USER MOD reduce.3.24.130724 H: found=0, std=0, add=700, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 703 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 8 MET CE :methyl 159:sc= -0.534 (180deg=-1.37) USER MOD Set 1.2: A 120 ASN : amide:sc= -2.43! K(o=-3!,f=-0.81) USER MOD Set 2.1: A 112 GLN : amide:sc= 0.0773 K(o=1.3,f=-10!) USER MOD Set 2.2: A 116 LYS NZ :NH3+ -164:sc= 1.21 (180deg=0) USER MOD Set 3.1: A 68 THR OG1 : rot 180:sc= -0.319 USER MOD Set 3.2: A 69 SER OG : rot 180:sc= 0 USER MOD Set 3.3: A 106 ASN : amide:sc= -1.12 K(o=-1.4,f=-11!) USER MOD Single : A 2 SER OG : rot -89:sc= 1.23 USER MOD Single : A 6 LYS NZ :NH3+ 173:sc=-0.00545 (180deg=-0.0736) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 46 SER OG : rot 173:sc= -0.142 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ -172:sc= 0.907 (180deg=0.67) USER MOD Single : A 63 LYS NZ :NH3+ -161:sc= 2.06 (180deg=1.71) USER MOD Single : A 74 MET CE :methyl 134:sc= -1.77 (180deg=-5.93!) USER MOD Single : A 75 LYS NZ :NH3+ 159:sc= 1.29 (180deg=1.15) USER MOD Single : A 81 SER OG : rot 23:sc= 0.589 USER MOD Single : A 82 SER OG : rot 180:sc= 0.445 USER MOD Single : A 84 SER OG : rot 180:sc= 0.0429 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 105 MET CE :methyl 135:sc= -0.152 (180deg=-0.717) USER MOD Single : A 110 HIS : no HD1:sc= 0.712 K(o=0.71,f=-3!) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 MET CE :methyl 158:sc= -0.76 (180deg=-2.14!) USER MOD Single : A 115 SER OG : rot 72:sc= 0.323 USER MOD Single : A 123 LYS NZ :NH3+ -172:sc= 1.26 (180deg=1.23) USER MOD ----------------------------------------------------------------- ATOM 20 N SER A 2 -21.519 -5.132 1.223 1.00 0.00 N ATOM 21 CA SER A 2 -20.722 -5.775 0.192 1.00 0.00 C ATOM 22 C SER A 2 -19.261 -5.796 0.626 1.00 0.00 C ATOM 23 O SER A 2 -18.514 -4.846 0.397 1.00 0.00 O ATOM 24 CB SER A 2 -20.883 -5.044 -1.146 1.00 0.00 C ATOM 25 OG SER A 2 -22.255 -4.854 -1.468 1.00 0.00 O ATOM 0 HA SER A 2 -21.067 -6.800 0.054 1.00 0.00 H new ATOM 0 HB2 SER A 2 -20.381 -4.078 -1.098 1.00 0.00 H new ATOM 0 HB3 SER A 2 -20.397 -5.616 -1.936 1.00 0.00 H new ATOM 0 HG SER A 2 -22.582 -5.627 -1.975 1.00 0.00 H new ATOM 31 N ILE A 3 -18.866 -6.888 1.264 1.00 0.00 N ATOM 32 CA ILE A 3 -17.571 -6.981 1.930 1.00 0.00 C ATOM 33 C ILE A 3 -16.392 -6.757 0.980 1.00 0.00 C ATOM 34 O ILE A 3 -15.409 -6.115 1.352 1.00 0.00 O ATOM 35 CB ILE A 3 -17.427 -8.334 2.644 1.00 0.00 C ATOM 36 CG1 ILE A 3 -18.604 -8.524 3.607 1.00 0.00 C ATOM 37 CG2 ILE A 3 -16.098 -8.412 3.379 1.00 0.00 C ATOM 38 CD1 ILE A 3 -18.448 -9.691 4.554 1.00 0.00 C ATOM 0 H ILE A 3 -19.431 -7.734 1.336 1.00 0.00 H new ATOM 0 HA ILE A 3 -17.543 -6.176 2.665 1.00 0.00 H new ATOM 0 HB ILE A 3 -17.441 -9.137 1.907 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -18.732 -7.612 4.190 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -19.516 -8.662 3.026 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -16.014 -9.377 3.878 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -15.281 -8.300 2.666 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -16.045 -7.614 4.120 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -19.323 -9.755 5.200 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -18.352 -10.614 3.982 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -17.556 -9.548 5.164 1.00 0.00 H new ATOM 50 N PHE A 4 -16.492 -7.254 -0.247 1.00 0.00 N ATOM 51 CA PHE A 4 -15.410 -7.073 -1.217 1.00 0.00 C ATOM 52 C PHE A 4 -15.206 -5.592 -1.542 1.00 0.00 C ATOM 53 O PHE A 4 -14.102 -5.169 -1.879 1.00 0.00 O ATOM 54 CB PHE A 4 -15.650 -7.891 -2.497 1.00 0.00 C ATOM 55 CG PHE A 4 -16.997 -7.691 -3.137 1.00 0.00 C ATOM 56 CD1 PHE A 4 -17.265 -6.563 -3.896 1.00 0.00 C ATOM 57 CD2 PHE A 4 -17.992 -8.642 -2.985 1.00 0.00 C ATOM 58 CE1 PHE A 4 -18.500 -6.387 -4.490 1.00 0.00 C ATOM 59 CE2 PHE A 4 -19.228 -8.471 -3.576 1.00 0.00 C ATOM 60 CZ PHE A 4 -19.483 -7.342 -4.327 1.00 0.00 C ATOM 0 H PHE A 4 -17.296 -7.778 -0.594 1.00 0.00 H new ATOM 0 HA PHE A 4 -14.495 -7.448 -0.758 1.00 0.00 H new ATOM 0 HB2 PHE A 4 -14.878 -7.636 -3.223 1.00 0.00 H new ATOM 0 HB3 PHE A 4 -15.530 -8.949 -2.262 1.00 0.00 H new ATOM 0 HD1 PHE A 4 -16.499 -5.812 -4.025 1.00 0.00 H new ATOM 0 HD2 PHE A 4 -17.799 -9.527 -2.398 1.00 0.00 H new ATOM 0 HE1 PHE A 4 -18.696 -5.504 -5.081 1.00 0.00 H new ATOM 0 HE2 PHE A 4 -19.995 -9.221 -3.450 1.00 0.00 H new ATOM 0 HZ PHE A 4 -20.451 -7.206 -4.787 1.00 0.00 H new ATOM 70 N GLY A 5 -16.266 -4.804 -1.398 1.00 0.00 N ATOM 71 CA GLY A 5 -16.166 -3.377 -1.636 1.00 0.00 C ATOM 72 C GLY A 5 -15.765 -2.627 -0.382 1.00 0.00 C ATOM 73 O GLY A 5 -15.417 -1.448 -0.432 1.00 0.00 O ATOM 0 H GLY A 5 -17.192 -5.128 -1.121 1.00 0.00 H new ATOM 0 HA2 GLY A 5 -15.434 -3.189 -2.422 1.00 0.00 H new ATOM 0 HA3 GLY A 5 -17.124 -3.000 -1.995 1.00 0.00 H new ATOM 77 N LYS A 6 -15.811 -3.321 0.744 1.00 0.00 N ATOM 78 CA LYS A 6 -15.434 -2.741 2.023 1.00 0.00 C ATOM 79 C LYS A 6 -13.938 -2.906 2.263 1.00 0.00 C ATOM 80 O LYS A 6 -13.256 -1.963 2.659 1.00 0.00 O ATOM 81 CB LYS A 6 -16.219 -3.410 3.152 1.00 0.00 C ATOM 82 CG LYS A 6 -17.718 -3.155 3.092 1.00 0.00 C ATOM 83 CD LYS A 6 -18.490 -4.079 4.026 1.00 0.00 C ATOM 84 CE LYS A 6 -18.070 -3.908 5.482 1.00 0.00 C ATOM 85 NZ LYS A 6 -18.303 -2.530 5.992 1.00 0.00 N ATOM 0 H LYS A 6 -16.108 -4.295 0.798 1.00 0.00 H new ATOM 0 HA LYS A 6 -15.669 -1.677 2.005 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -16.041 -4.485 3.118 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -15.837 -3.053 4.109 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -17.921 -2.118 3.359 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -18.070 -3.296 2.070 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -19.557 -3.879 3.932 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -18.332 -5.114 3.723 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -18.621 -4.617 6.100 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -17.013 -4.153 5.581 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -18.112 -2.501 7.014 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -17.669 -1.867 5.502 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -19.291 -2.257 5.817 1.00 0.00 H new ATOM 99 N ILE A 7 -13.429 -4.107 2.005 1.00 0.00 N ATOM 100 CA ILE A 7 -12.022 -4.409 2.254 1.00 0.00 C ATOM 101 C ILE A 7 -11.109 -3.614 1.321 1.00 0.00 C ATOM 102 O ILE A 7 -10.001 -3.233 1.700 1.00 0.00 O ATOM 103 CB ILE A 7 -11.720 -5.920 2.105 1.00 0.00 C ATOM 104 CG1 ILE A 7 -12.122 -6.419 0.713 1.00 0.00 C ATOM 105 CG2 ILE A 7 -12.445 -6.709 3.183 1.00 0.00 C ATOM 106 CD1 ILE A 7 -11.792 -7.872 0.454 1.00 0.00 C ATOM 0 H ILE A 7 -13.967 -4.885 1.625 1.00 0.00 H new ATOM 0 HA ILE A 7 -11.821 -4.116 3.285 1.00 0.00 H new ATOM 0 HB ILE A 7 -10.647 -6.071 2.223 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -13.194 -6.273 0.583 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -11.624 -5.806 -0.038 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -12.225 -7.770 3.067 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -12.112 -6.374 4.165 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -13.519 -6.549 3.090 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -12.109 -8.143 -0.553 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -10.717 -8.023 0.549 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -12.312 -8.498 1.179 1.00 0.00 H new ATOM 118 N MET A 8 -11.589 -3.336 0.114 1.00 0.00 N ATOM 119 CA MET A 8 -10.787 -2.628 -0.879 1.00 0.00 C ATOM 120 C MET A 8 -10.627 -1.156 -0.512 1.00 0.00 C ATOM 121 O MET A 8 -9.743 -0.476 -1.030 1.00 0.00 O ATOM 122 CB MET A 8 -11.394 -2.781 -2.287 1.00 0.00 C ATOM 123 CG MET A 8 -12.795 -2.199 -2.458 1.00 0.00 C ATOM 124 SD MET A 8 -12.812 -0.398 -2.602 1.00 0.00 S ATOM 125 CE MET A 8 -11.808 -0.161 -4.067 1.00 0.00 C ATOM 0 H MET A 8 -12.526 -3.589 -0.200 1.00 0.00 H new ATOM 0 HA MET A 8 -9.794 -3.079 -0.887 1.00 0.00 H new ATOM 0 HB2 MET A 8 -10.729 -2.302 -3.006 1.00 0.00 H new ATOM 0 HB3 MET A 8 -11.425 -3.841 -2.538 1.00 0.00 H new ATOM 0 HG2 MET A 8 -13.254 -2.631 -3.347 1.00 0.00 H new ATOM 0 HG3 MET A 8 -13.409 -2.494 -1.607 1.00 0.00 H new ATOM 0 HE1 MET A 8 -12.020 0.817 -4.499 1.00 0.00 H new ATOM 0 HE2 MET A 8 -10.753 -0.218 -3.798 1.00 0.00 H new ATOM 0 HE3 MET A 8 -12.039 -0.938 -4.796 1.00 0.00 H new ATOM 135 N SER A 9 -11.464 -0.679 0.403 1.00 0.00 N ATOM 136 CA SER A 9 -11.448 0.720 0.808 1.00 0.00 C ATOM 137 C SER A 9 -10.143 1.050 1.529 1.00 0.00 C ATOM 138 O SER A 9 -9.651 2.175 1.462 1.00 0.00 O ATOM 139 CB SER A 9 -12.653 1.022 1.707 1.00 0.00 C ATOM 140 OG SER A 9 -12.809 2.415 1.913 1.00 0.00 O ATOM 0 H SER A 9 -12.166 -1.245 0.880 1.00 0.00 H new ATOM 0 HA SER A 9 -11.514 1.345 -0.083 1.00 0.00 H new ATOM 0 HB2 SER A 9 -13.558 0.616 1.254 1.00 0.00 H new ATOM 0 HB3 SER A 9 -12.526 0.523 2.668 1.00 0.00 H new ATOM 0 HG SER A 9 -13.586 2.576 2.488 1.00 0.00 H new ATOM 146 N ALA A 10 -9.576 0.060 2.203 1.00 0.00 N ATOM 147 CA ALA A 10 -8.312 0.244 2.894 1.00 0.00 C ATOM 148 C ALA A 10 -7.147 -0.024 1.950 1.00 0.00 C ATOM 149 O ALA A 10 -6.180 0.735 1.904 1.00 0.00 O ATOM 150 CB ALA A 10 -8.237 -0.673 4.102 1.00 0.00 C ATOM 0 H ALA A 10 -9.972 -0.877 2.285 1.00 0.00 H new ATOM 0 HA ALA A 10 -8.248 1.277 3.236 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -7.285 -0.526 4.612 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -9.054 -0.442 4.785 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -8.318 -1.710 3.777 1.00 0.00 H new ATOM 156 N ILE A 11 -7.267 -1.105 1.187 1.00 0.00 N ATOM 157 CA ILE A 11 -6.218 -1.531 0.265 1.00 0.00 C ATOM 158 C ILE A 11 -5.949 -0.460 -0.787 1.00 0.00 C ATOM 159 O ILE A 11 -4.809 -0.063 -1.012 1.00 0.00 O ATOM 160 CB ILE A 11 -6.608 -2.847 -0.440 1.00 0.00 C ATOM 161 CG1 ILE A 11 -6.952 -3.916 0.599 1.00 0.00 C ATOM 162 CG2 ILE A 11 -5.480 -3.324 -1.348 1.00 0.00 C ATOM 163 CD1 ILE A 11 -7.518 -5.187 0.007 1.00 0.00 C ATOM 0 H ILE A 11 -8.089 -1.709 1.189 1.00 0.00 H new ATOM 0 HA ILE A 11 -5.313 -1.692 0.851 1.00 0.00 H new ATOM 0 HB ILE A 11 -7.487 -2.665 -1.059 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -6.054 -4.160 1.166 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -7.673 -3.504 1.305 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -5.774 -4.253 -1.836 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -5.276 -2.566 -2.104 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -4.582 -3.495 -0.754 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -7.736 -5.895 0.806 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -8.435 -4.959 -0.536 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -6.791 -5.625 -0.677 1.00 0.00 H new ATOM 175 N PHE A 12 -7.013 0.019 -1.411 1.00 0.00 N ATOM 176 CA PHE A 12 -6.897 1.022 -2.457 1.00 0.00 C ATOM 177 C PHE A 12 -7.089 2.421 -1.883 1.00 0.00 C ATOM 178 O PHE A 12 -7.286 3.388 -2.621 1.00 0.00 O ATOM 179 CB PHE A 12 -7.927 0.762 -3.561 1.00 0.00 C ATOM 180 CG PHE A 12 -7.727 -0.544 -4.277 1.00 0.00 C ATOM 181 CD1 PHE A 12 -8.301 -1.710 -3.798 1.00 0.00 C ATOM 182 CD2 PHE A 12 -6.969 -0.603 -5.431 1.00 0.00 C ATOM 183 CE1 PHE A 12 -8.117 -2.910 -4.452 1.00 0.00 C ATOM 184 CE2 PHE A 12 -6.781 -1.802 -6.093 1.00 0.00 C ATOM 185 CZ PHE A 12 -7.359 -2.956 -5.603 1.00 0.00 C ATOM 0 H PHE A 12 -7.970 -0.272 -1.210 1.00 0.00 H new ATOM 0 HA PHE A 12 -5.897 0.956 -2.885 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -8.926 0.778 -3.125 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -7.882 1.575 -4.286 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -8.901 -1.679 -2.900 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -6.518 0.298 -5.820 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -8.566 -3.812 -4.063 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -6.183 -1.836 -6.992 1.00 0.00 H new ATOM 0 HZ PHE A 12 -7.218 -3.893 -6.120 1.00 0.00 H new ATOM 195 N GLY A 13 -7.020 2.524 -0.564 1.00 0.00 N ATOM 196 CA GLY A 13 -7.236 3.797 0.093 1.00 0.00 C ATOM 197 C GLY A 13 -5.963 4.370 0.678 1.00 0.00 C ATOM 198 O GLY A 13 -5.997 5.388 1.373 1.00 0.00 O ATOM 0 H GLY A 13 -6.818 1.747 0.065 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -7.654 4.505 -0.622 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -7.973 3.672 0.886 1.00 0.00 H new ATOM 572 N SER A 46 0.361 0.919 -9.506 1.00 0.00 N ATOM 573 CA SER A 46 -0.315 -0.313 -9.146 1.00 0.00 C ATOM 574 C SER A 46 -0.353 -0.455 -7.629 1.00 0.00 C ATOM 575 O SER A 46 0.579 -0.039 -6.938 1.00 0.00 O ATOM 576 CB SER A 46 0.387 -1.515 -9.781 1.00 0.00 C ATOM 577 OG SER A 46 -0.461 -2.648 -9.786 1.00 0.00 O ATOM 0 HA SER A 46 -1.337 -0.279 -9.523 1.00 0.00 H new ATOM 0 HB2 SER A 46 0.682 -1.272 -10.802 1.00 0.00 H new ATOM 0 HB3 SER A 46 1.300 -1.741 -9.230 1.00 0.00 H new ATOM 0 HG SER A 46 -0.038 -3.371 -10.295 1.00 0.00 H new ATOM 583 N ILE A 47 -1.434 -1.022 -7.120 1.00 0.00 N ATOM 584 CA ILE A 47 -1.614 -1.190 -5.686 1.00 0.00 C ATOM 585 C ILE A 47 -1.123 -2.561 -5.235 1.00 0.00 C ATOM 586 O ILE A 47 -1.781 -3.567 -5.471 1.00 0.00 O ATOM 587 CB ILE A 47 -3.100 -1.020 -5.297 1.00 0.00 C ATOM 588 CG1 ILE A 47 -3.550 0.429 -5.514 1.00 0.00 C ATOM 589 CG2 ILE A 47 -3.348 -1.459 -3.860 1.00 0.00 C ATOM 590 CD1 ILE A 47 -2.795 1.436 -4.672 1.00 0.00 C ATOM 0 H ILE A 47 -2.207 -1.377 -7.683 1.00 0.00 H new ATOM 0 HA ILE A 47 -1.025 -0.421 -5.186 1.00 0.00 H new ATOM 0 HB ILE A 47 -3.695 -1.664 -5.945 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -3.427 0.684 -6.567 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -4.614 0.507 -5.290 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -4.402 -1.327 -3.616 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -3.078 -2.509 -3.749 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -2.741 -0.855 -3.185 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -3.169 2.438 -4.881 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -2.939 1.208 -3.616 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -1.733 1.388 -4.912 1.00 0.00 H new ATOM 602 N ASP A 48 0.030 -2.601 -4.587 1.00 0.00 N ATOM 603 CA ASP A 48 0.604 -3.862 -4.139 1.00 0.00 C ATOM 604 C ASP A 48 -0.120 -4.328 -2.883 1.00 0.00 C ATOM 605 O ASP A 48 0.020 -3.729 -1.816 1.00 0.00 O ATOM 606 CB ASP A 48 2.099 -3.698 -3.862 1.00 0.00 C ATOM 607 CG ASP A 48 2.848 -5.021 -3.819 1.00 0.00 C ATOM 608 OD1 ASP A 48 2.300 -6.014 -3.301 1.00 0.00 O ATOM 609 OD2 ASP A 48 3.998 -5.073 -4.312 1.00 0.00 O ATOM 0 H ASP A 48 0.587 -1.777 -4.359 1.00 0.00 H new ATOM 0 HA ASP A 48 0.483 -4.610 -4.922 1.00 0.00 H new ATOM 0 HB2 ASP A 48 2.538 -3.064 -4.633 1.00 0.00 H new ATOM 0 HB3 ASP A 48 2.231 -3.182 -2.911 1.00 0.00 H new ATOM 614 N VAL A 49 -0.899 -5.386 -3.021 1.00 0.00 N ATOM 615 CA VAL A 49 -1.775 -5.839 -1.949 1.00 0.00 C ATOM 616 C VAL A 49 -1.001 -6.615 -0.881 1.00 0.00 C ATOM 617 O VAL A 49 -1.421 -6.686 0.281 1.00 0.00 O ATOM 618 CB VAL A 49 -2.915 -6.724 -2.511 1.00 0.00 C ATOM 619 CG1 VAL A 49 -3.908 -7.106 -1.423 1.00 0.00 C ATOM 620 CG2 VAL A 49 -3.628 -6.016 -3.654 1.00 0.00 C ATOM 0 H VAL A 49 -0.945 -5.952 -3.868 1.00 0.00 H new ATOM 0 HA VAL A 49 -2.204 -4.951 -1.485 1.00 0.00 H new ATOM 0 HB VAL A 49 -2.466 -7.641 -2.892 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -4.695 -7.727 -1.851 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -3.393 -7.662 -0.639 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -4.348 -6.203 -0.999 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -4.426 -6.653 -4.036 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -4.053 -5.080 -3.293 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -2.917 -5.807 -4.453 1.00 0.00 H new ATOM 630 N ALA A 50 0.142 -7.169 -1.268 1.00 0.00 N ATOM 631 CA ALA A 50 0.921 -8.033 -0.382 1.00 0.00 C ATOM 632 C ALA A 50 1.292 -7.343 0.944 1.00 0.00 C ATOM 633 O ALA A 50 0.944 -7.851 2.015 1.00 0.00 O ATOM 634 CB ALA A 50 2.166 -8.551 -1.091 1.00 0.00 C ATOM 0 H ALA A 50 0.553 -7.036 -2.192 1.00 0.00 H new ATOM 0 HA ALA A 50 0.284 -8.880 -0.127 1.00 0.00 H new ATOM 0 HB1 ALA A 50 2.731 -9.192 -0.413 1.00 0.00 H new ATOM 0 HB2 ALA A 50 1.872 -9.123 -1.971 1.00 0.00 H new ATOM 0 HB3 ALA A 50 2.787 -7.709 -1.397 1.00 0.00 H new ATOM 640 N PRO A 51 1.980 -6.178 0.918 1.00 0.00 N ATOM 641 CA PRO A 51 2.418 -5.508 2.146 1.00 0.00 C ATOM 642 C PRO A 51 1.270 -4.819 2.879 1.00 0.00 C ATOM 643 O PRO A 51 1.444 -4.311 3.985 1.00 0.00 O ATOM 644 CB PRO A 51 3.427 -4.475 1.645 1.00 0.00 C ATOM 645 CG PRO A 51 2.985 -4.159 0.262 1.00 0.00 C ATOM 646 CD PRO A 51 2.388 -5.424 -0.286 1.00 0.00 C ATOM 0 HA PRO A 51 2.829 -6.214 2.868 1.00 0.00 H new ATOM 0 HB2 PRO A 51 3.428 -3.585 2.274 1.00 0.00 H new ATOM 0 HB3 PRO A 51 4.441 -4.874 1.656 1.00 0.00 H new ATOM 0 HG2 PRO A 51 2.253 -3.351 0.262 1.00 0.00 H new ATOM 0 HG3 PRO A 51 3.825 -3.828 -0.349 1.00 0.00 H new ATOM 0 HD2 PRO A 51 1.537 -5.215 -0.934 1.00 0.00 H new ATOM 0 HD3 PRO A 51 3.112 -5.982 -0.880 1.00 0.00 H new ATOM 654 N ILE A 52 0.100 -4.798 2.262 1.00 0.00 N ATOM 655 CA ILE A 52 -1.058 -4.169 2.872 1.00 0.00 C ATOM 656 C ILE A 52 -1.852 -5.182 3.694 1.00 0.00 C ATOM 657 O ILE A 52 -2.414 -4.841 4.729 1.00 0.00 O ATOM 658 CB ILE A 52 -1.969 -3.502 1.816 1.00 0.00 C ATOM 659 CG1 ILE A 52 -1.196 -2.398 1.085 1.00 0.00 C ATOM 660 CG2 ILE A 52 -3.226 -2.938 2.470 1.00 0.00 C ATOM 661 CD1 ILE A 52 -2.019 -1.649 0.056 1.00 0.00 C ATOM 0 H ILE A 52 -0.072 -5.207 1.344 1.00 0.00 H new ATOM 0 HA ILE A 52 -0.691 -3.387 3.537 1.00 0.00 H new ATOM 0 HB ILE A 52 -2.277 -4.255 1.090 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -0.816 -1.687 1.819 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -0.330 -2.840 0.592 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -3.854 -2.473 1.710 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -3.778 -3.744 2.953 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -2.946 -2.193 3.215 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -1.402 -0.885 -0.417 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -2.377 -2.347 -0.701 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -2.870 -1.176 0.545 1.00 0.00 H new ATOM 673 N LEU A 53 -1.872 -6.434 3.260 1.00 0.00 N ATOM 674 CA LEU A 53 -2.637 -7.452 3.965 1.00 0.00 C ATOM 675 C LEU A 53 -1.756 -8.257 4.905 1.00 0.00 C ATOM 676 O LEU A 53 -2.082 -8.425 6.075 1.00 0.00 O ATOM 677 CB LEU A 53 -3.348 -8.388 2.986 1.00 0.00 C ATOM 678 CG LEU A 53 -4.807 -8.036 2.696 1.00 0.00 C ATOM 679 CD1 LEU A 53 -4.923 -6.635 2.126 1.00 0.00 C ATOM 680 CD2 LEU A 53 -5.423 -9.052 1.751 1.00 0.00 C ATOM 0 H LEU A 53 -1.374 -6.766 2.434 1.00 0.00 H new ATOM 0 HA LEU A 53 -3.389 -6.933 4.559 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -2.797 -8.391 2.045 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -3.307 -9.402 3.383 1.00 0.00 H new ATOM 0 HG LEU A 53 -5.357 -8.064 3.637 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -5.971 -6.408 1.928 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -4.525 -5.917 2.843 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -4.356 -6.572 1.197 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -6.462 -8.785 1.556 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -4.868 -9.059 0.813 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -5.382 -10.042 2.205 1.00 0.00 H new ATOM 692 N ASP A 54 -0.624 -8.730 4.405 1.00 0.00 N ATOM 693 CA ASP A 54 0.224 -9.618 5.188 1.00 0.00 C ATOM 694 C ASP A 54 0.922 -8.857 6.310 1.00 0.00 C ATOM 695 O ASP A 54 1.123 -9.382 7.404 1.00 0.00 O ATOM 696 CB ASP A 54 1.256 -10.302 4.293 1.00 0.00 C ATOM 697 CG ASP A 54 1.796 -11.575 4.913 1.00 0.00 C ATOM 698 OD1 ASP A 54 2.801 -11.504 5.642 1.00 0.00 O ATOM 699 OD2 ASP A 54 1.204 -12.653 4.671 1.00 0.00 O ATOM 0 H ASP A 54 -0.274 -8.517 3.471 1.00 0.00 H new ATOM 0 HA ASP A 54 -0.412 -10.381 5.636 1.00 0.00 H new ATOM 0 HB2 ASP A 54 0.802 -10.533 3.329 1.00 0.00 H new ATOM 0 HB3 ASP A 54 2.080 -9.615 4.101 1.00 0.00 H new ATOM 704 N LYS A 55 1.271 -7.605 6.047 1.00 0.00 N ATOM 705 CA LYS A 55 1.967 -6.794 7.040 1.00 0.00 C ATOM 706 C LYS A 55 0.988 -6.179 8.036 1.00 0.00 C ATOM 707 O LYS A 55 1.368 -5.820 9.147 1.00 0.00 O ATOM 708 CB LYS A 55 2.793 -5.690 6.374 1.00 0.00 C ATOM 709 CG LYS A 55 3.887 -6.187 5.432 1.00 0.00 C ATOM 710 CD LYS A 55 4.937 -7.031 6.148 1.00 0.00 C ATOM 711 CE LYS A 55 4.562 -8.507 6.171 1.00 0.00 C ATOM 712 NZ LYS A 55 5.598 -9.342 6.837 1.00 0.00 N ATOM 0 H LYS A 55 1.086 -7.131 5.163 1.00 0.00 H new ATOM 0 HA LYS A 55 2.643 -7.457 7.580 1.00 0.00 H new ATOM 0 HB2 LYS A 55 2.120 -5.040 5.815 1.00 0.00 H new ATOM 0 HB3 LYS A 55 3.253 -5.080 7.152 1.00 0.00 H new ATOM 0 HG2 LYS A 55 3.435 -6.776 4.634 1.00 0.00 H new ATOM 0 HG3 LYS A 55 4.372 -5.332 4.961 1.00 0.00 H new ATOM 0 HD2 LYS A 55 5.900 -6.909 5.652 1.00 0.00 H new ATOM 0 HD3 LYS A 55 5.057 -6.671 7.170 1.00 0.00 H new ATOM 0 HE2 LYS A 55 3.611 -8.630 6.689 1.00 0.00 H new ATOM 0 HE3 LYS A 55 4.416 -8.859 5.150 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 5.299 -10.338 6.829 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 6.500 -9.247 6.328 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 5.720 -9.025 7.820 1.00 0.00 H new ATOM 726 N ALA A 56 -0.275 -6.055 7.642 1.00 0.00 N ATOM 727 CA ALA A 56 -1.293 -5.519 8.539 1.00 0.00 C ATOM 728 C ALA A 56 -2.010 -6.641 9.281 1.00 0.00 C ATOM 729 O ALA A 56 -2.728 -6.404 10.251 1.00 0.00 O ATOM 730 CB ALA A 56 -2.291 -4.681 7.764 1.00 0.00 C ATOM 0 H ALA A 56 -0.616 -6.315 6.717 1.00 0.00 H new ATOM 0 HA ALA A 56 -0.797 -4.885 9.274 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -3.044 -4.288 8.447 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -1.773 -3.853 7.280 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -2.774 -5.299 7.007 1.00 0.00 H new ATOM 736 N VAL A 57 -1.798 -7.867 8.825 1.00 0.00 N ATOM 737 CA VAL A 57 -2.434 -9.028 9.427 1.00 0.00 C ATOM 738 C VAL A 57 -1.901 -9.241 10.842 1.00 0.00 C ATOM 739 O VAL A 57 -2.626 -9.668 11.742 1.00 0.00 O ATOM 740 CB VAL A 57 -2.226 -10.292 8.550 1.00 0.00 C ATOM 741 CG1 VAL A 57 -1.160 -11.226 9.106 1.00 0.00 C ATOM 742 CG2 VAL A 57 -3.538 -11.024 8.361 1.00 0.00 C ATOM 0 H VAL A 57 -1.188 -8.083 8.037 1.00 0.00 H new ATOM 0 HA VAL A 57 -3.507 -8.847 9.488 1.00 0.00 H new ATOM 0 HB VAL A 57 -1.864 -9.951 7.580 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -1.058 -12.092 8.452 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -0.208 -10.699 9.162 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -1.450 -11.557 10.103 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -3.376 -11.908 7.744 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -3.929 -11.326 9.332 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -4.255 -10.365 7.870 1.00 0.00 H new ATOM 752 N LYS A 58 -0.638 -8.881 11.039 1.00 0.00 N ATOM 753 CA LYS A 58 -0.009 -8.979 12.348 1.00 0.00 C ATOM 754 C LYS A 58 -0.509 -7.863 13.258 1.00 0.00 C ATOM 755 O LYS A 58 -0.338 -7.917 14.473 1.00 0.00 O ATOM 756 CB LYS A 58 1.516 -8.924 12.214 1.00 0.00 C ATOM 757 CG LYS A 58 2.025 -7.640 11.582 1.00 0.00 C ATOM 758 CD LYS A 58 3.501 -7.730 11.229 1.00 0.00 C ATOM 759 CE LYS A 58 4.368 -7.965 12.456 1.00 0.00 C ATOM 760 NZ LYS A 58 5.811 -8.019 12.107 1.00 0.00 N ATOM 0 H LYS A 58 -0.029 -8.518 10.306 1.00 0.00 H new ATOM 0 HA LYS A 58 -0.279 -9.936 12.795 1.00 0.00 H new ATOM 0 HB2 LYS A 58 1.963 -9.035 13.202 1.00 0.00 H new ATOM 0 HB3 LYS A 58 1.851 -9.771 11.615 1.00 0.00 H new ATOM 0 HG2 LYS A 58 1.449 -7.425 10.682 1.00 0.00 H new ATOM 0 HG3 LYS A 58 1.866 -6.809 12.269 1.00 0.00 H new ATOM 0 HD2 LYS A 58 3.654 -8.540 10.516 1.00 0.00 H new ATOM 0 HD3 LYS A 58 3.813 -6.809 10.736 1.00 0.00 H new ATOM 0 HE2 LYS A 58 4.198 -7.168 13.180 1.00 0.00 H new ATOM 0 HE3 LYS A 58 4.074 -8.899 12.936 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 6.371 -8.180 12.969 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 5.977 -8.796 11.436 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 6.097 -7.119 11.672 1.00 0.00 H new ATOM 774 N ALA A 59 -1.136 -6.854 12.658 1.00 0.00 N ATOM 775 CA ALA A 59 -1.733 -5.764 13.414 1.00 0.00 C ATOM 776 C ALA A 59 -3.166 -6.115 13.791 1.00 0.00 C ATOM 777 O ALA A 59 -3.693 -5.641 14.801 1.00 0.00 O ATOM 778 CB ALA A 59 -1.685 -4.469 12.616 1.00 0.00 C ATOM 0 H ALA A 59 -1.242 -6.772 11.647 1.00 0.00 H new ATOM 0 HA ALA A 59 -1.160 -5.616 14.329 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -2.136 -3.666 13.198 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -0.648 -4.217 12.393 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -2.236 -4.595 11.684 1.00 0.00 H new ATOM 784 N LYS A 60 -3.796 -6.954 12.967 1.00 0.00 N ATOM 785 CA LYS A 60 -5.113 -7.487 13.283 1.00 0.00 C ATOM 786 C LYS A 60 -5.005 -8.346 14.533 1.00 0.00 C ATOM 787 O LYS A 60 -5.906 -8.373 15.370 1.00 0.00 O ATOM 788 CB LYS A 60 -5.669 -8.310 12.110 1.00 0.00 C ATOM 789 CG LYS A 60 -7.183 -8.481 12.137 1.00 0.00 C ATOM 790 CD LYS A 60 -7.603 -9.814 12.736 1.00 0.00 C ATOM 791 CE LYS A 60 -9.114 -9.992 12.694 1.00 0.00 C ATOM 792 NZ LYS A 60 -9.561 -11.237 13.378 1.00 0.00 N ATOM 0 H LYS A 60 -3.412 -7.276 12.078 1.00 0.00 H new ATOM 0 HA LYS A 60 -5.803 -6.662 13.461 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -5.384 -7.829 11.174 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -5.202 -9.295 12.117 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -7.628 -7.670 12.714 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -7.573 -8.402 11.122 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -7.124 -10.627 12.190 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -7.257 -9.876 13.768 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -9.591 -9.132 13.164 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -9.445 -10.013 11.656 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -10.576 -11.382 13.206 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -9.027 -12.048 13.006 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -9.392 -11.151 14.401 1.00 0.00 H new ATOM 806 N GLY A 61 -3.881 -9.043 14.652 1.00 0.00 N ATOM 807 CA GLY A 61 -3.587 -9.767 15.870 1.00 0.00 C ATOM 808 C GLY A 61 -3.395 -11.246 15.641 1.00 0.00 C ATOM 809 O GLY A 61 -3.422 -12.038 16.585 1.00 0.00 O ATOM 0 H GLY A 61 -3.169 -9.118 13.925 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -2.686 -9.355 16.324 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -4.399 -9.617 16.581 1.00 0.00 H new ATOM 813 N GLU A 62 -3.181 -11.620 14.388 1.00 0.00 N ATOM 814 CA GLU A 62 -3.126 -13.023 14.010 1.00 0.00 C ATOM 815 C GLU A 62 -2.538 -13.174 12.611 1.00 0.00 C ATOM 816 O GLU A 62 -2.946 -12.478 11.681 1.00 0.00 O ATOM 817 CB GLU A 62 -4.542 -13.595 14.072 1.00 0.00 C ATOM 818 CG GLU A 62 -5.565 -12.688 13.409 1.00 0.00 C ATOM 819 CD GLU A 62 -6.951 -12.822 13.997 1.00 0.00 C ATOM 820 OE1 GLU A 62 -7.169 -12.334 15.126 1.00 0.00 O ATOM 821 OE2 GLU A 62 -7.844 -13.366 13.321 1.00 0.00 O ATOM 0 H GLU A 62 -3.042 -10.969 13.615 1.00 0.00 H new ATOM 0 HA GLU A 62 -2.481 -13.571 14.697 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -4.558 -14.571 13.587 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -4.822 -13.752 15.114 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -5.237 -11.653 13.502 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -5.606 -12.915 12.344 1.00 0.00 H new ATOM 828 N LYS A 63 -1.566 -14.066 12.462 1.00 0.00 N ATOM 829 CA LYS A 63 -0.957 -14.295 11.163 1.00 0.00 C ATOM 830 C LYS A 63 -1.877 -15.167 10.324 1.00 0.00 C ATOM 831 O LYS A 63 -1.983 -16.375 10.536 1.00 0.00 O ATOM 832 CB LYS A 63 0.428 -14.942 11.297 1.00 0.00 C ATOM 833 CG LYS A 63 1.373 -14.588 10.152 1.00 0.00 C ATOM 834 CD LYS A 63 0.900 -15.139 8.811 1.00 0.00 C ATOM 835 CE LYS A 63 1.155 -14.145 7.689 1.00 0.00 C ATOM 836 NZ LYS A 63 0.851 -14.716 6.351 1.00 0.00 N ATOM 0 H LYS A 63 -1.187 -14.636 13.218 1.00 0.00 H new ATOM 0 HA LYS A 63 -0.817 -13.333 10.670 1.00 0.00 H new ATOM 0 HB2 LYS A 63 0.878 -14.630 12.240 1.00 0.00 H new ATOM 0 HB3 LYS A 63 0.313 -16.025 11.342 1.00 0.00 H new ATOM 0 HG2 LYS A 63 1.465 -13.504 10.083 1.00 0.00 H new ATOM 0 HG3 LYS A 63 2.367 -14.979 10.371 1.00 0.00 H new ATOM 0 HD2 LYS A 63 1.417 -16.075 8.596 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -0.165 -15.367 8.863 1.00 0.00 H new ATOM 0 HE2 LYS A 63 0.546 -13.255 7.849 1.00 0.00 H new ATOM 0 HE3 LYS A 63 2.197 -13.827 7.718 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 1.326 -14.153 5.617 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 1.190 -15.698 6.308 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -0.176 -14.697 6.191 1.00 0.00 H new ATOM 850 N LEU A 64 -2.548 -14.538 9.379 1.00 0.00 N ATOM 851 CA LEU A 64 -3.540 -15.215 8.569 1.00 0.00 C ATOM 852 C LEU A 64 -2.992 -15.513 7.182 1.00 0.00 C ATOM 853 O LEU A 64 -2.010 -14.900 6.749 1.00 0.00 O ATOM 854 CB LEU A 64 -4.781 -14.334 8.469 1.00 0.00 C ATOM 855 CG LEU A 64 -5.294 -13.797 9.809 1.00 0.00 C ATOM 856 CD1 LEU A 64 -6.313 -12.696 9.592 1.00 0.00 C ATOM 857 CD2 LEU A 64 -5.893 -14.916 10.644 1.00 0.00 C ATOM 0 H LEU A 64 -2.422 -13.551 9.153 1.00 0.00 H new ATOM 0 HA LEU A 64 -3.799 -16.165 9.037 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -4.559 -13.490 7.816 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -5.578 -14.905 7.993 1.00 0.00 H new ATOM 0 HG LEU A 64 -4.446 -13.379 10.352 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -6.664 -12.330 10.557 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -5.852 -11.878 9.039 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -7.157 -13.088 9.024 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -6.251 -14.512 11.591 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -6.726 -15.367 10.104 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -5.133 -15.673 10.837 1.00 0.00 H new ATOM 869 N GLU A 65 -3.623 -16.444 6.483 1.00 0.00 N ATOM 870 CA GLU A 65 -3.183 -16.812 5.149 1.00 0.00 C ATOM 871 C GLU A 65 -4.174 -16.325 4.112 1.00 0.00 C ATOM 872 O GLU A 65 -4.958 -17.099 3.567 1.00 0.00 O ATOM 873 CB GLU A 65 -2.989 -18.322 5.028 1.00 0.00 C ATOM 874 CG GLU A 65 -1.692 -18.820 5.637 1.00 0.00 C ATOM 875 CD GLU A 65 -0.470 -18.260 4.935 1.00 0.00 C ATOM 876 OE1 GLU A 65 -0.031 -18.854 3.927 1.00 0.00 O ATOM 877 OE2 GLU A 65 0.061 -17.227 5.389 1.00 0.00 O ATOM 0 H GLU A 65 -4.439 -16.956 6.817 1.00 0.00 H new ATOM 0 HA GLU A 65 -2.221 -16.332 4.970 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -3.825 -18.827 5.512 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -3.016 -18.600 3.974 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -1.660 -18.545 6.691 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -1.667 -19.909 5.591 1.00 0.00 H new ATOM 884 N TRP A 66 -4.137 -15.028 3.851 1.00 0.00 N ATOM 885 CA TRP A 66 -5.024 -14.412 2.872 1.00 0.00 C ATOM 886 C TRP A 66 -4.736 -14.937 1.469 1.00 0.00 C ATOM 887 O TRP A 66 -5.577 -14.854 0.571 1.00 0.00 O ATOM 888 CB TRP A 66 -4.870 -12.887 2.903 1.00 0.00 C ATOM 889 CG TRP A 66 -3.466 -12.411 2.665 1.00 0.00 C ATOM 890 CD1 TRP A 66 -2.498 -12.213 3.607 1.00 0.00 C ATOM 891 CD2 TRP A 66 -2.879 -12.058 1.405 1.00 0.00 C ATOM 892 NE1 TRP A 66 -1.343 -11.776 3.008 1.00 0.00 N ATOM 893 CE2 TRP A 66 -1.551 -11.672 1.659 1.00 0.00 C ATOM 894 CE3 TRP A 66 -3.345 -12.040 0.085 1.00 0.00 C ATOM 895 CZ2 TRP A 66 -0.684 -11.270 0.647 1.00 0.00 C ATOM 896 CZ3 TRP A 66 -2.485 -11.640 -0.919 1.00 0.00 C ATOM 897 CH2 TRP A 66 -1.166 -11.261 -0.632 1.00 0.00 C ATOM 0 H TRP A 66 -3.498 -14.376 4.306 1.00 0.00 H new ATOM 0 HA TRP A 66 -6.050 -14.672 3.132 1.00 0.00 H new ATOM 0 HB2 TRP A 66 -5.524 -12.450 2.148 1.00 0.00 H new ATOM 0 HB3 TRP A 66 -5.209 -12.517 3.871 1.00 0.00 H new ATOM 0 HD1 TRP A 66 -2.623 -12.376 4.667 1.00 0.00 H new ATOM 0 HE1 TRP A 66 -0.470 -11.563 3.490 1.00 0.00 H new ATOM 0 HE3 TRP A 66 -4.359 -12.334 -0.144 1.00 0.00 H new ATOM 0 HZ2 TRP A 66 0.332 -10.976 0.864 1.00 0.00 H new ATOM 0 HZ3 TRP A 66 -2.834 -11.619 -1.941 1.00 0.00 H new ATOM 0 HH2 TRP A 66 -0.517 -10.955 -1.439 1.00 0.00 H new ATOM 908 N ARG A 67 -3.547 -15.497 1.296 1.00 0.00 N ATOM 909 CA ARG A 67 -3.105 -15.973 -0.003 1.00 0.00 C ATOM 910 C ARG A 67 -3.791 -17.292 -0.356 1.00 0.00 C ATOM 911 O ARG A 67 -3.760 -17.732 -1.506 1.00 0.00 O ATOM 912 CB ARG A 67 -1.577 -16.118 -0.011 1.00 0.00 C ATOM 913 CG ARG A 67 -1.051 -17.308 0.774 1.00 0.00 C ATOM 914 CD ARG A 67 0.296 -17.012 1.421 1.00 0.00 C ATOM 915 NE ARG A 67 1.182 -16.212 0.570 1.00 0.00 N ATOM 916 CZ ARG A 67 2.129 -16.720 -0.220 1.00 0.00 C ATOM 917 NH1 ARG A 67 2.259 -18.035 -0.358 1.00 0.00 N ATOM 918 NH2 ARG A 67 2.947 -15.908 -0.871 1.00 0.00 N ATOM 0 H ARG A 67 -2.869 -15.632 2.046 1.00 0.00 H new ATOM 0 HA ARG A 67 -3.385 -15.245 -0.764 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -1.238 -16.202 -1.044 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -1.137 -15.208 0.396 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -1.772 -17.581 1.545 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -0.954 -18.167 0.110 1.00 0.00 H new ATOM 0 HD2 ARG A 67 0.132 -16.485 2.361 1.00 0.00 H new ATOM 0 HD3 ARG A 67 0.789 -17.953 1.665 1.00 0.00 H new ATOM 0 HE ARG A 67 1.066 -15.199 0.583 1.00 0.00 H new ATOM 0 HH11 ARG A 67 1.632 -18.665 0.142 1.00 0.00 H new ATOM 0 HH12 ARG A 67 2.986 -18.415 -0.964 1.00 0.00 H new ATOM 0 HH21 ARG A 67 2.852 -14.898 -0.767 1.00 0.00 H new ATOM 0 HH22 ARG A 67 3.673 -16.293 -1.476 1.00 0.00 H new ATOM 932 N THR A 68 -4.425 -17.909 0.638 1.00 0.00 N ATOM 933 CA THR A 68 -5.151 -19.155 0.432 1.00 0.00 C ATOM 934 C THR A 68 -6.591 -19.043 0.936 1.00 0.00 C ATOM 935 O THR A 68 -7.536 -19.432 0.251 1.00 0.00 O ATOM 936 CB THR A 68 -4.451 -20.327 1.150 1.00 0.00 C ATOM 937 OG1 THR A 68 -4.278 -20.023 2.541 1.00 0.00 O ATOM 938 CG2 THR A 68 -3.096 -20.608 0.521 1.00 0.00 C ATOM 0 H THR A 68 -4.449 -17.563 1.597 1.00 0.00 H new ATOM 0 HA THR A 68 -5.163 -19.348 -0.641 1.00 0.00 H new ATOM 0 HB THR A 68 -5.079 -21.212 1.048 1.00 0.00 H new ATOM 0 HG1 THR A 68 -3.834 -20.774 2.987 1.00 0.00 H new ATOM 0 HG21 THR A 68 -2.618 -21.438 1.042 1.00 0.00 H new ATOM 0 HG22 THR A 68 -3.229 -20.867 -0.529 1.00 0.00 H new ATOM 0 HG23 THR A 68 -2.468 -19.721 0.599 1.00 0.00 H new ATOM 946 N SER A 69 -6.744 -18.470 2.120 1.00 0.00 N ATOM 947 CA SER A 69 -8.028 -18.403 2.794 1.00 0.00 C ATOM 948 C SER A 69 -8.701 -17.062 2.544 1.00 0.00 C ATOM 949 O SER A 69 -8.109 -16.003 2.762 1.00 0.00 O ATOM 950 CB SER A 69 -7.818 -18.624 4.293 1.00 0.00 C ATOM 951 OG SER A 69 -7.211 -19.884 4.537 1.00 0.00 O ATOM 0 H SER A 69 -5.980 -18.038 2.640 1.00 0.00 H new ATOM 0 HA SER A 69 -8.681 -19.181 2.398 1.00 0.00 H new ATOM 0 HB2 SER A 69 -7.192 -17.829 4.698 1.00 0.00 H new ATOM 0 HB3 SER A 69 -8.776 -18.570 4.811 1.00 0.00 H new ATOM 0 HG SER A 69 -7.084 -20.005 5.501 1.00 0.00 H new ATOM 957 N ILE A 70 -9.941 -17.107 2.080 1.00 0.00 N ATOM 958 CA ILE A 70 -10.680 -15.892 1.782 1.00 0.00 C ATOM 959 C ILE A 70 -11.223 -15.273 3.065 1.00 0.00 C ATOM 960 O ILE A 70 -11.342 -14.054 3.183 1.00 0.00 O ATOM 961 CB ILE A 70 -11.833 -16.153 0.781 1.00 0.00 C ATOM 962 CG1 ILE A 70 -12.447 -14.832 0.315 1.00 0.00 C ATOM 963 CG2 ILE A 70 -12.897 -17.053 1.393 1.00 0.00 C ATOM 964 CD1 ILE A 70 -11.451 -13.914 -0.360 1.00 0.00 C ATOM 0 H ILE A 70 -10.455 -17.970 1.902 1.00 0.00 H new ATOM 0 HA ILE A 70 -9.988 -15.192 1.314 1.00 0.00 H new ATOM 0 HB ILE A 70 -11.418 -16.667 -0.086 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -13.263 -15.043 -0.376 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -12.881 -14.318 1.173 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -13.694 -17.219 0.668 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -12.451 -18.009 1.667 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -13.309 -16.576 2.282 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -11.952 -12.995 -0.666 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -10.647 -13.674 0.336 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -11.036 -14.410 -1.237 1.00 0.00 H new ATOM 976 N VAL A 71 -11.508 -16.126 4.040 1.00 0.00 N ATOM 977 CA VAL A 71 -12.028 -15.679 5.321 1.00 0.00 C ATOM 978 C VAL A 71 -10.964 -14.888 6.084 1.00 0.00 C ATOM 979 O VAL A 71 -11.281 -14.006 6.886 1.00 0.00 O ATOM 980 CB VAL A 71 -12.518 -16.881 6.170 1.00 0.00 C ATOM 981 CG1 VAL A 71 -11.379 -17.848 6.467 1.00 0.00 C ATOM 982 CG2 VAL A 71 -13.177 -16.409 7.458 1.00 0.00 C ATOM 0 H VAL A 71 -11.386 -17.136 3.965 1.00 0.00 H new ATOM 0 HA VAL A 71 -12.880 -15.026 5.131 1.00 0.00 H new ATOM 0 HB VAL A 71 -13.266 -17.415 5.584 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -11.754 -18.680 7.064 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -10.971 -18.228 5.530 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -10.596 -17.329 7.020 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -13.511 -17.272 8.033 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -12.459 -15.837 8.046 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -14.034 -15.779 7.219 1.00 0.00 H new ATOM 992 N ASP A 72 -9.704 -15.178 5.788 1.00 0.00 N ATOM 993 CA ASP A 72 -8.581 -14.578 6.497 1.00 0.00 C ATOM 994 C ASP A 72 -8.343 -13.138 6.076 1.00 0.00 C ATOM 995 O ASP A 72 -8.142 -12.276 6.922 1.00 0.00 O ATOM 996 CB ASP A 72 -7.315 -15.407 6.295 1.00 0.00 C ATOM 997 CG ASP A 72 -7.232 -16.574 7.261 1.00 0.00 C ATOM 998 OD1 ASP A 72 -8.191 -16.773 8.044 1.00 0.00 O ATOM 999 OD2 ASP A 72 -6.206 -17.288 7.239 1.00 0.00 O ATOM 0 H ASP A 72 -9.432 -15.832 5.054 1.00 0.00 H new ATOM 0 HA ASP A 72 -8.836 -14.570 7.557 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -7.288 -15.782 5.272 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -6.441 -14.769 6.423 1.00 0.00 H new ATOM 1004 N LEU A 73 -8.375 -12.859 4.782 1.00 0.00 N ATOM 1005 CA LEU A 73 -8.194 -11.485 4.325 1.00 0.00 C ATOM 1006 C LEU A 73 -9.418 -10.653 4.680 1.00 0.00 C ATOM 1007 O LEU A 73 -9.309 -9.463 4.968 1.00 0.00 O ATOM 1008 CB LEU A 73 -7.894 -11.426 2.821 1.00 0.00 C ATOM 1009 CG LEU A 73 -8.914 -12.078 1.887 1.00 0.00 C ATOM 1010 CD1 LEU A 73 -9.995 -11.083 1.490 1.00 0.00 C ATOM 1011 CD2 LEU A 73 -8.215 -12.632 0.656 1.00 0.00 C ATOM 0 H LEU A 73 -8.521 -13.546 4.042 1.00 0.00 H new ATOM 0 HA LEU A 73 -7.329 -11.064 4.837 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -7.793 -10.379 2.536 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -6.926 -11.898 2.649 1.00 0.00 H new ATOM 0 HG LEU A 73 -9.393 -12.902 2.416 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -10.710 -11.568 0.825 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -10.511 -10.731 2.383 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -9.539 -10.236 0.977 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -8.950 -13.094 -0.003 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -7.713 -11.822 0.127 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -7.480 -13.378 0.960 1.00 0.00 H new ATOM 1023 N MET A 74 -10.579 -11.298 4.686 1.00 0.00 N ATOM 1024 CA MET A 74 -11.817 -10.639 5.070 1.00 0.00 C ATOM 1025 C MET A 74 -11.720 -10.114 6.499 1.00 0.00 C ATOM 1026 O MET A 74 -12.010 -8.948 6.762 1.00 0.00 O ATOM 1027 CB MET A 74 -12.996 -11.609 4.937 1.00 0.00 C ATOM 1028 CG MET A 74 -14.311 -11.047 5.450 1.00 0.00 C ATOM 1029 SD MET A 74 -15.694 -12.184 5.226 1.00 0.00 S ATOM 1030 CE MET A 74 -15.118 -13.617 6.129 1.00 0.00 C ATOM 0 H MET A 74 -10.687 -12.279 4.428 1.00 0.00 H new ATOM 0 HA MET A 74 -11.983 -9.794 4.402 1.00 0.00 H new ATOM 0 HB2 MET A 74 -13.113 -11.883 3.889 1.00 0.00 H new ATOM 0 HB3 MET A 74 -12.765 -12.524 5.482 1.00 0.00 H new ATOM 0 HG2 MET A 74 -14.210 -10.809 6.509 1.00 0.00 H new ATOM 0 HG3 MET A 74 -14.528 -10.112 4.933 1.00 0.00 H new ATOM 0 HE1 MET A 74 -15.919 -13.992 6.766 1.00 0.00 H new ATOM 0 HE2 MET A 74 -14.820 -14.395 5.426 1.00 0.00 H new ATOM 0 HE3 MET A 74 -14.264 -13.339 6.746 1.00 0.00 H new ATOM 1040 N LYS A 75 -11.280 -10.972 7.416 1.00 0.00 N ATOM 1041 CA LYS A 75 -11.183 -10.598 8.823 1.00 0.00 C ATOM 1042 C LYS A 75 -10.032 -9.621 9.052 1.00 0.00 C ATOM 1043 O LYS A 75 -10.151 -8.707 9.866 1.00 0.00 O ATOM 1044 CB LYS A 75 -11.011 -11.844 9.702 1.00 0.00 C ATOM 1045 CG LYS A 75 -9.732 -12.619 9.424 1.00 0.00 C ATOM 1046 CD LYS A 75 -9.589 -13.878 10.276 1.00 0.00 C ATOM 1047 CE LYS A 75 -10.552 -14.971 9.851 1.00 0.00 C ATOM 1048 NZ LYS A 75 -9.987 -16.328 10.082 1.00 0.00 N ATOM 0 H LYS A 75 -10.986 -11.927 7.211 1.00 0.00 H new ATOM 0 HA LYS A 75 -12.111 -10.100 9.103 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -11.022 -11.543 10.749 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -11.865 -12.504 9.551 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -9.706 -12.897 8.370 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -8.876 -11.969 9.603 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -8.567 -14.249 10.204 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -9.765 -13.628 11.322 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -11.486 -14.867 10.404 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -10.792 -14.853 8.794 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -10.760 -17.023 10.125 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -9.344 -16.574 9.303 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -9.462 -16.337 10.980 1.00 0.00 H new ATOM 1062 N ALA A 76 -8.940 -9.806 8.310 1.00 0.00 N ATOM 1063 CA ALA A 76 -7.732 -9.000 8.471 1.00 0.00 C ATOM 1064 C ALA A 76 -8.008 -7.515 8.300 1.00 0.00 C ATOM 1065 O ALA A 76 -7.511 -6.692 9.066 1.00 0.00 O ATOM 1066 CB ALA A 76 -6.672 -9.437 7.474 1.00 0.00 C ATOM 0 H ALA A 76 -8.869 -10.517 7.582 1.00 0.00 H new ATOM 0 HA ALA A 76 -7.373 -9.159 9.488 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -5.777 -8.829 7.604 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -6.426 -10.486 7.641 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -7.052 -9.311 6.460 1.00 0.00 H new ATOM 1072 N LEU A 77 -8.793 -7.182 7.290 1.00 0.00 N ATOM 1073 CA LEU A 77 -9.083 -5.788 6.990 1.00 0.00 C ATOM 1074 C LEU A 77 -9.960 -5.140 8.058 1.00 0.00 C ATOM 1075 O LEU A 77 -9.509 -4.245 8.771 1.00 0.00 O ATOM 1076 CB LEU A 77 -9.735 -5.635 5.610 1.00 0.00 C ATOM 1077 CG LEU A 77 -8.760 -5.500 4.429 1.00 0.00 C ATOM 1078 CD1 LEU A 77 -7.822 -4.321 4.636 1.00 0.00 C ATOM 1079 CD2 LEU A 77 -7.962 -6.777 4.228 1.00 0.00 C ATOM 0 H LEU A 77 -9.240 -7.853 6.666 1.00 0.00 H new ATOM 0 HA LEU A 77 -8.125 -5.269 6.983 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -10.376 -6.499 5.433 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -10.381 -4.757 5.628 1.00 0.00 H new ATOM 0 HG LEU A 77 -9.351 -5.322 3.531 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -7.141 -4.245 3.788 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -8.404 -3.403 4.718 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -7.248 -4.469 5.551 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -7.281 -6.652 3.386 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -7.389 -6.993 5.129 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -8.643 -7.603 4.024 1.00 0.00 H new ATOM 1091 N ASP A 78 -11.208 -5.583 8.173 1.00 0.00 N ATOM 1092 CA ASP A 78 -12.156 -4.900 9.056 1.00 0.00 C ATOM 1093 C ASP A 78 -13.396 -5.749 9.344 1.00 0.00 C ATOM 1094 O ASP A 78 -14.372 -5.259 9.913 1.00 0.00 O ATOM 1095 CB ASP A 78 -12.574 -3.574 8.398 1.00 0.00 C ATOM 1096 CG ASP A 78 -13.371 -2.661 9.312 1.00 0.00 C ATOM 1097 OD1 ASP A 78 -12.835 -2.242 10.362 1.00 0.00 O ATOM 1098 OD2 ASP A 78 -14.527 -2.324 8.967 1.00 0.00 O ATOM 0 H ASP A 78 -11.584 -6.393 7.680 1.00 0.00 H new ATOM 0 HA ASP A 78 -11.663 -4.720 10.011 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -11.680 -3.047 8.064 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -13.167 -3.791 7.510 1.00 0.00 H new ATOM 1103 N ILE A 79 -13.364 -7.030 9.006 1.00 0.00 N ATOM 1104 CA ILE A 79 -14.588 -7.819 9.056 1.00 0.00 C ATOM 1105 C ILE A 79 -14.561 -8.832 10.196 1.00 0.00 C ATOM 1106 O ILE A 79 -13.511 -9.375 10.546 1.00 0.00 O ATOM 1107 CB ILE A 79 -14.868 -8.519 7.707 1.00 0.00 C ATOM 1108 CG1 ILE A 79 -14.800 -7.499 6.567 1.00 0.00 C ATOM 1109 CG2 ILE A 79 -16.237 -9.182 7.715 1.00 0.00 C ATOM 1110 CD1 ILE A 79 -15.824 -6.388 6.686 1.00 0.00 C ATOM 0 H ILE A 79 -12.531 -7.534 8.703 1.00 0.00 H new ATOM 0 HA ILE A 79 -15.405 -7.124 9.249 1.00 0.00 H new ATOM 0 HB ILE A 79 -14.110 -9.287 7.557 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -13.802 -7.061 6.541 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -14.946 -8.016 5.619 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -16.412 -9.668 6.755 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -16.276 -9.926 8.511 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -17.005 -8.428 7.885 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -15.717 -5.703 5.845 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -16.827 -6.815 6.681 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -15.666 -5.845 7.618 1.00 0.00 H new ATOM 1122 N ASP A 80 -15.736 -9.069 10.770 1.00 0.00 N ATOM 1123 CA ASP A 80 -15.883 -9.919 11.953 1.00 0.00 C ATOM 1124 C ASP A 80 -15.661 -11.389 11.622 1.00 0.00 C ATOM 1125 O ASP A 80 -15.560 -12.220 12.525 1.00 0.00 O ATOM 1126 CB ASP A 80 -17.285 -9.755 12.549 1.00 0.00 C ATOM 1127 CG ASP A 80 -17.703 -8.306 12.689 1.00 0.00 C ATOM 1128 OD1 ASP A 80 -18.019 -7.676 11.653 1.00 0.00 O ATOM 1129 OD2 ASP A 80 -17.737 -7.799 13.827 1.00 0.00 O ATOM 0 H ASP A 80 -16.615 -8.679 10.430 1.00 0.00 H new ATOM 0 HA ASP A 80 -15.127 -9.605 12.673 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -18.005 -10.276 11.918 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -17.316 -10.232 13.528 1.00 0.00 H new ATOM 1134 N SER A 81 -15.605 -11.693 10.323 1.00 0.00 N ATOM 1135 CA SER A 81 -15.493 -13.066 9.814 1.00 0.00 C ATOM 1136 C SER A 81 -16.499 -14.010 10.479 1.00 0.00 C ATOM 1137 O SER A 81 -16.290 -15.224 10.546 1.00 0.00 O ATOM 1138 CB SER A 81 -14.054 -13.596 9.951 1.00 0.00 C ATOM 1139 OG SER A 81 -13.502 -13.343 11.233 1.00 0.00 O ATOM 0 H SER A 81 -15.636 -10.988 9.587 1.00 0.00 H new ATOM 0 HA SER A 81 -15.739 -13.035 8.753 1.00 0.00 H new ATOM 0 HB2 SER A 81 -14.046 -14.669 9.761 1.00 0.00 H new ATOM 0 HB3 SER A 81 -13.426 -13.133 9.190 1.00 0.00 H new ATOM 0 HG SER A 81 -14.226 -13.214 11.881 1.00 0.00 H new ATOM 1145 N SER A 82 -17.616 -13.450 10.919 1.00 0.00 N ATOM 1146 CA SER A 82 -18.640 -14.213 11.606 1.00 0.00 C ATOM 1147 C SER A 82 -19.604 -14.829 10.596 1.00 0.00 C ATOM 1148 O SER A 82 -19.300 -14.910 9.403 1.00 0.00 O ATOM 1149 CB SER A 82 -19.380 -13.301 12.597 1.00 0.00 C ATOM 1150 OG SER A 82 -20.282 -14.029 13.413 1.00 0.00 O ATOM 0 H SER A 82 -17.835 -12.460 10.809 1.00 0.00 H new ATOM 0 HA SER A 82 -18.177 -15.027 12.164 1.00 0.00 H new ATOM 0 HB2 SER A 82 -18.655 -12.786 13.227 1.00 0.00 H new ATOM 0 HB3 SER A 82 -19.926 -12.534 12.047 1.00 0.00 H new ATOM 0 HG SER A 82 -20.732 -13.416 14.031 1.00 0.00 H new ATOM 1156 N LEU A 83 -20.754 -15.274 11.080 1.00 0.00 N ATOM 1157 CA LEU A 83 -21.765 -15.876 10.229 1.00 0.00 C ATOM 1158 C LEU A 83 -22.280 -14.836 9.240 1.00 0.00 C ATOM 1159 O LEU A 83 -22.369 -15.102 8.044 1.00 0.00 O ATOM 1160 CB LEU A 83 -22.908 -16.437 11.089 1.00 0.00 C ATOM 1161 CG LEU A 83 -23.810 -17.484 10.416 1.00 0.00 C ATOM 1162 CD1 LEU A 83 -24.715 -16.847 9.371 1.00 0.00 C ATOM 1163 CD2 LEU A 83 -22.966 -18.583 9.787 1.00 0.00 C ATOM 0 H LEU A 83 -21.010 -15.228 12.066 1.00 0.00 H new ATOM 0 HA LEU A 83 -21.330 -16.702 9.667 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -22.476 -16.882 11.986 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -23.532 -15.605 11.415 1.00 0.00 H new ATOM 0 HG LEU A 83 -24.445 -17.923 11.185 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -25.340 -17.615 8.914 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -25.349 -16.099 9.846 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -24.105 -16.371 8.603 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -23.618 -19.317 9.314 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -22.304 -18.149 9.037 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -22.370 -19.071 10.558 1.00 0.00 H new ATOM 1175 N SER A 84 -22.583 -13.647 9.750 1.00 0.00 N ATOM 1176 CA SER A 84 -23.086 -12.553 8.930 1.00 0.00 C ATOM 1177 C SER A 84 -22.123 -12.246 7.787 1.00 0.00 C ATOM 1178 O SER A 84 -22.538 -12.064 6.645 1.00 0.00 O ATOM 1179 CB SER A 84 -23.261 -11.315 9.801 1.00 0.00 C ATOM 1180 OG SER A 84 -23.798 -11.665 11.064 1.00 0.00 O ATOM 0 H SER A 84 -22.487 -13.416 10.739 1.00 0.00 H new ATOM 0 HA SER A 84 -24.045 -12.845 8.501 1.00 0.00 H new ATOM 0 HB2 SER A 84 -22.300 -10.818 9.934 1.00 0.00 H new ATOM 0 HB3 SER A 84 -23.921 -10.604 9.304 1.00 0.00 H new ATOM 0 HG SER A 84 -23.902 -10.858 11.610 1.00 0.00 H new ATOM 1186 N ALA A 85 -20.836 -12.222 8.107 1.00 0.00 N ATOM 1187 CA ALA A 85 -19.803 -11.906 7.133 1.00 0.00 C ATOM 1188 C ALA A 85 -19.787 -12.908 5.985 1.00 0.00 C ATOM 1189 O ALA A 85 -19.907 -12.534 4.822 1.00 0.00 O ATOM 1190 CB ALA A 85 -18.444 -11.869 7.807 1.00 0.00 C ATOM 0 H ALA A 85 -20.482 -12.420 9.043 1.00 0.00 H new ATOM 0 HA ALA A 85 -20.029 -10.924 6.717 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -17.678 -11.632 7.069 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -18.445 -11.107 8.587 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -18.231 -12.842 8.251 1.00 0.00 H new ATOM 1196 N ARG A 86 -19.649 -14.186 6.318 1.00 0.00 N ATOM 1197 CA ARG A 86 -19.571 -15.231 5.300 1.00 0.00 C ATOM 1198 C ARG A 86 -20.896 -15.362 4.545 1.00 0.00 C ATOM 1199 O ARG A 86 -20.944 -15.901 3.440 1.00 0.00 O ATOM 1200 CB ARG A 86 -19.173 -16.568 5.937 1.00 0.00 C ATOM 1201 CG ARG A 86 -20.224 -17.155 6.865 1.00 0.00 C ATOM 1202 CD ARG A 86 -19.641 -18.263 7.727 1.00 0.00 C ATOM 1203 NE ARG A 86 -18.638 -17.748 8.665 1.00 0.00 N ATOM 1204 CZ ARG A 86 -17.652 -18.485 9.187 1.00 0.00 C ATOM 1205 NH1 ARG A 86 -17.545 -19.772 8.880 1.00 0.00 N ATOM 1206 NH2 ARG A 86 -16.780 -17.936 10.027 1.00 0.00 N ATOM 0 H ARG A 86 -19.589 -14.524 7.279 1.00 0.00 H new ATOM 0 HA ARG A 86 -18.803 -14.949 4.579 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -18.962 -17.286 5.145 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -18.248 -16.430 6.496 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -20.629 -16.369 7.503 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -21.054 -17.547 6.277 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -20.442 -18.752 8.282 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -19.187 -19.021 7.088 1.00 0.00 H new ATOM 0 HE ARG A 86 -18.696 -16.766 8.936 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -18.216 -20.202 8.244 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -16.791 -20.331 9.280 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -16.862 -16.950 10.275 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -16.029 -18.501 10.424 1.00 0.00 H new ATOM 1220 N LYS A 87 -21.957 -14.843 5.143 1.00 0.00 N ATOM 1221 CA LYS A 87 -23.279 -14.878 4.540 1.00 0.00 C ATOM 1222 C LYS A 87 -23.384 -13.845 3.423 1.00 0.00 C ATOM 1223 O LYS A 87 -23.623 -14.191 2.270 1.00 0.00 O ATOM 1224 CB LYS A 87 -24.351 -14.604 5.601 1.00 0.00 C ATOM 1225 CG LYS A 87 -25.780 -14.778 5.107 1.00 0.00 C ATOM 1226 CD LYS A 87 -26.139 -16.246 4.937 1.00 0.00 C ATOM 1227 CE LYS A 87 -26.153 -16.976 6.273 1.00 0.00 C ATOM 1228 NZ LYS A 87 -26.514 -18.412 6.125 1.00 0.00 N ATOM 0 H LYS A 87 -21.926 -14.388 6.055 1.00 0.00 H new ATOM 0 HA LYS A 87 -23.438 -15.870 4.118 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -24.188 -15.272 6.447 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -24.228 -13.586 5.970 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -26.469 -14.314 5.813 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -25.902 -14.260 4.156 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -27.118 -16.330 4.465 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -25.421 -16.722 4.269 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -25.171 -16.896 6.739 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -26.864 -16.492 6.942 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -26.511 -18.869 7.059 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -27.462 -18.490 5.705 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -25.822 -18.882 5.508 1.00 0.00 H new ATOM 1242 N GLU A 88 -23.182 -12.576 3.770 1.00 0.00 N ATOM 1243 CA GLU A 88 -23.353 -11.483 2.820 1.00 0.00 C ATOM 1244 C GLU A 88 -22.234 -11.444 1.786 1.00 0.00 C ATOM 1245 O GLU A 88 -22.428 -10.939 0.683 1.00 0.00 O ATOM 1246 CB GLU A 88 -23.450 -10.141 3.549 1.00 0.00 C ATOM 1247 CG GLU A 88 -22.247 -9.808 4.408 1.00 0.00 C ATOM 1248 CD GLU A 88 -22.422 -8.497 5.136 1.00 0.00 C ATOM 1249 OE1 GLU A 88 -23.085 -8.486 6.192 1.00 0.00 O ATOM 1250 OE2 GLU A 88 -21.924 -7.468 4.641 1.00 0.00 O ATOM 0 H GLU A 88 -22.899 -12.280 4.704 1.00 0.00 H new ATOM 0 HA GLU A 88 -24.287 -11.664 2.288 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -23.585 -9.350 2.812 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -24.340 -10.146 4.178 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -22.085 -10.607 5.132 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -21.356 -9.760 3.782 1.00 0.00 H new ATOM 1257 N LEU A 89 -21.067 -11.976 2.128 1.00 0.00 N ATOM 1258 CA LEU A 89 -19.962 -12.025 1.178 1.00 0.00 C ATOM 1259 C LEU A 89 -20.307 -12.945 0.014 1.00 0.00 C ATOM 1260 O LEU A 89 -20.235 -12.541 -1.147 1.00 0.00 O ATOM 1261 CB LEU A 89 -18.668 -12.478 1.861 1.00 0.00 C ATOM 1262 CG LEU A 89 -17.436 -12.560 0.952 1.00 0.00 C ATOM 1263 CD1 LEU A 89 -17.260 -11.273 0.158 1.00 0.00 C ATOM 1264 CD2 LEU A 89 -16.196 -12.827 1.784 1.00 0.00 C ATOM 0 H LEU A 89 -20.862 -12.375 3.044 1.00 0.00 H new ATOM 0 HA LEU A 89 -19.800 -11.019 0.791 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -18.450 -11.791 2.679 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -18.836 -13.459 2.305 1.00 0.00 H new ATOM 0 HG LEU A 89 -17.583 -13.380 0.249 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -16.379 -11.356 -0.479 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -18.141 -11.104 -0.461 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -17.133 -10.436 0.845 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -15.325 -12.884 1.131 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -16.059 -12.019 2.502 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -16.312 -13.771 2.317 1.00 0.00 H new ATOM 1276 N ALA A 90 -20.704 -14.172 0.332 1.00 0.00 N ATOM 1277 CA ALA A 90 -21.112 -15.132 -0.687 1.00 0.00 C ATOM 1278 C ALA A 90 -22.369 -14.645 -1.400 1.00 0.00 C ATOM 1279 O ALA A 90 -22.531 -14.827 -2.611 1.00 0.00 O ATOM 1280 CB ALA A 90 -21.350 -16.498 -0.054 1.00 0.00 C ATOM 0 H ALA A 90 -20.752 -14.526 1.288 1.00 0.00 H new ATOM 0 HA ALA A 90 -20.314 -15.225 -1.424 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -21.654 -17.208 -0.823 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -20.431 -16.846 0.417 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -22.135 -16.419 0.698 1.00 0.00 H new ATOM 1286 N LYS A 91 -23.238 -14.004 -0.632 1.00 0.00 N ATOM 1287 CA LYS A 91 -24.501 -13.477 -1.126 1.00 0.00 C ATOM 1288 C LYS A 91 -24.282 -12.449 -2.236 1.00 0.00 C ATOM 1289 O LYS A 91 -24.968 -12.468 -3.257 1.00 0.00 O ATOM 1290 CB LYS A 91 -25.256 -12.837 0.040 1.00 0.00 C ATOM 1291 CG LYS A 91 -26.645 -12.335 -0.299 1.00 0.00 C ATOM 1292 CD LYS A 91 -27.287 -11.667 0.906 1.00 0.00 C ATOM 1293 CE LYS A 91 -26.583 -10.369 1.265 1.00 0.00 C ATOM 1294 NZ LYS A 91 -27.151 -9.753 2.492 1.00 0.00 N ATOM 0 H LYS A 91 -23.084 -13.834 0.362 1.00 0.00 H new ATOM 0 HA LYS A 91 -25.083 -14.296 -1.548 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -25.336 -13.566 0.846 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -24.667 -12.003 0.421 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -26.589 -11.627 -1.126 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -27.266 -13.167 -0.633 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -28.337 -11.466 0.695 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -27.257 -12.346 1.758 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -25.520 -10.561 1.413 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -26.667 -9.668 0.434 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -26.644 -8.870 2.704 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -28.159 -9.546 2.342 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -27.048 -10.411 3.291 1.00 0.00 H new ATOM 1308 N GLU A 92 -23.315 -11.565 -2.032 1.00 0.00 N ATOM 1309 CA GLU A 92 -23.029 -10.493 -2.979 1.00 0.00 C ATOM 1310 C GLU A 92 -22.259 -11.001 -4.194 1.00 0.00 C ATOM 1311 O GLU A 92 -22.174 -10.315 -5.216 1.00 0.00 O ATOM 1312 CB GLU A 92 -22.236 -9.382 -2.289 1.00 0.00 C ATOM 1313 CG GLU A 92 -23.075 -8.513 -1.368 1.00 0.00 C ATOM 1314 CD GLU A 92 -24.079 -7.675 -2.130 1.00 0.00 C ATOM 1315 OE1 GLU A 92 -23.653 -6.732 -2.833 1.00 0.00 O ATOM 1316 OE2 GLU A 92 -25.292 -7.950 -2.039 1.00 0.00 O ATOM 0 H GLU A 92 -22.709 -11.569 -1.211 1.00 0.00 H new ATOM 0 HA GLU A 92 -23.983 -10.099 -3.329 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -21.426 -9.830 -1.713 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -21.775 -8.751 -3.049 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -23.601 -9.146 -0.653 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -22.420 -7.858 -0.793 1.00 0.00 H new ATOM 1323 N LEU A 93 -21.695 -12.192 -4.078 1.00 0.00 N ATOM 1324 CA LEU A 93 -20.947 -12.790 -5.176 1.00 0.00 C ATOM 1325 C LEU A 93 -21.878 -13.567 -6.095 1.00 0.00 C ATOM 1326 O LEU A 93 -21.659 -13.636 -7.303 1.00 0.00 O ATOM 1327 CB LEU A 93 -19.858 -13.717 -4.638 1.00 0.00 C ATOM 1328 CG LEU A 93 -18.783 -13.037 -3.795 1.00 0.00 C ATOM 1329 CD1 LEU A 93 -17.852 -14.076 -3.196 1.00 0.00 C ATOM 1330 CD2 LEU A 93 -18.000 -12.035 -4.631 1.00 0.00 C ATOM 0 H LEU A 93 -21.740 -12.765 -3.235 1.00 0.00 H new ATOM 0 HA LEU A 93 -20.479 -11.987 -5.746 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -20.330 -14.495 -4.038 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -19.376 -14.213 -5.481 1.00 0.00 H new ATOM 0 HG LEU A 93 -19.269 -12.496 -2.983 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -17.089 -13.579 -2.597 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -18.424 -14.756 -2.564 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -17.374 -14.640 -3.996 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -17.238 -11.561 -4.012 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -17.521 -12.551 -5.463 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -18.679 -11.274 -5.017 1.00 0.00 H new ATOM 1342 N GLY A 94 -22.915 -14.148 -5.512 1.00 0.00 N ATOM 1343 CA GLY A 94 -23.872 -14.916 -6.283 1.00 0.00 C ATOM 1344 C GLY A 94 -24.523 -15.999 -5.453 1.00 0.00 C ATOM 1345 O GLY A 94 -25.744 -16.137 -5.454 1.00 0.00 O ATOM 0 H GLY A 94 -23.112 -14.101 -4.512 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -24.639 -14.250 -6.677 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -23.371 -15.367 -7.139 1.00 0.00 H new ATOM 1349 N TYR A 95 -23.690 -16.759 -4.748 1.00 0.00 N ATOM 1350 CA TYR A 95 -24.140 -17.814 -3.836 1.00 0.00 C ATOM 1351 C TYR A 95 -24.974 -18.878 -4.550 1.00 0.00 C ATOM 1352 O TYR A 95 -26.187 -18.738 -4.710 1.00 0.00 O ATOM 1353 CB TYR A 95 -24.926 -17.222 -2.656 1.00 0.00 C ATOM 1354 CG TYR A 95 -25.458 -18.266 -1.698 1.00 0.00 C ATOM 1355 CD1 TYR A 95 -24.594 -19.112 -1.013 1.00 0.00 C ATOM 1356 CD2 TYR A 95 -26.823 -18.407 -1.480 1.00 0.00 C ATOM 1357 CE1 TYR A 95 -25.078 -20.075 -0.147 1.00 0.00 C ATOM 1358 CE2 TYR A 95 -27.313 -19.365 -0.615 1.00 0.00 C ATOM 1359 CZ TYR A 95 -26.436 -20.194 0.051 1.00 0.00 C ATOM 1360 OH TYR A 95 -26.919 -21.152 0.915 1.00 0.00 O ATOM 0 H TYR A 95 -22.676 -16.662 -4.792 1.00 0.00 H new ATOM 0 HA TYR A 95 -23.244 -18.303 -3.452 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -24.281 -16.534 -2.109 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -25.760 -16.637 -3.043 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -23.528 -19.016 -1.159 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -27.513 -17.756 -1.996 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -24.395 -20.731 0.372 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -28.377 -19.464 -0.461 1.00 0.00 H new ATOM 0 HH TYR A 95 -27.897 -21.104 0.943 1.00 0.00 H new ATOM 1454 N ALA A 103 -15.709 -26.858 2.394 1.00 0.00 N ATOM 1455 CA ALA A 103 -14.417 -27.174 1.797 1.00 0.00 C ATOM 1456 C ALA A 103 -14.178 -26.346 0.539 1.00 0.00 C ATOM 1457 O ALA A 103 -13.229 -25.564 0.466 1.00 0.00 O ATOM 1458 CB ALA A 103 -14.344 -28.657 1.467 1.00 0.00 C ATOM 0 HA ALA A 103 -13.639 -26.928 2.519 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -13.375 -28.883 1.021 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -14.469 -29.239 2.380 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -15.136 -28.912 0.763 1.00 0.00 H new ATOM 1464 N SER A 104 -15.057 -26.501 -0.443 1.00 0.00 N ATOM 1465 CA SER A 104 -14.927 -25.778 -1.700 1.00 0.00 C ATOM 1466 C SER A 104 -15.439 -24.345 -1.558 1.00 0.00 C ATOM 1467 O SER A 104 -15.261 -23.517 -2.450 1.00 0.00 O ATOM 1468 CB SER A 104 -15.686 -26.517 -2.804 1.00 0.00 C ATOM 1469 OG SER A 104 -15.282 -27.876 -2.863 1.00 0.00 O ATOM 0 H SER A 104 -15.866 -27.120 -0.393 1.00 0.00 H new ATOM 0 HA SER A 104 -13.872 -25.730 -1.969 1.00 0.00 H new ATOM 0 HB2 SER A 104 -16.758 -26.458 -2.618 1.00 0.00 H new ATOM 0 HB3 SER A 104 -15.503 -26.035 -3.764 1.00 0.00 H new ATOM 0 HG SER A 104 -15.778 -28.334 -3.573 1.00 0.00 H new ATOM 1475 N MET A 105 -16.060 -24.058 -0.417 1.00 0.00 N ATOM 1476 CA MET A 105 -16.598 -22.730 -0.149 1.00 0.00 C ATOM 1477 C MET A 105 -15.474 -21.710 0.001 1.00 0.00 C ATOM 1478 O MET A 105 -15.544 -20.618 -0.552 1.00 0.00 O ATOM 1479 CB MET A 105 -17.455 -22.745 1.117 1.00 0.00 C ATOM 1480 CG MET A 105 -18.124 -21.417 1.421 1.00 0.00 C ATOM 1481 SD MET A 105 -19.014 -21.440 2.987 1.00 0.00 S ATOM 1482 CE MET A 105 -17.658 -21.633 4.145 1.00 0.00 C ATOM 0 H MET A 105 -16.203 -24.730 0.337 1.00 0.00 H new ATOM 0 HA MET A 105 -17.220 -22.442 -0.996 1.00 0.00 H new ATOM 0 HB2 MET A 105 -18.222 -23.513 1.016 1.00 0.00 H new ATOM 0 HB3 MET A 105 -16.830 -23.028 1.964 1.00 0.00 H new ATOM 0 HG2 MET A 105 -17.370 -20.631 1.446 1.00 0.00 H new ATOM 0 HG3 MET A 105 -18.816 -21.169 0.616 1.00 0.00 H new ATOM 0 HE1 MET A 105 -17.791 -20.944 4.979 1.00 0.00 H new ATOM 0 HE2 MET A 105 -17.642 -22.657 4.519 1.00 0.00 H new ATOM 0 HE3 MET A 105 -16.716 -21.415 3.642 1.00 0.00 H new ATOM 1492 N ASN A 106 -14.434 -22.079 0.746 1.00 0.00 N ATOM 1493 CA ASN A 106 -13.278 -21.202 0.938 1.00 0.00 C ATOM 1494 C ASN A 106 -12.558 -20.986 -0.389 1.00 0.00 C ATOM 1495 O ASN A 106 -12.011 -19.914 -0.653 1.00 0.00 O ATOM 1496 CB ASN A 106 -12.315 -21.807 1.971 1.00 0.00 C ATOM 1497 CG ASN A 106 -11.112 -20.920 2.267 1.00 0.00 C ATOM 1498 OD1 ASN A 106 -11.194 -19.690 2.229 1.00 0.00 O ATOM 1499 ND2 ASN A 106 -9.984 -21.544 2.571 1.00 0.00 N ATOM 0 H ASN A 106 -14.367 -22.977 1.226 1.00 0.00 H new ATOM 0 HA ASN A 106 -13.628 -20.239 1.310 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -12.858 -21.992 2.898 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -11.964 -22.773 1.608 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -9.144 -21.005 2.784 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -9.955 -22.563 2.592 1.00 0.00 H new ATOM 1506 N ILE A 107 -12.593 -22.008 -1.235 1.00 0.00 N ATOM 1507 CA ILE A 107 -11.933 -21.958 -2.529 1.00 0.00 C ATOM 1508 C ILE A 107 -12.664 -21.021 -3.487 1.00 0.00 C ATOM 1509 O ILE A 107 -12.079 -20.058 -3.987 1.00 0.00 O ATOM 1510 CB ILE A 107 -11.837 -23.359 -3.165 1.00 0.00 C ATOM 1511 CG1 ILE A 107 -11.125 -24.329 -2.215 1.00 0.00 C ATOM 1512 CG2 ILE A 107 -11.109 -23.291 -4.505 1.00 0.00 C ATOM 1513 CD1 ILE A 107 -11.063 -25.754 -2.725 1.00 0.00 C ATOM 0 H ILE A 107 -13.075 -22.886 -1.044 1.00 0.00 H new ATOM 0 HA ILE A 107 -10.926 -21.577 -2.356 1.00 0.00 H new ATOM 0 HB ILE A 107 -12.847 -23.728 -3.342 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -10.110 -23.972 -2.040 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -11.636 -24.320 -1.252 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -11.051 -24.289 -4.939 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -11.653 -22.632 -5.182 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -10.102 -22.903 -4.353 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -10.545 -26.379 -1.997 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -12.075 -26.132 -2.872 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -10.525 -25.778 -3.673 1.00 0.00 H new ATOM 1525 N TRP A 108 -13.948 -21.292 -3.722 1.00 0.00 N ATOM 1526 CA TRP A 108 -14.719 -20.541 -4.708 1.00 0.00 C ATOM 1527 C TRP A 108 -14.784 -19.062 -4.338 1.00 0.00 C ATOM 1528 O TRP A 108 -14.595 -18.192 -5.191 1.00 0.00 O ATOM 1529 CB TRP A 108 -16.138 -21.112 -4.848 1.00 0.00 C ATOM 1530 CG TRP A 108 -16.975 -20.372 -5.852 1.00 0.00 C ATOM 1531 CD1 TRP A 108 -17.086 -20.635 -7.186 1.00 0.00 C ATOM 1532 CD2 TRP A 108 -17.813 -19.237 -5.598 1.00 0.00 C ATOM 1533 NE1 TRP A 108 -17.936 -19.729 -7.777 1.00 0.00 N ATOM 1534 CE2 TRP A 108 -18.395 -18.861 -6.820 1.00 0.00 C ATOM 1535 CE3 TRP A 108 -18.121 -18.504 -4.451 1.00 0.00 C ATOM 1536 CZ2 TRP A 108 -19.271 -17.783 -6.924 1.00 0.00 C ATOM 1537 CZ3 TRP A 108 -18.986 -17.437 -4.555 1.00 0.00 C ATOM 1538 CH2 TRP A 108 -19.552 -17.084 -5.780 1.00 0.00 C ATOM 0 H TRP A 108 -14.473 -22.024 -3.244 1.00 0.00 H new ATOM 0 HA TRP A 108 -14.211 -20.637 -5.667 1.00 0.00 H new ATOM 0 HB2 TRP A 108 -16.074 -22.160 -5.139 1.00 0.00 H new ATOM 0 HB3 TRP A 108 -16.633 -21.081 -3.877 1.00 0.00 H new ATOM 0 HD1 TRP A 108 -16.580 -21.437 -7.703 1.00 0.00 H new ATOM 0 HE1 TRP A 108 -18.184 -19.707 -8.766 1.00 0.00 H new ATOM 0 HE3 TRP A 108 -17.688 -18.769 -3.498 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 -19.712 -17.509 -7.871 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 -19.230 -16.864 -3.673 1.00 0.00 H new ATOM 0 HH2 TRP A 108 -20.226 -16.242 -5.828 1.00 0.00 H new ATOM 1549 N LEU A 109 -15.044 -18.785 -3.067 1.00 0.00 N ATOM 1550 CA LEU A 109 -15.120 -17.412 -2.584 1.00 0.00 C ATOM 1551 C LEU A 109 -13.800 -16.690 -2.807 1.00 0.00 C ATOM 1552 O LEU A 109 -13.780 -15.518 -3.165 1.00 0.00 O ATOM 1553 CB LEU A 109 -15.473 -17.369 -1.095 1.00 0.00 C ATOM 1554 CG LEU A 109 -16.955 -17.168 -0.761 1.00 0.00 C ATOM 1555 CD1 LEU A 109 -17.769 -18.404 -1.106 1.00 0.00 C ATOM 1556 CD2 LEU A 109 -17.112 -16.814 0.708 1.00 0.00 C ATOM 0 H LEU A 109 -15.206 -19.493 -2.351 1.00 0.00 H new ATOM 0 HA LEU A 109 -15.906 -16.911 -3.148 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -15.141 -18.300 -0.636 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -14.904 -16.564 -0.630 1.00 0.00 H new ATOM 0 HG LEU A 109 -17.335 -16.344 -1.365 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -18.816 -18.231 -0.858 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -17.679 -18.613 -2.172 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -17.397 -19.255 -0.536 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -18.168 -16.673 0.937 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -16.712 -17.621 1.322 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -16.568 -15.893 0.921 1.00 0.00 H new ATOM 1568 N HIS A 110 -12.695 -17.400 -2.612 1.00 0.00 N ATOM 1569 CA HIS A 110 -11.374 -16.801 -2.745 1.00 0.00 C ATOM 1570 C HIS A 110 -11.096 -16.432 -4.201 1.00 0.00 C ATOM 1571 O HIS A 110 -10.287 -15.552 -4.486 1.00 0.00 O ATOM 1572 CB HIS A 110 -10.294 -17.754 -2.225 1.00 0.00 C ATOM 1573 CG HIS A 110 -8.948 -17.114 -2.059 1.00 0.00 C ATOM 1574 ND1 HIS A 110 -7.876 -17.377 -2.885 1.00 0.00 N ATOM 1575 CD2 HIS A 110 -8.503 -16.225 -1.142 1.00 0.00 C ATOM 1576 CE1 HIS A 110 -6.830 -16.677 -2.482 1.00 0.00 C ATOM 1577 NE2 HIS A 110 -7.185 -15.969 -1.425 1.00 0.00 N ATOM 0 H HIS A 110 -12.688 -18.389 -2.362 1.00 0.00 H new ATOM 0 HA HIS A 110 -11.351 -15.891 -2.145 1.00 0.00 H new ATOM 0 HB2 HIS A 110 -10.613 -18.160 -1.265 1.00 0.00 H new ATOM 0 HB3 HIS A 110 -10.203 -18.595 -2.913 1.00 0.00 H new ATOM 0 HD2 HIS A 110 -9.079 -15.796 -0.336 1.00 0.00 H new ATOM 0 HE1 HIS A 110 -5.852 -16.683 -2.939 1.00 0.00 H new ATOM 0 HE2 HIS A 110 -6.579 -15.335 -0.904 1.00 0.00 H new ATOM 1586 N LYS A 111 -11.772 -17.116 -5.112 1.00 0.00 N ATOM 1587 CA LYS A 111 -11.656 -16.832 -6.536 1.00 0.00 C ATOM 1588 C LYS A 111 -12.499 -15.614 -6.901 1.00 0.00 C ATOM 1589 O LYS A 111 -12.017 -14.656 -7.508 1.00 0.00 O ATOM 1590 CB LYS A 111 -12.150 -18.030 -7.352 1.00 0.00 C ATOM 1591 CG LYS A 111 -11.520 -19.356 -6.956 1.00 0.00 C ATOM 1592 CD LYS A 111 -10.299 -19.695 -7.795 1.00 0.00 C ATOM 1593 CE LYS A 111 -10.671 -19.902 -9.254 1.00 0.00 C ATOM 1594 NZ LYS A 111 -9.685 -20.757 -9.961 1.00 0.00 N ATOM 0 H LYS A 111 -12.412 -17.878 -4.888 1.00 0.00 H new ATOM 0 HA LYS A 111 -10.608 -16.636 -6.762 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -13.232 -18.108 -7.244 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -11.948 -17.845 -8.407 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -11.235 -19.319 -5.904 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -12.259 -20.151 -7.059 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -9.566 -18.892 -7.715 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -9.827 -20.597 -7.406 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -11.658 -20.360 -9.315 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -10.736 -18.935 -9.753 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -9.975 -20.874 -10.953 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -8.747 -20.308 -9.925 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -9.641 -21.689 -9.501 1.00 0.00 H new ATOM 1608 N GLN A 112 -13.762 -15.663 -6.496 1.00 0.00 N ATOM 1609 CA GLN A 112 -14.748 -14.675 -6.906 1.00 0.00 C ATOM 1610 C GLN A 112 -14.441 -13.296 -6.321 1.00 0.00 C ATOM 1611 O GLN A 112 -14.478 -12.294 -7.035 1.00 0.00 O ATOM 1612 CB GLN A 112 -16.148 -15.138 -6.493 1.00 0.00 C ATOM 1613 CG GLN A 112 -17.261 -14.420 -7.236 1.00 0.00 C ATOM 1614 CD GLN A 112 -17.178 -14.615 -8.738 1.00 0.00 C ATOM 1615 OE1 GLN A 112 -17.521 -13.720 -9.505 1.00 0.00 O ATOM 1616 NE2 GLN A 112 -16.742 -15.789 -9.167 1.00 0.00 N ATOM 0 H GLN A 112 -14.129 -16.386 -5.877 1.00 0.00 H new ATOM 0 HA GLN A 112 -14.707 -14.582 -7.991 1.00 0.00 H new ATOM 0 HB2 GLN A 112 -16.235 -16.210 -6.669 1.00 0.00 H new ATOM 0 HB3 GLN A 112 -16.274 -14.980 -5.422 1.00 0.00 H new ATOM 0 HG2 GLN A 112 -18.225 -14.783 -6.879 1.00 0.00 H new ATOM 0 HG3 GLN A 112 -17.217 -13.355 -7.008 1.00 0.00 H new ATOM 0 HE21 GLN A 112 -16.466 -16.507 -8.497 1.00 0.00 H new ATOM 0 HE22 GLN A 112 -16.682 -15.976 -10.168 1.00 0.00 H new ATOM 1625 N VAL A 113 -14.136 -13.249 -5.027 1.00 0.00 N ATOM 1626 CA VAL A 113 -13.762 -11.998 -4.373 1.00 0.00 C ATOM 1627 C VAL A 113 -12.501 -11.423 -5.005 1.00 0.00 C ATOM 1628 O VAL A 113 -12.377 -10.212 -5.165 1.00 0.00 O ATOM 1629 CB VAL A 113 -13.528 -12.184 -2.856 1.00 0.00 C ATOM 1630 CG1 VAL A 113 -13.095 -10.876 -2.202 1.00 0.00 C ATOM 1631 CG2 VAL A 113 -14.777 -12.720 -2.177 1.00 0.00 C ATOM 0 H VAL A 113 -14.140 -14.062 -4.411 1.00 0.00 H new ATOM 0 HA VAL A 113 -14.595 -11.308 -4.509 1.00 0.00 H new ATOM 0 HB VAL A 113 -12.726 -12.911 -2.733 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -12.938 -11.037 -1.135 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -12.167 -10.531 -2.658 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -13.871 -10.124 -2.345 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -14.587 -12.842 -1.111 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -15.599 -12.019 -2.321 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -15.042 -13.684 -2.611 1.00 0.00 H new ATOM 1641 N MET A 114 -11.585 -12.302 -5.393 1.00 0.00 N ATOM 1642 CA MET A 114 -10.322 -11.879 -5.985 1.00 0.00 C ATOM 1643 C MET A 114 -10.581 -11.110 -7.274 1.00 0.00 C ATOM 1644 O MET A 114 -9.943 -10.093 -7.547 1.00 0.00 O ATOM 1645 CB MET A 114 -9.440 -13.094 -6.277 1.00 0.00 C ATOM 1646 CG MET A 114 -7.973 -12.762 -6.487 1.00 0.00 C ATOM 1647 SD MET A 114 -7.175 -12.187 -4.973 1.00 0.00 S ATOM 1648 CE MET A 114 -5.476 -12.059 -5.519 1.00 0.00 C ATOM 0 H MET A 114 -11.693 -13.313 -5.308 1.00 0.00 H new ATOM 0 HA MET A 114 -9.807 -11.229 -5.278 1.00 0.00 H new ATOM 0 HB2 MET A 114 -9.527 -13.799 -5.450 1.00 0.00 H new ATOM 0 HB3 MET A 114 -9.818 -13.598 -7.167 1.00 0.00 H new ATOM 0 HG2 MET A 114 -7.452 -13.646 -6.856 1.00 0.00 H new ATOM 0 HG3 MET A 114 -7.883 -11.995 -7.256 1.00 0.00 H new ATOM 0 HE1 MET A 114 -4.935 -11.372 -4.868 1.00 0.00 H new ATOM 0 HE2 MET A 114 -5.006 -13.042 -5.480 1.00 0.00 H new ATOM 0 HE3 MET A 114 -5.450 -11.685 -6.542 1.00 0.00 H new ATOM 1658 N SER A 115 -11.557 -11.586 -8.041 1.00 0.00 N ATOM 1659 CA SER A 115 -11.902 -10.980 -9.321 1.00 0.00 C ATOM 1660 C SER A 115 -12.565 -9.615 -9.120 1.00 0.00 C ATOM 1661 O SER A 115 -12.585 -8.782 -10.021 1.00 0.00 O ATOM 1662 CB SER A 115 -12.830 -11.916 -10.098 1.00 0.00 C ATOM 1663 OG SER A 115 -12.277 -13.221 -10.186 1.00 0.00 O ATOM 0 H SER A 115 -12.126 -12.396 -7.795 1.00 0.00 H new ATOM 0 HA SER A 115 -10.987 -10.825 -9.893 1.00 0.00 H new ATOM 0 HB2 SER A 115 -13.802 -11.961 -9.607 1.00 0.00 H new ATOM 0 HB3 SER A 115 -12.997 -11.519 -11.099 1.00 0.00 H new ATOM 0 HG SER A 115 -12.327 -13.657 -9.310 1.00 0.00 H new ATOM 1669 N LYS A 116 -13.099 -9.393 -7.925 1.00 0.00 N ATOM 1670 CA LYS A 116 -13.738 -8.127 -7.583 1.00 0.00 C ATOM 1671 C LYS A 116 -12.734 -7.174 -6.937 1.00 0.00 C ATOM 1672 O LYS A 116 -12.973 -5.971 -6.847 1.00 0.00 O ATOM 1673 CB LYS A 116 -14.905 -8.361 -6.614 1.00 0.00 C ATOM 1674 CG LYS A 116 -16.274 -8.525 -7.267 1.00 0.00 C ATOM 1675 CD LYS A 116 -16.346 -9.721 -8.203 1.00 0.00 C ATOM 1676 CE LYS A 116 -17.793 -10.059 -8.531 1.00 0.00 C ATOM 1677 NZ LYS A 116 -17.917 -11.052 -9.630 1.00 0.00 N ATOM 0 H LYS A 116 -13.102 -10.079 -7.170 1.00 0.00 H new ATOM 0 HA LYS A 116 -14.114 -7.682 -8.504 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -14.693 -9.253 -6.025 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -14.951 -7.523 -5.918 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -17.031 -8.633 -6.490 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -16.516 -7.620 -7.824 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -15.801 -9.504 -9.121 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -15.862 -10.581 -7.740 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -18.282 -10.449 -7.638 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -18.320 -9.147 -8.810 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -18.891 -11.046 -9.995 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -17.258 -10.806 -10.396 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -17.689 -12.000 -9.269 1.00 0.00 H new ATOM 1691 N LEU A 117 -11.609 -7.724 -6.502 1.00 0.00 N ATOM 1692 CA LEU A 117 -10.643 -6.972 -5.712 1.00 0.00 C ATOM 1693 C LEU A 117 -9.461 -6.508 -6.557 1.00 0.00 C ATOM 1694 O LEU A 117 -9.353 -5.328 -6.892 1.00 0.00 O ATOM 1695 CB LEU A 117 -10.146 -7.831 -4.544 1.00 0.00 C ATOM 1696 CG LEU A 117 -9.163 -7.144 -3.594 1.00 0.00 C ATOM 1697 CD1 LEU A 117 -9.826 -5.968 -2.895 1.00 0.00 C ATOM 1698 CD2 LEU A 117 -8.630 -8.140 -2.576 1.00 0.00 C ATOM 0 H LEU A 117 -11.342 -8.692 -6.683 1.00 0.00 H new ATOM 0 HA LEU A 117 -11.145 -6.084 -5.328 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -11.009 -8.164 -3.968 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -9.669 -8.724 -4.949 1.00 0.00 H new ATOM 0 HG LEU A 117 -8.325 -6.764 -4.179 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -9.110 -5.493 -2.224 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -10.161 -5.245 -3.638 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -10.682 -6.322 -2.321 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -7.932 -7.638 -1.907 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -9.459 -8.547 -1.997 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -8.117 -8.950 -3.094 1.00 0.00 H new ATOM 1710 N VAL A 118 -8.588 -7.441 -6.926 1.00 0.00 N ATOM 1711 CA VAL A 118 -7.334 -7.092 -7.592 1.00 0.00 C ATOM 1712 C VAL A 118 -7.566 -6.552 -9.001 1.00 0.00 C ATOM 1713 O VAL A 118 -6.694 -5.904 -9.572 1.00 0.00 O ATOM 1714 CB VAL A 118 -6.352 -8.282 -7.643 1.00 0.00 C ATOM 1715 CG1 VAL A 118 -5.885 -8.640 -6.242 1.00 0.00 C ATOM 1716 CG2 VAL A 118 -6.988 -9.486 -8.325 1.00 0.00 C ATOM 0 H VAL A 118 -8.724 -8.441 -6.777 1.00 0.00 H new ATOM 0 HA VAL A 118 -6.884 -6.303 -6.990 1.00 0.00 H new ATOM 0 HB VAL A 118 -5.484 -7.985 -8.232 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -5.193 -9.481 -6.293 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -5.382 -7.782 -5.796 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -6.745 -8.914 -5.631 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -6.275 -10.310 -8.348 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -7.877 -9.790 -7.772 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -7.268 -9.221 -9.344 1.00 0.00 H new ATOM 1726 N ALA A 119 -8.757 -6.783 -9.542 1.00 0.00 N ATOM 1727 CA ALA A 119 -9.098 -6.280 -10.869 1.00 0.00 C ATOM 1728 C ALA A 119 -9.265 -4.763 -10.848 1.00 0.00 C ATOM 1729 O ALA A 119 -9.406 -4.128 -11.890 1.00 0.00 O ATOM 1730 CB ALA A 119 -10.362 -6.947 -11.386 1.00 0.00 C ATOM 0 H ALA A 119 -9.500 -7.313 -9.085 1.00 0.00 H new ATOM 0 HA ALA A 119 -8.278 -6.524 -11.544 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -10.599 -6.559 -12.376 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -10.206 -8.024 -11.446 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -11.188 -6.737 -10.706 1.00 0.00 H new ATOM 1736 N ASN A 120 -9.242 -4.184 -9.650 1.00 0.00 N ATOM 1737 CA ASN A 120 -9.374 -2.738 -9.493 1.00 0.00 C ATOM 1738 C ASN A 120 -8.013 -2.058 -9.584 1.00 0.00 C ATOM 1739 O ASN A 120 -7.911 -0.838 -9.451 1.00 0.00 O ATOM 1740 CB ASN A 120 -10.027 -2.379 -8.152 1.00 0.00 C ATOM 1741 CG ASN A 120 -11.491 -2.782 -8.047 1.00 0.00 C ATOM 1742 OD1 ASN A 120 -12.291 -2.081 -7.427 1.00 0.00 O ATOM 1743 ND2 ASN A 120 -11.855 -3.905 -8.642 1.00 0.00 N ATOM 0 H ASN A 120 -9.133 -4.694 -8.774 1.00 0.00 H new ATOM 0 HA ASN A 120 -10.012 -2.383 -10.302 1.00 0.00 H new ATOM 0 HB2 ASN A 120 -9.470 -2.861 -7.348 1.00 0.00 H new ATOM 0 HB3 ASN A 120 -9.945 -1.303 -7.997 1.00 0.00 H new ATOM 0 HD21 ASN A 120 -12.826 -4.215 -8.596 1.00 0.00 H new ATOM 0 HD22 ASN A 120 -11.165 -4.461 -9.147 1.00 0.00 H new ATOM 1750 N GLY A 121 -6.970 -2.847 -9.811 1.00 0.00 N ATOM 1751 CA GLY A 121 -5.628 -2.302 -9.886 1.00 0.00 C ATOM 1752 C GLY A 121 -4.724 -2.850 -8.800 1.00 0.00 C ATOM 1753 O GLY A 121 -3.678 -2.270 -8.496 1.00 0.00 O ATOM 0 H GLY A 121 -7.030 -3.856 -9.945 1.00 0.00 H new ATOM 0 HA2 GLY A 121 -5.199 -2.530 -10.862 1.00 0.00 H new ATOM 0 HA3 GLY A 121 -5.674 -1.216 -9.804 1.00 0.00 H new ATOM 1757 N GLY A 122 -5.133 -3.966 -8.212 1.00 0.00 N ATOM 1758 CA GLY A 122 -4.346 -4.598 -7.178 1.00 0.00 C ATOM 1759 C GLY A 122 -3.296 -5.541 -7.739 1.00 0.00 C ATOM 1760 O GLY A 122 -3.590 -6.388 -8.583 1.00 0.00 O ATOM 0 H GLY A 122 -6.004 -4.447 -8.437 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -3.857 -3.830 -6.578 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -5.007 -5.151 -6.510 1.00 0.00 H new ATOM 1764 N LYS A 123 -2.077 -5.378 -7.269 1.00 0.00 N ATOM 1765 CA LYS A 123 -0.958 -6.217 -7.651 1.00 0.00 C ATOM 1766 C LYS A 123 -0.749 -7.302 -6.601 1.00 0.00 C ATOM 1767 O LYS A 123 -0.803 -7.030 -5.400 1.00 0.00 O ATOM 1768 CB LYS A 123 0.305 -5.357 -7.763 1.00 0.00 C ATOM 1769 CG LYS A 123 1.587 -6.155 -7.920 1.00 0.00 C ATOM 1770 CD LYS A 123 2.802 -5.328 -7.530 1.00 0.00 C ATOM 1771 CE LYS A 123 4.058 -6.175 -7.471 1.00 0.00 C ATOM 1772 NZ LYS A 123 5.164 -5.467 -6.776 1.00 0.00 N ATOM 0 H LYS A 123 -1.831 -4.648 -6.601 1.00 0.00 H new ATOM 0 HA LYS A 123 -1.166 -6.686 -8.613 1.00 0.00 H new ATOM 0 HB2 LYS A 123 0.200 -4.686 -8.616 1.00 0.00 H new ATOM 0 HB3 LYS A 123 0.386 -4.732 -6.874 1.00 0.00 H new ATOM 0 HG2 LYS A 123 1.539 -7.050 -7.300 1.00 0.00 H new ATOM 0 HG3 LYS A 123 1.687 -6.488 -8.953 1.00 0.00 H new ATOM 0 HD2 LYS A 123 2.940 -4.521 -8.250 1.00 0.00 H new ATOM 0 HD3 LYS A 123 2.630 -4.863 -6.559 1.00 0.00 H new ATOM 0 HE2 LYS A 123 3.843 -7.110 -6.954 1.00 0.00 H new ATOM 0 HE3 LYS A 123 4.370 -6.434 -8.483 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 6.042 -6.016 -6.872 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 5.295 -4.527 -7.201 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 4.930 -5.362 -5.768 1.00 0.00 H new ATOM 1786 N LEU A 124 -0.523 -8.525 -7.051 1.00 0.00 N ATOM 1787 CA LEU A 124 -0.262 -9.627 -6.146 1.00 0.00 C ATOM 1788 C LEU A 124 0.919 -10.455 -6.641 1.00 0.00 C ATOM 1789 O LEU A 124 1.157 -10.552 -7.847 1.00 0.00 O ATOM 1790 CB LEU A 124 -1.529 -10.502 -5.902 1.00 0.00 C ATOM 1791 CG LEU A 124 -2.287 -11.112 -7.115 1.00 0.00 C ATOM 1792 CD1 LEU A 124 -2.836 -10.047 -8.054 1.00 0.00 C ATOM 1793 CD2 LEU A 124 -1.436 -12.116 -7.880 1.00 0.00 C ATOM 0 H LEU A 124 -0.515 -8.778 -8.039 1.00 0.00 H new ATOM 0 HA LEU A 124 0.005 -9.206 -5.177 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -1.235 -11.327 -5.253 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -2.242 -9.895 -5.344 1.00 0.00 H new ATOM 0 HG LEU A 124 -3.138 -11.648 -6.694 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -3.356 -10.526 -8.884 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -3.531 -9.407 -7.511 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -2.014 -9.444 -8.441 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -2.008 -12.515 -8.718 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -0.540 -11.622 -8.255 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -1.150 -12.931 -7.216 1.00 0.00 H new ATOM 1805 N PRO A 125 1.714 -11.005 -5.708 1.00 0.00 N ATOM 1806 CA PRO A 125 2.817 -11.915 -6.036 1.00 0.00 C ATOM 1807 C PRO A 125 2.322 -13.157 -6.778 1.00 0.00 C ATOM 1808 O PRO A 125 1.167 -13.559 -6.617 1.00 0.00 O ATOM 1809 CB PRO A 125 3.392 -12.296 -4.664 1.00 0.00 C ATOM 1810 CG PRO A 125 2.960 -11.200 -3.754 1.00 0.00 C ATOM 1811 CD PRO A 125 1.620 -10.757 -4.262 1.00 0.00 C ATOM 0 HA PRO A 125 3.551 -11.454 -6.697 1.00 0.00 H new ATOM 0 HB2 PRO A 125 3.011 -13.261 -4.330 1.00 0.00 H new ATOM 0 HB3 PRO A 125 4.478 -12.376 -4.699 1.00 0.00 H new ATOM 0 HG2 PRO A 125 2.892 -11.550 -2.724 1.00 0.00 H new ATOM 0 HG3 PRO A 125 3.675 -10.377 -3.765 1.00 0.00 H new ATOM 0 HD2 PRO A 125 0.808 -11.325 -3.807 1.00 0.00 H new ATOM 0 HD3 PRO A 125 1.434 -9.705 -4.044 1.00 0.00 H new ATOM 1819 N PRO A 126 3.196 -13.786 -7.582 1.00 0.00 N ATOM 1820 CA PRO A 126 2.841 -14.937 -8.435 1.00 0.00 C ATOM 1821 C PRO A 126 2.544 -16.222 -7.648 1.00 0.00 C ATOM 1822 O PRO A 126 2.876 -17.323 -8.090 1.00 0.00 O ATOM 1823 CB PRO A 126 4.089 -15.139 -9.311 1.00 0.00 C ATOM 1824 CG PRO A 126 4.917 -13.912 -9.126 1.00 0.00 C ATOM 1825 CD PRO A 126 4.608 -13.415 -7.746 1.00 0.00 C ATOM 0 HA PRO A 126 1.925 -14.736 -8.991 1.00 0.00 H new ATOM 0 HB2 PRO A 126 4.638 -16.031 -9.010 1.00 0.00 H new ATOM 0 HB3 PRO A 126 3.815 -15.272 -10.358 1.00 0.00 H new ATOM 0 HG2 PRO A 126 5.978 -14.137 -9.232 1.00 0.00 H new ATOM 0 HG3 PRO A 126 4.674 -13.159 -9.876 1.00 0.00 H new ATOM 0 HD2 PRO A 126 5.241 -13.886 -6.994 1.00 0.00 H new ATOM 0 HD3 PRO A 126 4.757 -12.339 -7.660 1.00 0.00 H new