 13.521 -17.163 -11.915 1.00 0.00 H new ATOM 0 HG2 GLN A 76 14.485 -16.630 -9.876 1.00 0.00 H new ATOM 0 HG3 GLN A 76 15.461 -15.336 -10.542 1.00 0.00 H new ATOM 0 HE21 GLN A 76 14.714 -14.244 -8.517 1.00 0.00 H new ATOM 0 HE22 GLN A 76 13.189 -13.354 -8.581 1.00 0.00 H new ATOM 1108 N LYS A 77 17.170 -14.946 -12.933 1.00 0.00 N ATOM 1109 CA LYS A 77 17.846 -13.710 -13.376 1.00 0.00 C ATOM 1110 C LYS A 77 16.870 -12.712 -14.033 1.00 0.00 C ATOM 1111 O LYS A 77 16.971 -12.475 -15.243 1.00 0.00 O ATOM 1112 CB LYS A 77 19.068 -14.053 -14.250 1.00 0.00 C ATOM 1113 CG LYS A 77 20.148 -14.778 -13.438 1.00 0.00 C ATOM 1114 CD LYS A 77 21.363 -15.242 -14.254 1.00 0.00 C ATOM 1115 CE LYS A 77 21.011 -16.433 -15.152 1.00 0.00 C ATOM 1116 NZ LYS A 77 22.183 -16.935 -15.915 1.00 0.00 N ATOM 0 H LYS A 77 17.632 -15.363 -12.125 1.00 0.00 H new ATOM 0 HA LYS A 77 18.223 -13.187 -12.497 1.00 0.00 H new ATOM 0 HB2 LYS A 77 18.756 -14.680 -15.085 1.00 0.00 H new ATOM 0 HB3 LYS A 77 19.482 -13.139 -14.675 1.00 0.00 H new ATOM 0 HG2 LYS A 77 20.493 -14.115 -12.644 1.00 0.00 H new ATOM 0 HG3 LYS A 77 19.699 -15.646 -12.956 1.00 0.00 H new ATOM 0 HD2 LYS A 77 21.728 -14.418 -14.867 1.00 0.00 H new ATOM 0 HD3 LYS A 77 22.172 -15.520 -13.579 1.00 0.00 H new ATOM 0 HE2 LYS A 77 20.608 -17.239 -14.539 1.00 0.00 H new ATOM 0 HE3 LYS A 77 20.226 -16.139 -15.849 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 21.893 -17.740 -16.507 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 22.554 -16.176 -16.521 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 22.923 -17.242 -15.252 1.00 0.00 H new ATOM 1130 N PRO A 78 15.876 -12.194 -13.281 1.00 0.00 N ATOM 1131 CA PRO A 78 14.777 -11.424 -13.845 1.00 0.00 C ATOM 1132 C PRO A 78 15.232 -10.122 -14.496 1.00 0.00 C ATOM 1133 O PRO A 78 16.336 -9.630 -14.259 1.00 0.00 O ATOM 1134 CB PRO A 78 13.787 -11.166 -12.710 1.00 0.00 C ATOM 1135 CG PRO A 78 14.605 -11.366 -11.438 1.00 0.00 C ATOM 1136 CD PRO A 78 15.708 -12.341 -11.843 1.00 0.00 C ATOM 0 HA PRO A 78 14.312 -11.990 -14.652 1.00 0.00 H new ATOM 0 HB2 PRO A 78 13.376 -10.158 -12.763 1.00 0.00 H new ATOM 0 HB3 PRO A 78 12.945 -11.857 -12.753 1.00 0.00 H new ATOM 0 HG2 PRO A 78 15.020 -10.424 -11.080 1.00 0.00 H new ATOM 0 HG3 PRO A 78 13.993 -11.771 -10.632 1.00 0.00 H new ATOM 0 HD2 PRO A 78 16.637 -12.117 -11.318 1.00 0.00 H new ATOM 0 HD3 PRO A 78 15.436 -13.365 -11.586 1.00 0.00 H new ATOM 1144 N ASP A 79 14.331 -9.555 -15.295 1.00 0.00 N ATOM 1145 CA ASP A 79 14.559 -8.363 -16.115 1.00 0.00 C ATOM 1146 C ASP A 79 14.507 -7.089 -15.268 1.00 0.00 C ATOM 1147 O ASP A 79 13.616 -6.249 -15.396 1.00 0.00 O ATOM 1148 CB ASP A 79 13.573 -8.328 -17.293 1.00 0.00 C ATOM 1149 CG ASP A 79 13.802 -7.108 -18.203 1.00 0.00 C ATOM 1150 OD1 ASP A 79 14.968 -6.685 -18.374 1.00 0.00 O ATOM 1151 OD2 ASP A 79 12.820 -6.600 -18.792 1.00 0.00 O ATOM 0 H ASP A 79 13.386 -9.926 -15.394 1.00 0.00 H new ATOM 0 HA ASP A 79 15.564 -8.413 -16.534 1.00 0.00 H new ATOM 0 HB2 ASP A 79 13.676 -9.241 -17.879 1.00 0.00 H new ATOM 0 HB3 ASP A 79 12.552 -8.308 -16.911 1.00 0.00 H new ATOM 1156 N LEU A 80 15.465 -6.966 -14.349 1.00 0.00 N ATOM 1157 CA LEU A 80 15.586 -5.856 -13.407 1.00 0.00 C ATOM 1158 C LEU A 80 16.052 -4.555 -14.083 1.00 0.00 C ATOM 1159 O LEU A 80 16.349 -3.579 -13.406 1.00 0.00 O ATOM 1160 CB LEU A 80 16.576 -6.226 -12.292 1.00 0.00 C ATOM 1161 CG LEU A 80 16.143 -7.082 -11.077 1.00 0.00 C ATOM 1162 CD1 LEU A 80 14.679 -7.511 -11.080 1.00 0.00 C ATOM 1163 CD2 LEU A 80 17.048 -8.302 -10.907 1.00 0.00 C ATOM 0 H LEU A 80 16.203 -7.661 -14.237 1.00 0.00 H new ATOM 0 HA LEU A 80 14.593 -5.678 -12.995 1.00 0.00 H new ATOM 0 HB2 LEU A 80 17.407 -6.747 -12.767 1.00 0.00 H new ATOM 0 HB3 LEU A 80 16.971 -5.291 -11.896 1.00 0.00 H new ATOM 0 HG LEU A 80 16.254 -6.416 -10.222 1.00 0.00 H new ATOM 0 HD11 LEU A 80 14.472 -8.106 -10.190 1.00 0.00 H new ATOM 0 HD12 LEU A 80 14.041 -6.627 -11.082 1.00 0.00 H new ATOM 0 HD13 LEU A 80 14.476 -8.107 -11.970 1.00 0.00 H new ATOM 0 HD21 LEU A 80 16.718 -8.883 -10.046 1.00 0.00 H new ATOM 0 HD22 LEU A 80 16.997 -8.921 -11.803 1.00 0.00 H new ATOM 0 HD23 LEU A 80 18.076 -7.974 -10.751 1.00 0.00 H new ATOM 1175 N SER A 81 16.120 -4.490 -15.403 1.00 0.00 N ATOM 1176 CA SER A 81 16.521 -3.372 -16.222 1.00 0.00 C ATOM 1177 C SER A 81 15.610 -2.145 -16.045 1.00 0.00 C ATOM 1178 O SER A 81 15.897 -1.075 -16.587 1.00 0.00 O ATOM 1179 CB SER A 81 16.462 -3.904 -17.655 1.00 0.00 C ATOM 1180 OG SER A 81 16.998 -5.213 -17.780 1.00 0.00 O ATOM 0 H SER A 81 15.871 -5.297 -15.975 1.00 0.00 H new ATOM 0 HA SER A 81 17.513 -3.017 -15.945 1.00 0.00 H new ATOM 0 HB2 SER A 81 15.426 -3.907 -17.994 1.00 0.00 H new ATOM 0 HB3 SER A 81 17.010 -3.228 -18.311 1.00 0.00 H new ATOM 0 HG SER A 81 16.415 -5.752 -18.354 1.00 0.00 H new ATOM 1186 N ALA A 82 14.520 -2.303 -15.286 1.00 0.00 N ATOM 1187 CA ALA A 82 13.558 -1.267 -14.946 1.00 0.00 C ATOM 1188 C ALA A 82 13.592 -0.955 -13.441 1.00 0.00 C ATOM 1189 O ALA A 82 12.713 -0.243 -12.948 1.00 0.00 O ATOM 1190 CB ALA A 82 12.169 -1.711 -15.418 1.00 0.00 C ATOM 0 H ALA A 82 14.279 -3.205 -14.875 1.00 0.00 H new ATOM 0 HA ALA A 82 13.817 -0.338 -15.454 1.00 0.00 H new ATOM 0 HB1 ALA A 82 11.437 -0.942 -15.169 1.00 0.00 H new ATOM 0 HB2 ALA A 82 12.183 -1.863 -16.497 1.00 0.00 H new ATOM 0 HB3 ALA A 82 11.898 -2.644 -14.924 1.00 0.00 H new ATOM 1196 N VAL A 83 14.581 -1.467 -12.699 1.00 0.00 N ATOM 1197 CA VAL A 83 14.756 -1.155 -11.280 1.00 0.00 C ATOM 1198 C VAL A 83 16.215 -0.809 -10.962 1.00 0.00 C ATOM 1199 O VAL A 83 17.144 -1.236 -11.649 1.00 0.00 O ATOM 1200 CB VAL A 83 14.127 -2.273 -10.407 1.00 0.00 C ATOM 1201 CG1 VAL A 83 14.412 -3.697 -10.884 1.00 0.00 C ATOM 1202 CG2 VAL A 83 14.501 -2.250 -8.924 1.00 0.00 C ATOM 0 H VAL A 83 15.282 -2.110 -13.068 1.00 0.00 H new ATOM 0 HA VAL A 83 14.209 -0.248 -11.024 1.00 0.00 H new ATOM 0 HB VAL A 83 13.072 -2.026 -10.527 1.00 0.00 H new ATOM 0 HG11 VAL A 83 13.932 -4.409 -10.212 1.00 0.00 H new ATOM 0 HG12 VAL A 83 14.019 -3.828 -11.892 1.00 0.00 H new ATOM 0 HG13 VAL A 83 15.488 -3.871 -10.888 1.00 0.00 H new ATOM 0 HG21 VAL A 83 14.006 -3.074 -8.411 1.00 0.00 H new ATOM 0 HG22 VAL A 83 15.581 -2.354 -8.819 1.00 0.00 H new ATOM 0 HG23 VAL A 83 14.183 -1.305 -8.483 1.00 0.00 H new ATOM 1212 N ARG A 84 16.425 -0.011 -9.910 1.00 0.00 N ATOM 1213 CA ARG A 84 17.754 0.231 -9.352 1.00 0.00 C ATOM 1214 C ARG A 84 17.881 -0.584 -8.074 1.00 0.00 C ATOM 1215 O ARG A 84 16.881 -0.764 -7.376 1.00 0.00 O ATOM 1216 CB ARG A 84 17.970 1.735 -9.109 1.00 0.00 C ATOM 1217 CG ARG A 84 17.288 2.282 -7.837 1.00 0.00 C ATOM 1218 CD ARG A 84 17.234 3.813 -7.764 1.00 0.00 C ATOM 1219 NE ARG A 84 18.514 4.421 -8.160 1.00 0.00 N ATOM 1220 CZ ARG A 84 18.668 5.347 -9.120 1.00 0.00 C ATOM 1221 NH1 ARG A 84 17.637 6.069 -9.556 1.00 0.00 N ATOM 1222 NH2 ARG A 84 19.867 5.529 -9.654 1.00 0.00 N ATOM 0 H ARG A 84 15.677 0.484 -9.424 1.00 0.00 H new ATOM 0 HA ARG A 84 18.530 -0.082 -10.050 1.00 0.00 H new ATOM 0 HB2 ARG A 84 19.041 1.930 -9.044 1.00 0.00 H new ATOM 0 HB3 ARG A 84 17.597 2.287 -9.972 1.00 0.00 H new ATOM 0 HG2 ARG A 84 16.272 1.891 -7.786 1.00 0.00 H new ATOM 0 HG3 ARG A 84 17.819 1.906 -6.963 1.00 0.00 H new ATOM 0 HD2 ARG A 84 16.440 4.181 -8.414 1.00 0.00 H new ATOM 0 HD3 ARG A 84 16.983 4.121 -6.749 1.00 0.00 H new ATOM 0 HE ARG A 84 19.352 4.114 -7.665 1.00 0.00 H new ATOM 0 HH11 ARG A 84 16.709 5.923 -9.160 1.00 0.00 H new ATOM 0 HH12 ARG A 84 17.776 6.767 -10.286 1.00 0.00 H new ATOM 0 HH21 ARG A 84 20.658 4.969 -9.335 1.00 0.00 H new ATOM 0 HH22 ARG A 84 19.999 6.229 -10.384 1.00 0.00 H new ATOM 1236 N PHE A 85 19.094 -1.006 -7.730 1.00 0.00 N ATOM 1237 CA PHE A 85 19.364 -1.601 -6.428 1.00 0.00 C ATOM 1238 C PHE A 85 20.454 -0.799 -5.732 1.00 0.00 C ATOM 1239 O PHE A 85 21.248 -0.096 -6.368 1.00 0.00 O ATOM 1240 CB PHE A 85 19.690 -3.100 -6.518 1.00 0.00 C ATOM 1241 CG PHE A 85 21.136 -3.476 -6.788 1.00 0.00 C ATOM 1242 CD1 PHE A 85 21.631 -3.465 -8.102 1.00 0.00 C ATOM 1243 CD2 PHE A 85 21.973 -3.903 -5.737 1.00 0.00 C ATOM 1244 CE1 PHE A 85 22.916 -3.950 -8.379 1.00 0.00 C ATOM 1245 CE2 PHE A 85 23.277 -4.357 -6.009 1.00 0.00 C ATOM 1246 CZ PHE A 85 23.741 -4.402 -7.334 1.00 0.00 C ATOM 0 H PHE A 85 19.909 -0.946 -8.340 1.00 0.00 H new ATOM 0 HA PHE A 85 18.458 -1.552 -5.824 1.00 0.00 H new ATOM 0 HB2 PHE A 85 19.387 -3.569 -5.582 1.00 0.00 H new ATOM 0 HB3 PHE A 85 19.074 -3.534 -7.306 1.00 0.00 H new ATOM 0 HD1 PHE A 85 21.018 -3.081 -8.904 1.00 0.00 H new ATOM 0 HD2 PHE A 85 21.612 -3.882 -4.719 1.00 0.00 H new ATOM 0 HE1 PHE A 85 23.274 -3.977 -9.398 1.00 0.00 H new ATOM 0 HE2 PHE A 85 23.920 -4.670 -5.200 1.00 0.00 H new ATOM 0 HZ PHE A 85 24.728 -4.783 -7.549 1.00 0.00 H new ATOM 1256 N GLY A 86 20.498 -0.940 -4.414 1.00 0.00 N ATOM 1257 CA GLY A 86 21.577 -0.450 -3.579 1.00 0.00 C ATOM 1258 C GLY A 86 21.875 -1.562 -2.575 1.00 0.00 C ATOM 1259 O GLY A 86 20.947 -2.235 -2.116 1.00 0.00 O ATOM 0 H GLY A 86 19.763 -1.411 -3.886 1.00 0.00 H new ATOM 0 HA2 GLY A 86 22.458 -0.219 -4.177 1.00 0.00 H new ATOM 0 HA3 GLY A 86 21.288 0.469 -3.069 1.00 0.00 H new ATOM 1263 N ALA A 87 23.152 -1.799 -2.270 1.00 0.00 N ATOM 1264 CA ALA A 87 23.582 -2.886 -1.398 1.00 0.00 C ATOM 1265 C ALA A 87 24.101 -2.288 -0.099 1.00 0.00 C ATOM 1266 O ALA A 87 24.769 -1.253 -0.130 1.00 0.00 O ATOM 1267 CB ALA A 87 24.666 -3.709 -2.096 1.00 0.00 C ATOM 0 H ALA A 87 23.923 -1.234 -2.627 1.00 0.00 H new ATOM 0 HA ALA A 87 22.747 -3.550 -1.176 1.00 0.00 H new ATOM 0 HB1 ALA A 87 24.985 -4.520 -1.442 1.00 0.00 H new ATOM 0 HB2 ALA A 87 24.268 -4.125 -3.022 1.00 0.00 H new ATOM 0 HB3 ALA A 87 25.519 -3.069 -2.323 1.00 0.00 H new ATOM 1273 N ILE A 88 23.819 -2.934 1.031 1.00 0.00 N ATOM 1274 CA ILE A 88 24.052 -2.387 2.361 1.00 0.00 C ATOM 1275 C ILE A 88 24.602 -3.501 3.247 1.00 0.00 C ATOM 1276 O ILE A 88 24.136 -4.639 3.172 1.00 0.00 O ATOM 1277 CB ILE A 88 22.724 -1.818 2.929 1.00 0.00 C ATOM 1278 CG1 ILE A 88 22.042 -0.824 1.952 1.00 0.00 C ATOM 1279 CG2 ILE A 88 22.952 -1.195 4.320 1.00 0.00 C ATOM 1280 CD1 ILE A 88 20.793 -0.106 2.478 1.00 0.00 C ATOM 0 H ILE A 88 23.414 -3.870 1.045 1.00 0.00 H new ATOM 0 HA ILE A 88 24.775 -1.572 2.324 1.00 0.00 H new ATOM 0 HB ILE A 88 22.031 -2.652 3.043 1.00 0.00 H new ATOM 0 HG12 ILE A 88 22.775 -0.070 1.664 1.00 0.00 H new ATOM 0 HG13 ILE A 88 21.770 -1.366 1.047 1.00 0.00 H new ATOM 0 HG21 ILE A 88 22.010 -0.802 4.701 1.00 0.00 H new ATOM 0 HG22 ILE A 88 23.330 -1.956 5.002 1.00 0.00 H new ATOM 0 HG23 ILE A 88 23.678 -0.386 4.242 1.00 0.00 H new ATOM 0 HD11 ILE A 88 20.405 0.561 1.708 1.00 0.00 H new ATOM 0 HD12 ILE A 88 20.032 -0.842 2.737 1.00 0.00 H new ATOM 0 HD13 ILE A 88 21.053 0.474 3.364 1.00 0.00 H new ATOM 1292 N GLY A 89 25.595 -3.183 4.083 1.00 0.00 N ATOM 1293 CA GLY A 89 26.176 -4.094 5.075 1.00 0.00 C ATOM 1294 C GLY A 89 27.173 -5.066 4.438 1.00 0.00 C ATOM 1295 O GLY A 89 28.153 -5.458 5.071 1.00 0.00 O ATOM 0 H GLY A 89 26.029 -2.260 4.089 1.00 0.00 H new ATOM 0 HA2 GLY A 89 26.677 -3.515 5.851 1.00 0.00 H new ATOM 0 HA3 GLY A 89 25.380 -4.657 5.562 1.00 0.00 H new ATOM 1299 N ILE A 90 26.940 -5.409 3.171 1.00 0.00 N ATOM 1300 CA ILE A 90 27.836 -6.129 2.285 1.00 0.00 C ATOM 1301 C ILE A 90 29.196 -5.413 2.343 1.00 0.00 C ATOM 1302 O ILE A 90 29.276 -4.195 2.171 1.00 0.00 O ATOM 1303 CB ILE A 90 27.164 -6.165 0.886 1.00 0.00 C ATOM 1304 CG1 ILE A 90 25.858 -7.000 0.967 1.00 0.00 C ATOM 1305 CG2 ILE A 90 28.091 -6.641 -0.242 1.00 0.00 C ATOM 1306 CD1 ILE A 90 25.260 -7.480 -0.364 1.00 0.00 C ATOM 0 H ILE A 90 26.060 -5.172 2.712 1.00 0.00 H new ATOM 0 HA ILE A 90 28.020 -7.166 2.565 1.00 0.00 H new ATOM 0 HB ILE A 90 26.921 -5.138 0.614 1.00 0.00 H new ATOM 0 HG12 ILE A 90 26.052 -7.875 1.588 1.00 0.00 H new ATOM 0 HG13 ILE A 90 25.105 -6.404 1.483 1.00 0.00 H new ATOM 0 HG21 ILE A 90 27.546 -6.638 -1.186 1.00 0.00 H new ATOM 0 HG22 ILE A 90 28.948 -5.972 -0.315 1.00 0.00 H new ATOM 0 HG23 ILE A 90 28.437 -7.652 -0.026 1.00 0.00 H new ATOM 0 HD11 ILE A 90 24.352 -8.051 -0.170 1.00 0.00 H new ATOM 0 HD12 ILE A 90 25.021 -6.618 -0.987 1.00 0.00 H new ATOM 0 HD13 ILE A 90 25.982 -8.112 -0.881 1.00 0.00 H new ATOM 1318 N GLY A 91 30.263 -6.167 2.615 1.00 0.00 N ATOM 1319 CA GLY A 91 31.614 -5.627 2.792 1.00 0.00 C ATOM 1320 C GLY A 91 32.474 -5.754 1.535 1.00 0.00 C ATOM 1321 O GLY A 91 33.514 -5.105 1.421 1.00 0.00 O ATOM 0 H GLY A 91 30.214 -7.180 2.720 1.00 0.00 H new ATOM 0 HA2 GLY A 91 31.546 -4.577 3.075 1.00 0.00 H new ATOM 0 HA3 GLY A 91 32.103 -6.148 3.615 1.00 0.00 H new ATOM 1325 N SER A 92 32.014 -6.560 0.584 1.00 0.00 N ATOM 1326 CA SER A 92 32.697 -7.043 -0.606 1.00 0.00 C ATOM 1327 C SER A 92 33.415 -5.994 -1.457 1.00 0.00 C ATOM 1328 O SER A 92 34.379 -6.331 -2.146 1.00 0.00 O ATOM 1329 CB SER A 92 31.649 -7.778 -1.437 1.00 0.00 C ATOM 1330 OG SER A 92 30.929 -8.656 -0.605 1.00 0.00 O ATOM 0 H SER A 92 31.063 -6.925 0.634 1.00 0.00 H new ATOM 0 HA SER A 92 33.514 -7.681 -0.270 1.00 0.00 H new ATOM 0 HB2 SER A 92 30.971 -7.063 -1.904 1.00 0.00 H new ATOM 0 HB3 SER A 92 32.130 -8.334 -2.242 1.00 0.00 H new ATOM 0 HG SER A 92 30.254 -9.129 -1.135 1.00 0.00 H new ATOM 1501 N LYS A 104 29.429 -11.888 -5.297 1.00 0.00 N ATOM 1502 CA LYS A 104 28.615 -12.517 -6.331 1.00 0.00 C ATOM 1503 C LYS A 104 27.153 -12.088 -6.231 1.00 0.00 C ATOM 1504 O LYS A 104 26.494 -12.024 -7.267 1.00 0.00 O ATOM 1505 CB LYS A 104 28.751 -14.046 -6.307 1.00 0.00 C ATOM 1506 CG LYS A 104 30.196 -14.552 -6.393 1.00 0.00 C ATOM 1507 CD LYS A 104 30.248 -16.085 -6.307 1.00 0.00 C ATOM 1508 CE LYS A 104 31.685 -16.628 -6.308 1.00 0.00 C ATOM 1509 NZ LYS A 104 32.377 -16.445 -7.611 1.00 0.00 N ATOM 0 HA LYS A 104 28.993 -12.171 -7.293 1.00 0.00 H new ATOM 0 HB2 LYS A 104 28.300 -14.425 -5.390 1.00 0.00 H new ATOM 0 HB3 LYS A 104 28.182 -14.463 -7.138 1.00 0.00 H new ATOM 0 HG2 LYS A 104 30.646 -14.221 -7.329 1.00 0.00 H new ATOM 0 HG3 LYS A 104 30.786 -14.119 -5.585 1.00 0.00 H new ATOM 0 HD2 LYS A 104 29.741 -16.412 -5.399 1.00 0.00 H new ATOM 0 HD3 LYS A 104 29.702 -16.511 -7.148 1.00 0.00 H new ATOM 0 HE2 LYS A 104 32.257 -16.127 -5.526 1.00 0.00 H new ATOM 0 HE3 LYS A 104 31.666 -17.689 -6.059 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 33.341 -16.831 -7.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 31.851 -16.945 -8.356 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 32.424 -15.432 -7.840 1.00 0.00 H new ATOM 1523 N LEU A 105 26.646 -11.760 -5.036 1.00 0.00 N ATOM 1524 CA LEU A 105 25.317 -11.181 -4.865 1.00 0.00 C ATOM 1525 C LEU A 105 25.181 -9.943 -5.744 1.00 0.00 C ATOM 1526 O LEU A 105 24.280 -9.886 -6.584 1.00 0.00 O ATOM 1527 CB LEU A 105 25.084 -10.851 -3.376 1.00 0.00 C ATOM 1528 CG LEU A 105 23.742 -10.187 -2.994 1.00 0.00 C ATOM 1529 CD1 LEU A 105 23.602 -8.720 -3.419 1.00 0.00 C ATOM 1530 CD2 LEU A 105 22.535 -10.988 -3.498 1.00 0.00 C ATOM 0 H LEU A 105 27.152 -11.891 -4.160 1.00 0.00 H new ATOM 0 HA LEU A 105 24.555 -11.897 -5.174 1.00 0.00 H new ATOM 0 HB2 LEU A 105 25.175 -11.777 -2.808 1.00 0.00 H new ATOM 0 HB3 LEU A 105 25.890 -10.195 -3.047 1.00 0.00 H new ATOM 0 HG LEU A 105 23.754 -10.193 -1.904 1.00 0.00 H new ATOM 0 HD11 LEU A 105 22.628 -8.342 -3.107 1.00 0.00 H new ATOM 0 HD12 LEU A 105 24.388 -8.129 -2.949 1.00 0.00 H new ATOM 0 HD13 LEU A 105 23.690 -8.645 -4.503 1.00 0.00 H new ATOM 0 HD21 LEU A 105 21.615 -10.482 -3.205 1.00 0.00 H new ATOM 0 HD22 LEU A 105 22.577 -11.065 -4.584 1.00 0.00 H new ATOM 0 HD23 LEU A 105 22.554 -11.987 -3.063 1.00 0.00 H new ATOM 1542 N GLU A 106 26.070 -8.959 -5.563 1.00 0.00 N ATOM 1543 CA GLU A 106 25.964 -7.705 -6.303 1.00 0.00 C ATOM 1544 C GLU A 106 26.138 -7.993 -7.794 1.00 0.00 C ATOM 1545 O GLU A 106 25.401 -7.447 -8.615 1.00 0.00 O ATOM 1546 CB GLU A 106 27.009 -6.666 -5.846 1.00 0.00 C ATOM 1547 CG GLU A 106 27.013 -6.377 -4.335 1.00 0.00 C ATOM 1548 CD GLU A 106 28.095 -5.345 -3.961 1.00 0.00 C ATOM 1549 OE1 GLU A 106 29.297 -5.695 -3.976 1.00 0.00 O ATOM 1550 OE2 GLU A 106 27.740 -4.182 -3.652 1.00 0.00 O ATOM 0 H GLU A 106 26.859 -9.009 -4.919 1.00 0.00 H new ATOM 0 HA GLU A 106 24.980 -7.279 -6.107 1.00 0.00 H new ATOM 0 HB2 GLU A 106 28.000 -7.015 -6.138 1.00 0.00 H new ATOM 0 HB3 GLU A 106 26.830 -5.733 -6.380 1.00 0.00 H new ATOM 0 HG2 GLU A 106 26.034 -6.006 -4.032 1.00 0.00 H new ATOM 0 HG3 GLU A 106 27.187 -7.303 -3.787 1.00 0.00 H new ATOM 1557 N ALA A 107 27.077 -8.882 -8.144 1.00 0.00 N ATOM 1558 CA ALA A 107 27.383 -9.201 -9.526 1.00 0.00 C ATOM 1559 C ALA A 107 26.143 -9.745 -10.228 1.00 0.00 C ATOM 1560 O ALA A 107 25.798 -9.258 -11.303 1.00 0.00 O ATOM 1561 CB ALA A 107 28.541 -10.202 -9.598 1.00 0.00 C ATOM 0 H ALA A 107 27.642 -9.396 -7.468 1.00 0.00 H new ATOM 0 HA ALA A 107 27.692 -8.290 -10.039 1.00 0.00 H new ATOM 0 HB1 ALA A 107 28.759 -10.432 -10.641 1.00 0.00 H new ATOM 0 HB2 ALA A 107 29.425 -9.770 -9.129 1.00 0.00 H new ATOM 0 HB3 ALA A 107 28.264 -11.117 -9.075 1.00 0.00 H new ATOM 1567 N GLU A 108 25.441 -10.711 -9.626 1.00 0.00 N ATOM 1568 CA GLU A 108 24.284 -11.321 -10.247 1.00 0.00 C ATOM 1569 C GLU A 108 23.132 -10.332 -10.389 1.00 0.00 C ATOM 1570 O GLU A 108 22.417 -10.426 -11.387 1.00 0.00 O ATOM 1571 CB GLU A 108 23.869 -12.579 -9.480 1.00 0.00 C ATOM 1572 CG GLU A 108 24.804 -13.771 -9.732 1.00 0.00 C ATOM 1573 CD GLU A 108 24.892 -14.170 -11.214 1.00 0.00 C ATOM 1574 OE1 GLU A 108 24.066 -15.001 -11.650 1.00 0.00 O ATOM 1575 OE2 GLU A 108 25.811 -13.706 -11.925 1.00 0.00 O ATOM 0 H GLU A 108 25.665 -11.082 -8.703 1.00 0.00 H new ATOM 0 HA GLU A 108 24.559 -11.621 -11.258 1.00 0.00 H new ATOM 0 HB2 GLU A 108 23.851 -12.358 -8.413 1.00 0.00 H new ATOM 0 HB3 GLU A 108 22.854 -12.854 -9.766 1.00 0.00 H new ATOM 0 HG2 GLU A 108 25.802 -13.525 -9.369 1.00 0.00 H new ATOM 0 HG3 GLU A 108 24.456 -14.626 -9.152 1.00 0.00 H new ATOM 1582 N LEU A 109 22.966 -9.361 -9.484 1.00 0.00 N ATOM 1583 CA LEU A 109 21.930 -8.336 -9.633 1.00 0.00 C ATOM 1584 C LEU A 109 22.226 -7.436 -10.833 1.00 0.00 C ATOM 1585 O LEU A 109 21.330 -7.176 -11.640 1.00 0.00 O ATOM 1586 CB LEU A 109 21.809 -7.483 -8.357 1.00 0.00 C ATOM 1587 CG LEU A 109 21.170 -8.214 -7.162 1.00 0.00 C ATOM 1588 CD1 LEU A 109 21.196 -7.314 -5.926 1.00 0.00 C ATOM 1589 CD2 LEU A 109 19.715 -8.611 -7.431 1.00 0.00 C ATOM 0 H LEU A 109 23.535 -9.264 -8.643 1.00 0.00 H new ATOM 0 HA LEU A 109 20.982 -8.847 -9.801 1.00 0.00 H new ATOM 0 HB2 LEU A 109 22.802 -7.140 -8.068 1.00 0.00 H new ATOM 0 HB3 LEU A 109 21.218 -6.595 -8.583 1.00 0.00 H new ATOM 0 HG LEU A 109 21.754 -9.120 -7.000 1.00 0.00 H new ATOM 0 HD11 LEU A 109 20.742 -7.838 -5.085 1.00 0.00 H new ATOM 0 HD12 LEU A 109 22.228 -7.061 -5.682 1.00 0.00 H new ATOM 0 HD13 LEU A 109 20.637 -6.401 -6.129 1.00 0.00 H new ATOM 0 HD21 LEU A 109 19.310 -9.123 -6.558 1.00 0.00 H new ATOM 0 HD22 LEU A 109 19.125 -7.717 -7.633 1.00 0.00 H new ATOM 0 HD23 LEU A 109 19.673 -9.276 -8.294 1.00 0.00 H new ATOM 1601 N LYS A 110 23.481 -7.007 -10.994 1.00 0.00 N ATOM 1602 CA LYS A 110 23.912 -6.166 -12.112 1.00 0.00 C ATOM 1603 C LYS A 110 23.729 -6.923 -13.424 1.00 0.00 C ATOM 1604 O LYS A 110 23.265 -6.356 -14.411 1.00 0.00 O ATOM 1605 CB LYS A 110 25.384 -5.750 -11.913 1.00 0.00 C ATOM 1606 CG LYS A 110 25.587 -4.906 -10.641 1.00 0.00 C ATOM 1607 CD LYS A 110 27.060 -4.760 -10.225 1.00 0.00 C ATOM 1608 CE LYS A 110 27.765 -3.672 -11.047 1.00 0.00 C ATOM 1609 NZ LYS A 110 29.225 -3.627 -10.782 1.00 0.00 N ATOM 0 H LYS A 110 24.233 -7.237 -10.345 1.00 0.00 H new ATOM 0 HA LYS A 110 23.303 -5.263 -12.149 1.00 0.00 H new ATOM 0 HB2 LYS A 110 26.007 -6.643 -11.857 1.00 0.00 H new ATOM 0 HB3 LYS A 110 25.719 -5.182 -12.781 1.00 0.00 H new ATOM 0 HG2 LYS A 110 25.164 -3.914 -10.802 1.00 0.00 H new ATOM 0 HG3 LYS A 110 25.030 -5.360 -9.821 1.00 0.00 H new ATOM 0 HD2 LYS A 110 27.118 -4.513 -9.165 1.00 0.00 H new ATOM 0 HD3 LYS A 110 27.574 -5.712 -10.360 1.00 0.00 H new ATOM 0 HE2 LYS A 110 27.595 -3.854 -12.108 1.00 0.00 H new ATOM 0 HE3 LYS A 110 27.325 -2.702 -10.815 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 29.660 -2.878 -11.358 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 29.389 -3.428 -9.775 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 29.651 -4.544 -11.027 1.00 0.00 H new ATOM 1623 N ASN A 111 24.053 -8.217 -13.415 1.00 0.00 N ATOM 1624 CA ASN A 111 23.904 -9.127 -14.543 1.00 0.00 C ATOM 1625 C ASN A 111 22.433 -9.349 -14.886 1.00 0.00 C ATOM 1626 O ASN A 111 22.093 -9.460 -16.063 1.00 0.00 O ATOM 1627 CB ASN A 111 24.619 -10.444 -14.197 1.00 0.00 C ATOM 1628 CG ASN A 111 23.866 -11.720 -14.564 1.00 0.00 C ATOM 1629 OD1 ASN A 111 24.043 -12.287 -15.637 1.00 0.00 O ATOM 1630 ND2 ASN A 111 23.033 -12.203 -13.654 1.00 0.00 N ATOM 0 H ASN A 111 24.441 -8.673 -12.589 1.00 0.00 H new ATOM 0 HA ASN A 111 24.360 -8.694 -15.433 1.00 0.00 H new ATOM 0 HB2 ASN A 111 25.585 -10.456 -14.702 1.00 0.00 H new ATOM 0 HB3 ASN A 111 24.819 -10.457 -13.126 1.00 0.00 H new ATOM 0 HD21 ASN A 111 22.521 -13.066 -13.838 1.00 0.00 H new ATOM 0 HD22 ASN A 111 22.904 -11.712 -12.769 1.00 0.00 H new ATOM 1637 N SER A 112 21.568 -9.407 -13.872 1.00 0.00 N ATOM 1638 CA SER A 112 20.142 -9.615 -14.080 1.00 0.00 C ATOM 1639 C SER A 112 19.527 -8.356 -14.702 1.00 0.00 C ATOM 1640 O SER A 112 18.728 -8.454 -15.634 1.00 0.00 O ATOM 1641 CB SER A 112 19.453 -10.012 -12.777 1.00 0.00 C ATOM 1642 OG SER A 112 20.005 -11.204 -12.251 1.00 0.00 O ATOM 0 H SER A 112 21.837 -9.312 -12.893 1.00 0.00 H new ATOM 0 HA SER A 112 19.993 -10.442 -14.774 1.00 0.00 H new ATOM 0 HB2 SER A 112 19.555 -9.208 -12.048 1.00 0.00 H new ATOM 0 HB3 SER A 112 18.386 -10.149 -12.953 1.00 0.00 H new ATOM 0 HG SER A 112 20.891 -11.017 -11.876 1.00 0.00 H new ATOM 1648 N GLY A 113 19.957 -7.170 -14.250 1.00 0.00 N ATOM 1649 CA GLY A 113 19.611 -5.916 -14.906 1.00 0.00 C ATOM 1650 C GLY A 113 19.619 -4.691 -13.995 1.00 0.00 C ATOM 1651 O GLY A 113 19.689 -3.579 -14.519 1.00 0.00 O ATOM 0 H GLY A 113 20.549 -7.060 -13.426 1.00 0.00 H new ATOM 0 HA2 GLY A 113 20.310 -5.746 -15.725 1.00 0.00 H new ATOM 0 HA3 GLY A 113 18.620 -6.015 -15.348 1.00 0.00 H new ATOM 1655 N ALA A 114 19.518 -4.853 -12.666 1.00 0.00 N ATOM 1656 CA ALA A 114 19.355 -3.704 -11.784 1.00 0.00 C ATOM 1657 C ALA A 114 20.636 -2.878 -11.810 1.00 0.00 C ATOM 1658 O ALA A 114 21.735 -3.432 -11.732 1.00 0.00 O ATOM 1659 CB ALA A 114 18.998 -4.097 -10.345 1.00 0.00 C ATOM 0 H ALA A 114 19.547 -5.756 -12.192 1.00 0.00 H new ATOM 0 HA ALA A 114 18.514 -3.117 -12.153 1.00 0.00 H new ATOM 0 HB1 ALA A 114 18.890 -3.198 -9.738 1.00 0.00 H new ATOM 0 HB2 ALA A 114 18.060 -4.652 -10.341 1.00 0.00 H new ATOM 0 HB3 ALA A 114 19.790 -4.721 -9.931 1.00 0.00 H new ATOM 1665 N LYS A 115 20.507 -1.552 -11.886 1.00 0.00 N ATOM 1666 CA LYS A 115 21.676 -0.682 -11.850 1.00 0.00 C ATOM 1667 C LYS A 115 22.093 -0.564 -10.393 1.00 0.00 C ATOM 1668 O LYS A 115 21.244 -0.254 -9.552 1.00 0.00 O ATOM 1669 CB LYS A 115 21.395 0.675 -12.531 1.00 0.00 C ATOM 1670 CG LYS A 115 20.180 1.456 -11.994 1.00 0.00 C ATOM 1671 CD LYS A 115 19.972 2.810 -12.689 1.00 0.00 C ATOM 1672 CE LYS A 115 19.590 2.649 -14.170 1.00 0.00 C ATOM 1673 NZ LYS A 115 19.338 3.953 -14.833 1.00 0.00 N ATOM 0 H LYS A 115 19.615 -1.065 -11.972 1.00 0.00 H new ATOM 0 HA LYS A 115 22.503 -1.101 -12.424 1.00 0.00 H new ATOM 0 HB2 LYS A 115 22.281 1.302 -12.428 1.00 0.00 H new ATOM 0 HB3 LYS A 115 21.249 0.502 -13.597 1.00 0.00 H new ATOM 0 HG2 LYS A 115 19.283 0.850 -12.119 1.00 0.00 H new ATOM 0 HG3 LYS A 115 20.307 1.620 -10.924 1.00 0.00 H new ATOM 0 HD2 LYS A 115 19.190 3.366 -12.172 1.00 0.00 H new ATOM 0 HD3 LYS A 115 20.885 3.400 -12.613 1.00 0.00 H new ATOM 0 HE2 LYS A 115 20.390 2.126 -14.694 1.00 0.00 H new ATOM 0 HE3 LYS A 115 18.698 2.027 -14.247 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 19.084 3.793 -15.829 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 18.557 4.442 -14.351 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 20.196 4.539 -14.784 1.00 0.00 H new ATOM 1687 N GLN A 116 23.361 -0.839 -10.075 1.00 0.00 N ATOM 1688 CA GLN A 116 23.866 -0.528 -8.749 1.00 0.00 C ATOM 1689 C GLN A 116 24.050 0.983 -8.719 1.00 0.00 C ATOM 1690 O GLN A 116 24.899 1.515 -9.439 1.00 0.00 O ATOM 1691 CB GLN A 116 25.163 -1.272 -8.404 1.00 0.00 C ATOM 1692 CG GLN A 116 25.527 -0.965 -6.939 1.00 0.00 C ATOM 1693 CD GLN A 116 26.516 -1.946 -6.317 1.00 0.00 C ATOM 1694 OE1 GLN A 116 27.448 -2.430 -6.957 1.00 0.00 O ATOM 1695 NE2 GLN A 116 26.354 -2.217 -5.033 1.00 0.00 N ATOM 0 H GLN A 116 24.038 -1.267 -10.706 1.00 0.00 H new ATOM 0 HA GLN A 116 23.161 -0.862 -7.988 1.00 0.00 H new ATOM 0 HB2 GLN A 116 25.033 -2.345 -8.545 1.00 0.00 H new ATOM 0 HB3 GLN A 116 25.968 -0.958 -9.068 1.00 0.00 H new ATOM 0 HG2 GLN A 116 25.947 0.039 -6.884 1.00 0.00 H new ATOM 0 HG3 GLN A 116 24.614 -0.961 -6.343 1.00 0.00 H new ATOM 0 HE21 GLN A 116 25.575 -1.806 -4.519 1.00 0.00 H new ATOM 0 HE22 GLN A 116 27.008 -2.837 -4.556 1.00 0.00 H new ATOM 1704 N THR A 117 23.251 1.674 -7.915 1.00 0.00 N ATOM 1705 CA THR A 117 23.425 3.106 -7.719 1.00 0.00 C ATOM 1706 C THR A 117 24.463 3.335 -6.617 1.00 0.00 C ATOM 1707 O THR A 117 24.623 2.493 -5.728 1.00 0.00 O ATOM 1708 CB THR A 117 22.072 3.720 -7.364 1.00 0.00 C ATOM 1709 OG1 THR A 117 21.123 3.333 -8.335 1.00 0.00 O ATOM 1710 CG2 THR A 117 22.098 5.250 -7.353 1.00 0.00 C ATOM 0 H THR A 117 22.478 1.266 -7.390 1.00 0.00 H new ATOM 0 HA THR A 117 23.789 3.586 -8.627 1.00 0.00 H new ATOM 0 HB THR A 117 21.820 3.366 -6.365 1.00 0.00 H new ATOM 0 HG1 THR A 117 21.571 3.203 -9.197 1.00 0.00 H new ATOM 0 HG21 THR A 117 21.109 5.629 -7.094 1.00 0.00 H new ATOM 0 HG22 THR A 117 22.823 5.596 -6.617 1.00 0.00 H new ATOM 0 HG23 THR A 117 22.380 5.616 -8.340 1.00 0.00 H new ATOM 1718 N GLY A 118 25.122 4.497 -6.646 1.00 0.00 N ATOM 1719 CA GLY A 118 26.048 4.910 -5.609 1.00 0.00 C ATOM 1720 C GLY A 118 27.190 3.904 -5.545 1.00 0.00 C ATOM 1721 O GLY A 118 27.824 3.599 -6.558 1.00 0.00 O ATOM 0 H GLY A 118 25.021 5.177 -7.400 1.00 0.00 H new ATOM 0 HA2 GLY A 118 26.434 5.907 -5.822 1.00 0.00 H new ATOM 0 HA3 GLY A 118 25.538 4.965 -4.647 1.00 0.00 H new ATOM 1725 N GLU A 119 27.411 3.365 -4.353 1.00 0.00 N ATOM 1726 CA GLU A 119 28.293 2.236 -4.091 1.00 0.00 C ATOM 1727 C GLU A 119 27.796 1.546 -2.815 1.00 0.00 C ATOM 1728 O GLU A 119 26.935 2.088 -2.113 1.00 0.00 O ATOM 1729 CB GLU A 119 29.764 2.692 -4.001 1.00 0.00 C ATOM 1730 CG GLU A 119 30.114 3.542 -2.777 1.00 0.00 C ATOM 1731 CD GLU A 119 31.542 4.105 -2.876 1.00 0.00 C ATOM 1732 OE1 GLU A 119 31.737 5.194 -3.465 1.00 0.00 O ATOM 1733 OE2 GLU A 119 32.483 3.469 -2.350 1.00 0.00 O ATOM 0 H GLU A 119 26.962 3.717 -3.508 1.00 0.00 H new ATOM 0 HA GLU A 119 28.265 1.519 -4.912 1.00 0.00 H new ATOM 0 HB2 GLU A 119 30.402 1.808 -4.003 1.00 0.00 H new ATOM 0 HB3 GLU A 119 30.006 3.261 -4.899 1.00 0.00 H new ATOM 0 HG2 GLU A 119 29.403 4.363 -2.687 1.00 0.00 H new ATOM 0 HG3 GLU A 119 30.021 2.939 -1.874 1.00 0.00 H new ATOM 1740 N THR A 120 28.323 0.358 -2.519 1.00 0.00 N ATOM 1741 CA THR A 120 27.952 -0.452 -1.368 1.00 0.00 C ATOM 1742 C THR A 120 28.032 0.374 -0.074 1.00 0.00 C ATOM 1743 O THR A 120 29.030 1.057 0.195 1.00 0.00 O ATOM 1744 CB THR A 120 28.856 -1.696 -1.330 1.00 0.00 C ATOM 1745 OG1 THR A 120 29.120 -2.163 -2.644 1.00 0.00 O ATOM 1746 CG2 THR A 120 28.247 -2.825 -0.509 1.00 0.00 C ATOM 0 H THR A 120 29.043 -0.078 -3.095 1.00 0.00 H new ATOM 0 HA THR A 120 26.917 -0.782 -1.456 1.00 0.00 H new ATOM 0 HB THR A 120 29.787 -1.392 -0.852 1.00 0.00 H new ATOM 0 HG1 THR A 120 28.679 -3.028 -2.779 1.00 0.00 H new ATOM 0 HG21 THR A 120 28.921 -3.681 -0.511 1.00 0.00 H new ATOM 0 HG22 THR A 120 28.093 -2.487 0.516 1.00 0.00 H new ATOM 0 HG23 THR A 120 27.290 -3.115 -0.943 1.00 0.00 H new ATOM 1754 N LEU A 121 26.960 0.323 0.713 1.00 0.00 N ATOM 1755 CA LEU A 121 26.741 1.093 1.930 1.00 0.00 C ATOM 1756 C LEU A 121 27.250 0.253 3.100 1.00 0.00 C ATOM 1757 O LEU A 121 27.104 -0.971 3.083 1.00 0.00 O ATOM 1758 CB LEU A 121 25.221 1.344 2.047 1.00 0.00 C ATOM 1759 CG LEU A 121 24.796 2.717 2.581 1.00 0.00 C ATOM 1760 CD1 LEU A 121 23.272 2.853 2.603 1.00 0.00 C ATOM 1761 CD2 LEU A 121 25.343 3.052 3.970 1.00 0.00 C ATOM 0 H LEU A 121 26.176 -0.294 0.504 1.00 0.00 H new ATOM 0 HA LEU A 121 27.263 2.050 1.924 1.00 0.00 H new ATOM 0 HB2 LEU A 121 24.775 1.208 1.062 1.00 0.00 H new ATOM 0 HB3 LEU A 121 24.797 0.578 2.697 1.00 0.00 H new ATOM 0 HG LEU A 121 25.235 3.431 1.884 1.00 0.00 H new ATOM 0 HD11 LEU A 121 23.000 3.836 2.986 1.00 0.00 H new ATOM 0 HD12 LEU A 121 22.882 2.737 1.592 1.00 0.00 H new ATOM 0 HD13 LEU A 121 22.847 2.083 3.247 1.00 0.00 H new ATOM 0 HD21 LEU A 121 24.994 4.040 4.270 1.00 0.00 H new ATOM 0 HD22 LEU A 121 24.993 2.310 4.688 1.00 0.00 H new ATOM 0 HD23 LEU A 121 26.433 3.045 3.943 1.00 0.00 H new ATOM 1773 N LYS A 122 27.797 0.881 4.139 1.00 0.00 N ATOM 1774 CA LYS A 122 28.226 0.201 5.362 1.00 0.00 C ATOM 1775 C LYS A 122 27.459 0.829 6.516 1.00 0.00 C ATOM 1776 O LYS A 122 27.186 2.030 6.505 1.00 0.00 O ATOM 1777 CB LYS A 122 29.741 0.338 5.603 1.00 0.00 C ATOM 1778 CG LYS A 122 30.655 -0.527 4.714 1.00 0.00 C ATOM 1779 CD LYS A 122 30.774 -0.131 3.233 1.00 0.00 C ATOM 1780 CE LYS A 122 31.101 1.360 3.057 1.00 0.00 C ATOM 1781 NZ LYS A 122 31.396 1.700 1.647 1.00 0.00 N ATOM 0 H LYS A 122 27.957 1.888 4.157 1.00 0.00 H new ATOM 0 HA LYS A 122 28.020 -0.866 5.274 1.00 0.00 H new ATOM 0 HB2 LYS A 122 30.017 1.383 5.462 1.00 0.00 H new ATOM 0 HB3 LYS A 122 29.945 0.092 6.645 1.00 0.00 H new ATOM 0 HG2 LYS A 122 31.655 -0.518 5.148 1.00 0.00 H new ATOM 0 HG3 LYS A 122 30.297 -1.555 4.761 1.00 0.00 H new ATOM 0 HD2 LYS A 122 31.552 -0.730 2.759 1.00 0.00 H new ATOM 0 HD3 LYS A 122 29.839 -0.359 2.721 1.00 0.00 H new ATOM 0 HE2 LYS A 122 30.260 1.959 3.406 1.00 0.00 H new ATOM 0 HE3 LYS A 122 31.957 1.619 3.679 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 31.611 2.715 1.572 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 32.214 1.147 1.321 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 30.570 1.477 1.056 1.00 0.00 H new ATOM 1795 N ILE A 123 27.132 0.017 7.512 1.00 0.00 N ATOM 1796 CA ILE A 123 26.323 0.382 8.661 1.00 0.00 C ATOM 1797 C ILE A 123 27.024 -0.146 9.912 1.00 0.00 C ATOM 1798 O ILE A 123 27.844 -1.068 9.830 1.00 0.00 O ATOM 1799 CB ILE A 123 24.880 -0.151 8.469 1.00 0.00 C ATOM 1800 CG1 ILE A 123 24.750 -1.570 7.854 1.00 0.00 C ATOM 1801 CG2 ILE A 123 24.106 0.819 7.558 1.00 0.00 C ATOM 1802 CD1 ILE A 123 25.318 -2.721 8.691 1.00 0.00 C ATOM 0 H ILE A 123 27.438 -0.956 7.540 1.00 0.00 H new ATOM 0 HA ILE A 123 26.225 1.462 8.772 1.00 0.00 H new ATOM 0 HB ILE A 123 24.477 -0.221 9.480 1.00 0.00 H new ATOM 0 HG12 ILE A 123 23.694 -1.769 7.669 1.00 0.00 H new ATOM 0 HG13 ILE A 123 25.249 -1.571 6.885 1.00 0.00 H new ATOM 0 HG21 ILE A 123 23.089 0.453 7.417 1.00 0.00 H new ATOM 0 HG22 ILE A 123 24.075 1.806 8.020 1.00 0.00 H new ATOM 0 HG23 ILE A 123 24.605 0.886 6.591 1.00 0.00 H new ATOM 0 HD11 ILE A 123 25.171 -3.663 8.162 1.00 0.00 H new ATOM 0 HD12 ILE A 123 26.383 -2.560 8.856 1.00 0.00 H new ATOM 0 HD13 ILE A 123 24.804 -2.760 9.652 1.00 0.00 H new ATOM 2006 N GLU A 137 25.795 8.766 5.340 1.00 0.00 N ATOM 2007 CA GLU A 137 25.810 9.824 4.326 1.00 0.00 C ATOM 2008 C GLU A 137 25.510 9.287 2.917 1.00 0.00 C ATOM 2009 O GLU A 137 24.933 10.010 2.104 1.00 0.00 O ATOM 2010 CB GLU A 137 27.170 10.540 4.338 1.00 0.00 C ATOM 2011 CG GLU A 137 27.437 11.278 5.658 1.00 0.00 C ATOM 2012 CD GLU A 137 28.767 12.052 5.613 1.00 0.00 C ATOM 2013 OE1 GLU A 137 28.774 13.241 5.219 1.00 0.00 O ATOM 2014 OE2 GLU A 137 29.820 11.490 5.992 1.00 0.00 O ATOM 0 HA GLU A 137 25.018 10.529 4.579 1.00 0.00 H new ATOM 0 HB2 GLU A 137 27.962 9.811 4.167 1.00 0.00 H new ATOM 0 HB3 GLU A 137 27.209 11.252 3.514 1.00 0.00 H new ATOM 0 HG2 GLU A 137 26.619 11.969 5.861 1.00 0.00 H new ATOM 0 HG3 GLU A 137 27.460 10.561 6.479 1.00 0.00 H new ATOM 2021 N TRP A 138 25.843 8.021 2.635 1.00 0.00 N ATOM 2022 CA TRP A 138 25.493 7.357 1.387 1.00 0.00 C ATOM 2023 C TRP A 138 23.985 7.400 1.153 1.00 0.00 C ATOM 2024 O TRP A 138 23.572 7.619 0.022 1.00 0.00 O ATOM 2025 CB TRP A 138 25.892 5.882 1.419 1.00 0.00 C ATOM 2026 CG TRP A 138 27.266 5.444 1.013 1.00 0.00 C ATOM 2027 CD1 TRP A 138 27.484 4.326 0.286 1.00 0.00 C ATOM 2028 CD2 TRP A 138 28.596 6.003 1.277 1.00 0.00 C ATOM 2029 NE1 TRP A 138 28.828 4.140 0.091 1.00 0.00 N ATOM 2030 CE2 TRP A 138 29.568 5.155 0.657 1.00 0.00 C ATOM 2031 CE3 TRP A 138 29.094 7.135 1.962 1.00 0.00 C ATOM 2032 CZ2 TRP A 138 30.945 5.426 0.698 1.00 0.00 C ATOM 2033 CZ3 TRP A 138 30.474 7.411 2.020 1.00 0.00 C ATOM 2034 CH2 TRP A 138 31.398 6.562 1.387 1.00 0.00 C ATOM 0 H TRP A 138 26.368 7.429 3.278 1.00 0.00 H new ATOM 0 HA TRP A 138 26.025 7.883 0.594 1.00 0.00 H new ATOM 0 HB2 TRP A 138 25.734 5.531 2.439 1.00 0.00 H new ATOM 0 HB3 TRP A 138 25.186 5.347 0.784 1.00 0.00 H new ATOM 0 HD1 TRP A 138 26.710 3.672 -0.088 1.00 0.00 H new ATOM 0 HE1 TRP A 138 29.230 3.348 -0.411 1.00 0.00 H new ATOM 0 HE3 TRP A 138 28.401 7.803 2.452 1.00 0.00 H new ATOM 0 HZ2 TRP A 138 31.647 4.769 0.206 1.00 0.00 H new ATOM 0 HZ3 TRP A 138 30.825 8.281 2.555 1.00 0.00 H new ATOM 0 HH2 TRP A 138 32.454 6.783 1.431 1.00 0.00 H new ATOM 2045 N LEU A 139 23.172 7.177 2.191 1.00 0.00 N ATOM 2046 CA LEU A 139 21.714 7.161 2.094 1.00 0.00 C ATOM 2047 C LEU A 139 21.244 8.530 1.636 1.00 0.00 C ATOM 2048 O LEU A 139 20.493 8.632 0.674 1.00 0.00 O ATOM 2049 CB LEU A 139 21.126 6.851 3.483 1.00 0.00 C ATOM 2050 CG LEU A 139 19.767 6.131 3.449 1.00 0.00 C ATOM 2051 CD1 LEU A 139 19.888 4.690 2.936 1.00 0.00 C ATOM 2052 CD2 LEU A 139 19.177 6.107 4.864 1.00 0.00 C ATOM 0 H LEU A 139 23.516 7.000 3.135 1.00 0.00 H new ATOM 0 HA LEU A 139 21.387 6.402 1.383 1.00 0.00 H new ATOM 0 HB2 LEU A 139 21.836 6.236 4.036 1.00 0.00 H new ATOM 0 HB3 LEU A 139 21.016 7.785 4.034 1.00 0.00 H new ATOM 0 HG LEU A 139 19.119 6.677 2.764 1.00 0.00 H new ATOM 0 HD11 LEU A 139 18.904 4.222 2.930 1.00 0.00 H new ATOM 0 HD12 LEU A 139 20.293 4.697 1.924 1.00 0.00 H new ATOM 0 HD13 LEU A 139 20.554 4.126 3.589 1.00 0.00 H new ATOM 0 HD21 LEU A 139 18.213 5.598 4.848 1.00 0.00 H new ATOM 0 HD22 LEU A 139 19.856 5.577 5.532 1.00 0.00 H new ATOM 0 HD23 LEU A 139 19.042 7.129 5.219 1.00 0.00 H new ATOM 2064 N GLY A 140 21.732 9.568 2.313 1.00 0.00 N ATOM 2065 CA GLY A 140 21.421 10.960 2.007 1.00 0.00 C ATOM 2066 C GLY A 140 21.759 11.313 0.556 1.00 0.00 C ATOM 2067 O GLY A 140 20.917 11.854 -0.167 1.00 0.00 O ATOM 0 H GLY A 140 22.367 9.461 3.104 1.00 0.00 H new ATOM 0 HA2 GLY A 140 20.362 11.144 2.189 1.00 0.00 H new ATOM 0 HA3 GLY A 140 21.978 11.613 2.679 1.00 0.00 H new ATOM 2071 N SER A 141 22.963 10.962 0.101 1.00 0.00 N ATOM 2072 CA SER A 141 23.408 11.135 -1.253 1.00 0.00 C ATOM 2073 C SER A 141 22.508 10.365 -2.220 1.00 0.00 C ATOM 2074 O SER A 141 21.899 10.973 -3.094 1.00 0.00 O ATOM 2075 CB SER A 141 24.846 10.625 -1.256 1.00 0.00 C ATOM 2076 OG SER A 141 25.724 11.596 -0.711 1.00 0.00 O ATOM 0 H SER A 141 23.670 10.535 0.700 1.00 0.00 H new ATOM 0 HA SER A 141 23.360 12.172 -1.587 1.00 0.00 H new ATOM 0 HB2 SER A 141 24.911 9.703 -0.678 1.00 0.00 H new ATOM 0 HB3 SER A 141 25.149 10.384 -2.275 1.00 0.00 H new ATOM 0 HG SER A 141 26.641 11.250 -0.720 1.00 0.00 H new ATOM 2082 N TRP A 142 22.368 9.056 -2.033 1.00 0.00 N ATOM 2083 CA TRP A 142 21.576 8.163 -2.866 1.00 0.00 C ATOM 2084 C TRP A 142 20.136 8.667 -3.028 1.00 0.00 C ATOM 2085 O TRP A 142 19.630 8.729 -4.148 1.00 0.00 O ATOM 2086 CB TRP A 142 21.653 6.770 -2.236 1.00 0.00 C ATOM 2087 CG TRP A 142 20.868 5.696 -2.903 1.00 0.00 C ATOM 2088 CD1 TRP A 142 21.206 5.074 -4.050 1.00 0.00 C ATOM 2089 CD2 TRP A 142 19.624 5.083 -2.461 1.00 0.00 C ATOM 2090 NE1 TRP A 142 20.222 4.167 -4.393 1.00 0.00 N ATOM 2091 CE2 TRP A 142 19.235 4.111 -3.433 1.00 0.00 C ATOM 2092 CE3 TRP A 142 18.798 5.245 -1.326 1.00 0.00 C ATOM 2093 CZ2 TRP A 142 18.072 3.342 -3.298 1.00 0.00 C ATOM 2094 CZ3 TRP A 142 17.623 4.477 -1.190 1.00 0.00 C ATOM 2095 CH2 TRP A 142 17.261 3.534 -2.169 1.00 0.00 C ATOM 0 H TRP A 142 22.825 8.569 -1.262 1.00 0.00 H new ATOM 0 HA TRP A 142 21.973 8.126 -3.880 1.00 0.00 H new ATOM 0 HB2 TRP A 142 22.699 6.464 -2.212 1.00 0.00 H new ATOM 0 HB3 TRP A 142 21.319 6.844 -1.201 1.00 0.00 H new ATOM 0 HD1 TRP A 142 22.108 5.257 -4.615 1.00 0.00 H new ATOM 0 HE1 TRP A 142 20.226 3.610 -5.248 1.00 0.00 H new ATOM 0 HE3 TRP A 142 19.067 5.958 -0.561 1.00 0.00 H new ATOM 0 HZ2 TRP A 142 17.804 2.614 -4.050 1.00 0.00 H new ATOM 0 HZ3 TRP A 142 16.993 4.615 -0.323 1.00 0.00 H new ATOM 0 HH2 TRP A 142 16.356 2.956 -2.051 1.00 0.00 H new ATOM 2106 N VAL A 143 19.509 9.106 -1.934 1.00 0.00 N ATOM 2107 CA VAL A 143 18.200 9.745 -1.919 1.00 0.00 C ATOM 2108 C VAL A 143 18.204 10.972 -2.833 1.00 0.00 C ATOM 2109 O VAL A 143 17.408 11.033 -3.768 1.00 0.00 O ATOM 2110 CB VAL A 143 17.825 10.068 -0.454 1.00 0.00 C ATOM 2111 CG1 VAL A 143 16.776 11.175 -0.308 1.00 0.00 C ATOM 2112 CG2 VAL A 143 17.307 8.804 0.247 1.00 0.00 C ATOM 0 H VAL A 143 19.917 9.021 -1.003 1.00 0.00 H new ATOM 0 HA VAL A 143 17.433 9.079 -2.314 1.00 0.00 H new ATOM 0 HB VAL A 143 18.741 10.432 0.011 1.00 0.00 H new ATOM 0 HG11 VAL A 143 16.568 11.342 0.749 1.00 0.00 H new ATOM 0 HG12 VAL A 143 17.154 12.095 -0.753 1.00 0.00 H new ATOM 0 HG13 VAL A 143 15.859 10.876 -0.816 1.00 0.00 H new ATOM 0 HG21 VAL A 143 17.045 9.041 1.278 1.00 0.00 H new ATOM 0 HG22 VAL A 143 16.425 8.434 -0.275 1.00 0.00 H new ATOM 0 HG23 VAL A 143 18.083 8.038 0.236 1.00 0.00 H new ATOM 2122 N ASN A 144 19.081 11.955 -2.605 1.00 0.00 N ATOM 2123 CA ASN A 144 19.049 13.180 -3.404 1.00 0.00 C ATOM 2124 C ASN A 144 19.471 12.933 -4.863 1.00 0.00 C ATOM 2125 O ASN A 144 19.186 13.767 -5.723 1.00 0.00 O ATOM 2126 CB ASN A 144 19.807 14.338 -2.725 1.00 0.00 C ATOM 2127 CG ASN A 144 21.142 14.680 -3.375 1.00 0.00 C ATOM 2128 OD1 ASN A 144 21.345 15.782 -3.877 1.00 0.00 O ATOM 2129 ND2 ASN A 144 22.079 13.753 -3.369 1.00 0.00 N ATOM 0 H ASN A 144 19.807 11.927 -1.889 1.00 0.00 H new ATOM 0 HA ASN A 144 18.010 13.505 -3.455 1.00 0.00 H new ATOM 0 HB2 ASN A 144 19.174 15.225 -2.734 1.00 0.00 H new ATOM 0 HB3 ASN A 144 19.980 14.080 -1.680 1.00 0.00 H new ATOM 0 HD21 ASN A 144 22.990 13.946 -3.786 1.00 0.00 H new ATOM 0 HD22 ASN A 144 21.893 12.843 -2.948 1.00 0.00 H new ATOM 2136 N LEU A 145 20.122 11.797 -5.152 1.00 0.00 N ATOM 2137 CA LEU A 145 20.449 11.364 -6.505 1.00 0.00 C ATOM 2138 C LEU A 145 19.205 10.814 -7.205 1.00 0.00 C ATOM 2139 O LEU A 145 18.928 11.209 -8.339 1.00 0.00 O ATOM 2140 CB LEU A 145 21.563 10.293 -6.490 1.00 0.00 C ATOM 2141 CG LEU A 145 22.943 10.828 -6.912 1.00 0.00 C ATOM 2142 CD1 LEU A 145 23.462 11.933 -5.985 1.00 0.00 C ATOM 2143 CD2 LEU A 145 23.954 9.675 -6.930 1.00 0.00 C ATOM 0 H LEU A 145 20.439 11.146 -4.434 1.00 0.00 H new ATOM 0 HA LEU A 145 20.813 12.231 -7.056 1.00 0.00 H new ATOM 0 HB2 LEU A 145 21.637 9.873 -5.487 1.00 0.00 H new ATOM 0 HB3 LEU A 145 21.280 9.478 -7.156 1.00 0.00 H new ATOM 0 HG LEU A 145 22.827 11.262 -7.905 1.00 0.00 H new ATOM 0 HD11 LEU A 145 24.438 12.271 -6.333 1.00 0.00 H new ATOM 0 HD12 LEU A 145 22.765 12.771 -5.992 1.00 0.00 H new ATOM 0 HD13 LEU A 145 23.552 11.544 -4.971 1.00 0.00 H new ATOM 0 HD21 LEU A 145 24.932 10.053 -7.229 1.00 0.00 H new ATOM 0 HD22 LEU A 145 24.023 9.236 -5.935 1.00 0.00 H new ATOM 0 HD23 LEU A 145 23.627 8.915 -7.639 1.00 0.00 H new ATOM 2155 N LEU A 146 18.469 9.892 -6.568 1.00 0.00 N ATOM 2156 CA LEU A 146 17.317 9.239 -7.173 1.00 0.00 C ATOM 2157 C LEU A 146 16.085 10.146 -7.233 1.00 0.00 C ATOM 2158 O LEU A 146 15.244 9.969 -8.116 1.00 0.00 O ATOM 2159 CB LEU A 146 17.038 7.909 -6.460 1.00 0.00 C ATOM 2160 CG LEU A 146 16.482 7.932 -5.019 1.00 0.00 C ATOM 2161 CD1 LEU A 146 14.952 8.049 -4.947 1.00 0.00 C ATOM 2162 CD2 LEU A 146 16.888 6.648 -4.287 1.00 0.00 C ATOM 0 H LEU A 146 18.663 9.583 -5.616 1.00 0.00 H new ATOM 0 HA LEU A 146 17.559 9.023 -8.214 1.00 0.00 H new ATOM 0 HB2 LEU A 146 16.334 7.348 -7.075 1.00 0.00 H new ATOM 0 HB3 LEU A 146 17.969 7.343 -6.444 1.00 0.00 H new ATOM 0 HG LEU A 146 16.907 8.820 -4.552 1.00 0.00 H new ATOM 0 HD11 LEU A 146 14.637 8.059 -3.904 1.00 0.00 H new ATOM 0 HD12 LEU A 146 14.635 8.973 -5.431 1.00 0.00 H new ATOM 0 HD13 LEU A 146 14.498 7.198 -5.455 1.00 0.00 H new ATOM 0 HD21 LEU A 146 16.494 6.668 -3.271 1.00 0.00 H new ATOM 0 HD22 LEU A 146 16.484 5.785 -4.816 1.00 0.00 H new ATOM 0 HD23 LEU A 146 17.975 6.577 -4.253 1.00 0.00 H new ATOM 2174 N LYS A 147 15.983 11.107 -6.312 1.00 0.00 N ATOM 2175 CA LYS A 147 14.982 12.167 -6.332 1.00 0.00 C ATOM 2176 C LYS A 147 15.028 12.891 -7.676 1.00 0.00 C ATOM 2177 O LYS A 147 13.957 13.060 -8.295 1.00 0.00 O ATOM 2178 CB LYS A 147 15.213 13.137 -5.161 1.00 0.00 C ATOM 2179 CG LYS A 147 14.519 12.673 -3.871 1.00 0.00 C ATOM 2180 CD LYS A 147 14.706 13.697 -2.740 1.00 0.00 C ATOM 2181 CE LYS A 147 14.072 13.241 -1.415 1.00 0.00 C ATOM 2182 NZ LYS A 147 12.587 13.250 -1.425 1.00 0.00 N ATOM 2183 OXT LYS A 147 16.120 13.319 -8.104 1.00 0.00 O ATOM 0 H LYS A 147 16.613 11.168 -5.512 1.00 0.00 H new ATOM 0 HA LYS A 147 13.989 11.734 -6.212 1.00 0.00 H new ATOM 0 HB2 LYS A 147 16.283 13.235 -4.980 1.00 0.00 H new ATOM 0 HB3 LYS A 147 14.844 14.126 -5.434 1.00 0.00 H new ATOM 0 HG2 LYS A 147 13.456 12.526 -4.060 1.00 0.00 H new ATOM 0 HG3 LYS A 147 14.924 11.709 -3.563 1.00 0.00 H new ATOM 0 HD2 LYS A 147 15.771 13.873 -2.587 1.00 0.00 H new ATOM 0 HD3 LYS A 147 14.266 14.648 -3.040 1.00 0.00 H new ATOM 0 HE2 LYS A 147 14.418 12.233 -1.186 1.00 0.00 H new ATOM 0 HE3 LYS A 147 14.424 13.889 -0.613 1.00 0.00 H new ATOM 0 HZ1 LYS A 147 12.231 12.791 -0.562 1.00 0.00 H new ATOM 0 HZ2 LYS A 147 12.246 14.232 -1.460 1.00 0.00 H new ATOM 0 HZ3 LYS A 147 12.242 12.734 -2.259 1.00 0.00 H new