USER MOD reduce.3.24.130724 H: found=0, std=0, add=817, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 817 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 44 SER OG : rot -86:sc= -0.174! USER MOD Set 1.2: A 95 LYS NZ :NH3+ 150:sc= 0.106 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0157) USER MOD Single : A 4 GLN : amide:sc= 0 X(o=0,f=-0.02) USER MOD Single : A 7 SER OG : rot 180:sc= -0.0562 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 GLN : amide:sc= -1.9! K(o=-1.9!,f=-0.75) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0129) USER MOD Single : A 43 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 46 SER OG : rot -100:sc= -0.871 USER MOD Single : A 48 LYS NZ :NH3+ -162:sc= 0.0154 (180deg=0.000432) USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 50 SER OG : rot 60:sc= 0.258 USER MOD Single : A 51 ASN : amide:sc= -0.103 K(o=-0.1,f=-1!) USER MOD Single : A 63 GLN : amide:sc= 0 X(o=0,f=-0.44) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 TYR OH : rot -78:sc= 0.856 USER MOD Single : A 76 THR OG1 : rot -50:sc= -2.62 USER MOD Single : A 81 LYS NZ :NH3+ -165:sc= 0 (180deg=-0.144) USER MOD Single : A 82 ASN : amide:sc= -0.298 X(o=-0.3,f=-0.042) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 97 GLN : amide:sc= -1.1 X(o=-1.1,f=-1.2) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 ASN : amide:sc= -0.418 K(o=-0.42,f=-2.1!) USER MOD ----------------------------------------------------------------- ATOM 20 N VAL A 2 0.414 -4.342 -2.488 1.00 0.00 N ATOM 21 CA VAL A 2 -0.972 -4.057 -2.834 1.00 0.00 C ATOM 22 C VAL A 2 -1.092 -3.597 -4.279 1.00 0.00 C ATOM 23 O VAL A 2 -0.210 -2.917 -4.801 1.00 0.00 O ATOM 24 CB VAL A 2 -1.578 -2.979 -1.909 1.00 0.00 C ATOM 25 CG1 VAL A 2 -3.061 -2.778 -2.206 1.00 0.00 C ATOM 26 CG2 VAL A 2 -1.369 -3.351 -0.449 1.00 0.00 C ATOM 0 HA VAL A 2 -1.526 -4.986 -2.703 1.00 0.00 H new ATOM 0 HB VAL A 2 -1.064 -2.037 -2.102 1.00 0.00 H new ATOM 0 HG11 VAL A 2 -3.465 -2.014 -1.542 1.00 0.00 H new ATOM 0 HG12 VAL A 2 -3.185 -2.461 -3.241 1.00 0.00 H new ATOM 0 HG13 VAL A 2 -3.594 -3.715 -2.047 1.00 0.00 H new ATOM 0 HG21 VAL A 2 -1.802 -2.580 0.188 1.00 0.00 H new ATOM 0 HG22 VAL A 2 -1.853 -4.306 -0.244 1.00 0.00 H new ATOM 0 HG23 VAL A 2 -0.302 -3.434 -0.244 1.00 0.00 H new ATOM 36 N LYS A 3 -2.186 -3.982 -4.924 1.00 0.00 N ATOM 37 CA LYS A 3 -2.412 -3.616 -6.308 1.00 0.00 C ATOM 38 C LYS A 3 -3.887 -3.354 -6.550 1.00 0.00 C ATOM 39 O LYS A 3 -4.734 -4.218 -6.327 1.00 0.00 O ATOM 40 CB LYS A 3 -1.923 -4.726 -7.243 1.00 0.00 C ATOM 41 CG LYS A 3 -2.246 -6.130 -6.751 1.00 0.00 C ATOM 42 CD LYS A 3 -0.983 -6.916 -6.430 1.00 0.00 C ATOM 43 CE LYS A 3 -0.612 -7.866 -7.558 1.00 0.00 C ATOM 44 NZ LYS A 3 -0.315 -7.140 -8.823 1.00 0.00 N ATOM 0 H LYS A 3 -2.927 -4.546 -4.508 1.00 0.00 H new ATOM 0 HA LYS A 3 -1.850 -2.706 -6.517 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -2.371 -4.584 -8.226 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -0.844 -4.634 -7.368 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -2.873 -6.069 -5.862 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -2.821 -6.659 -7.511 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -0.160 -6.225 -6.250 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -1.130 -7.482 -5.510 1.00 0.00 H new ATOM 0 HE2 LYS A 3 0.257 -8.455 -7.265 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -1.430 -8.567 -7.726 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 0.031 -7.813 -9.536 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -1.181 -6.681 -9.171 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 0.413 -6.418 -8.646 1.00 0.00 H new ATOM 58 N GLN A 4 -4.188 -2.146 -6.998 1.00 0.00 N ATOM 59 CA GLN A 4 -5.560 -1.760 -7.266 1.00 0.00 C ATOM 60 C GLN A 4 -6.045 -2.414 -8.560 1.00 0.00 C ATOM 61 O GLN A 4 -5.394 -2.312 -9.600 1.00 0.00 O ATOM 62 CB GLN A 4 -5.668 -0.235 -7.359 1.00 0.00 C ATOM 63 CG GLN A 4 -7.060 0.265 -7.712 1.00 0.00 C ATOM 64 CD GLN A 4 -7.519 1.397 -6.810 1.00 0.00 C ATOM 65 OE1 GLN A 4 -6.788 2.360 -6.582 1.00 0.00 O ATOM 66 NE2 GLN A 4 -8.737 1.282 -6.295 1.00 0.00 N ATOM 0 H GLN A 4 -3.499 -1.417 -7.183 1.00 0.00 H new ATOM 0 HA GLN A 4 -6.193 -2.102 -6.447 1.00 0.00 H new ATOM 0 HB2 GLN A 4 -5.368 0.199 -6.405 1.00 0.00 H new ATOM 0 HB3 GLN A 4 -4.963 0.124 -8.109 1.00 0.00 H new ATOM 0 HG2 GLN A 4 -7.069 0.604 -8.748 1.00 0.00 H new ATOM 0 HG3 GLN A 4 -7.768 -0.561 -7.641 1.00 0.00 H new ATOM 0 HE21 GLN A 4 -9.308 0.465 -6.512 1.00 0.00 H new ATOM 0 HE22 GLN A 4 -9.102 2.011 -5.682 1.00 0.00 H new ATOM 75 N ILE A 5 -7.188 -3.085 -8.488 1.00 0.00 N ATOM 76 CA ILE A 5 -7.757 -3.755 -9.654 1.00 0.00 C ATOM 77 C ILE A 5 -8.879 -2.902 -10.255 1.00 0.00 C ATOM 78 O ILE A 5 -9.967 -2.804 -9.688 1.00 0.00 O ATOM 79 CB ILE A 5 -8.280 -5.168 -9.277 1.00 0.00 C ATOM 80 CG1 ILE A 5 -7.124 -6.178 -9.128 1.00 0.00 C ATOM 81 CG2 ILE A 5 -9.276 -5.677 -10.307 1.00 0.00 C ATOM 82 CD1 ILE A 5 -5.737 -5.565 -9.074 1.00 0.00 C ATOM 0 H ILE A 5 -7.740 -3.180 -7.636 1.00 0.00 H new ATOM 0 HA ILE A 5 -6.974 -3.877 -10.402 1.00 0.00 H new ATOM 0 HB ILE A 5 -8.784 -5.075 -8.315 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -7.284 -6.758 -8.219 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -7.163 -6.877 -9.963 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -9.625 -6.668 -10.017 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -10.124 -4.995 -10.361 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -8.794 -5.734 -11.283 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -4.994 -6.355 -8.969 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -5.549 -5.010 -9.993 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -5.671 -4.889 -8.222 1.00 0.00 H new ATOM 94 N GLU A 6 -8.601 -2.288 -11.407 1.00 0.00 N ATOM 95 CA GLU A 6 -9.585 -1.442 -12.084 1.00 0.00 C ATOM 96 C GLU A 6 -10.350 -2.203 -13.167 1.00 0.00 C ATOM 97 O GLU A 6 -10.977 -1.593 -14.035 1.00 0.00 O ATOM 98 CB GLU A 6 -8.904 -0.210 -12.696 1.00 0.00 C ATOM 99 CG GLU A 6 -8.824 0.984 -11.754 1.00 0.00 C ATOM 100 CD GLU A 6 -7.609 1.854 -12.016 1.00 0.00 C ATOM 101 OE1 GLU A 6 -7.200 1.965 -13.192 1.00 0.00 O ATOM 102 OE2 GLU A 6 -7.066 2.426 -11.047 1.00 0.00 O ATOM 0 H GLU A 6 -7.705 -2.361 -11.889 1.00 0.00 H new ATOM 0 HA GLU A 6 -10.305 -1.123 -11.330 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -7.896 -0.482 -13.008 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -9.447 0.084 -13.594 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -9.727 1.586 -11.859 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -8.796 0.628 -10.724 1.00 0.00 H new ATOM 109 N SER A 7 -10.294 -3.528 -13.121 1.00 0.00 N ATOM 110 CA SER A 7 -10.982 -4.355 -14.111 1.00 0.00 C ATOM 111 C SER A 7 -11.291 -5.745 -13.558 1.00 0.00 C ATOM 112 O SER A 7 -10.692 -6.179 -12.572 1.00 0.00 O ATOM 113 CB SER A 7 -10.127 -4.480 -15.375 1.00 0.00 C ATOM 114 OG SER A 7 -8.749 -4.537 -15.054 1.00 0.00 O ATOM 0 H SER A 7 -9.782 -4.054 -12.413 1.00 0.00 H new ATOM 0 HA SER A 7 -11.926 -3.868 -14.355 1.00 0.00 H new ATOM 0 HB2 SER A 7 -10.413 -5.377 -15.924 1.00 0.00 H new ATOM 0 HB3 SER A 7 -10.316 -3.630 -16.031 1.00 0.00 H new ATOM 0 HG SER A 7 -8.224 -4.618 -15.878 1.00 0.00 H new ATOM 120 N LYS A 8 -12.221 -6.448 -14.205 1.00 0.00 N ATOM 121 CA LYS A 8 -12.594 -7.793 -13.777 1.00 0.00 C ATOM 122 C LYS A 8 -11.491 -8.793 -14.116 1.00 0.00 C ATOM 123 O LYS A 8 -11.369 -9.837 -13.476 1.00 0.00 O ATOM 124 CB LYS A 8 -13.915 -8.224 -14.428 1.00 0.00 C ATOM 125 CG LYS A 8 -14.372 -9.618 -14.017 1.00 0.00 C ATOM 126 CD LYS A 8 -14.536 -10.532 -15.222 1.00 0.00 C ATOM 127 CE LYS A 8 -14.494 -12.000 -14.823 1.00 0.00 C ATOM 128 NZ LYS A 8 -13.113 -12.556 -14.884 1.00 0.00 N ATOM 0 H LYS A 8 -12.727 -6.109 -15.023 1.00 0.00 H new ATOM 0 HA LYS A 8 -12.729 -7.776 -12.695 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -14.691 -7.505 -14.166 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -13.803 -8.192 -15.512 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -13.647 -10.051 -13.328 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -15.319 -9.548 -13.481 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -15.483 -10.316 -15.717 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -13.745 -10.328 -15.944 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -14.886 -12.112 -13.812 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -15.145 -12.574 -15.483 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -13.129 -13.558 -14.605 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -12.748 -12.473 -15.854 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -12.496 -12.026 -14.236 1.00 0.00 H new ATOM 142 N THR A 9 -10.681 -8.462 -15.120 1.00 0.00 N ATOM 143 CA THR A 9 -9.583 -9.330 -15.533 1.00 0.00 C ATOM 144 C THR A 9 -8.392 -9.167 -14.596 1.00 0.00 C ATOM 145 O THR A 9 -7.643 -10.114 -14.356 1.00 0.00 O ATOM 146 CB THR A 9 -9.158 -9.020 -16.969 1.00 0.00 C ATOM 147 OG1 THR A 9 -10.255 -8.544 -17.727 1.00 0.00 O ATOM 148 CG2 THR A 9 -8.588 -10.222 -17.690 1.00 0.00 C ATOM 0 H THR A 9 -10.765 -7.601 -15.660 1.00 0.00 H new ATOM 0 HA THR A 9 -9.933 -10.361 -15.486 1.00 0.00 H new ATOM 0 HB THR A 9 -8.381 -8.260 -16.885 1.00 0.00 H new ATOM 0 HG1 THR A 9 -9.961 -8.350 -18.642 1.00 0.00 H new ATOM 0 HG21 THR A 9 -8.305 -9.938 -18.704 1.00 0.00 H new ATOM 0 HG22 THR A 9 -7.709 -10.584 -17.156 1.00 0.00 H new ATOM 0 HG23 THR A 9 -9.338 -11.012 -17.731 1.00 0.00 H new ATOM 156 N ALA A 10 -8.223 -7.958 -14.072 1.00 0.00 N ATOM 157 CA ALA A 10 -7.122 -7.670 -13.164 1.00 0.00 C ATOM 158 C ALA A 10 -7.277 -8.446 -11.862 1.00 0.00 C ATOM 159 O ALA A 10 -6.303 -8.966 -11.320 1.00 0.00 O ATOM 160 CB ALA A 10 -7.042 -6.176 -12.888 1.00 0.00 C ATOM 0 H ALA A 10 -8.834 -7.163 -14.261 1.00 0.00 H new ATOM 0 HA ALA A 10 -6.194 -7.987 -13.639 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -6.214 -5.975 -12.208 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -6.880 -5.641 -13.824 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -7.974 -5.839 -12.434 1.00 0.00 H new ATOM 166 N PHE A 11 -8.509 -8.541 -11.369 1.00 0.00 N ATOM 167 CA PHE A 11 -8.775 -9.265 -10.130 1.00 0.00 C ATOM 168 C PHE A 11 -8.290 -10.707 -10.253 1.00 0.00 C ATOM 169 O PHE A 11 -7.662 -11.242 -9.340 1.00 0.00 O ATOM 170 CB PHE A 11 -10.271 -9.218 -9.790 1.00 0.00 C ATOM 171 CG PHE A 11 -10.565 -9.487 -8.340 1.00 0.00 C ATOM 172 CD1 PHE A 11 -9.807 -8.887 -7.346 1.00 0.00 C ATOM 173 CD2 PHE A 11 -11.590 -10.342 -7.969 1.00 0.00 C ATOM 174 CE1 PHE A 11 -10.064 -9.135 -6.013 1.00 0.00 C ATOM 175 CE2 PHE A 11 -11.853 -10.593 -6.635 1.00 0.00 C ATOM 176 CZ PHE A 11 -11.088 -9.989 -5.656 1.00 0.00 C ATOM 0 H PHE A 11 -9.334 -8.129 -11.805 1.00 0.00 H new ATOM 0 HA PHE A 11 -8.230 -8.785 -9.317 1.00 0.00 H new ATOM 0 HB2 PHE A 11 -10.666 -8.238 -10.057 1.00 0.00 H new ATOM 0 HB3 PHE A 11 -10.798 -9.951 -10.401 1.00 0.00 H new ATOM 0 HD1 PHE A 11 -9.005 -8.217 -7.619 1.00 0.00 H new ATOM 0 HD2 PHE A 11 -12.190 -10.818 -8.730 1.00 0.00 H new ATOM 0 HE1 PHE A 11 -9.464 -8.661 -5.250 1.00 0.00 H new ATOM 0 HE2 PHE A 11 -12.656 -11.261 -6.359 1.00 0.00 H new ATOM 0 HZ PHE A 11 -11.291 -10.185 -4.613 1.00 0.00 H new ATOM 186 N GLN A 12 -8.555 -11.320 -11.403 1.00 0.00 N ATOM 187 CA GLN A 12 -8.113 -12.686 -11.651 1.00 0.00 C ATOM 188 C GLN A 12 -6.591 -12.724 -11.769 1.00 0.00 C ATOM 189 O GLN A 12 -5.933 -13.589 -11.192 1.00 0.00 O ATOM 190 CB GLN A 12 -8.755 -13.252 -12.921 1.00 0.00 C ATOM 191 CG GLN A 12 -10.253 -13.507 -12.803 1.00 0.00 C ATOM 192 CD GLN A 12 -10.646 -14.261 -11.541 1.00 0.00 C ATOM 193 OE1 GLN A 12 -11.742 -14.071 -11.013 1.00 0.00 O ATOM 194 NE2 GLN A 12 -9.758 -15.117 -11.046 1.00 0.00 N ATOM 0 H GLN A 12 -9.071 -10.894 -12.173 1.00 0.00 H new ATOM 0 HA GLN A 12 -8.426 -13.306 -10.811 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -8.579 -12.559 -13.743 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -8.258 -14.187 -13.180 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -10.778 -12.552 -12.824 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -10.586 -14.073 -13.673 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -8.860 -15.247 -11.512 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -9.974 -15.644 -10.200 1.00 0.00 H new ATOM 203 N GLU A 13 -6.039 -11.771 -12.524 1.00 0.00 N ATOM 204 CA GLU A 13 -4.594 -11.686 -12.727 1.00 0.00 C ATOM 205 C GLU A 13 -3.861 -11.559 -11.397 1.00 0.00 C ATOM 206 O GLU A 13 -2.863 -12.238 -11.159 1.00 0.00 O ATOM 207 CB GLU A 13 -4.254 -10.486 -13.615 1.00 0.00 C ATOM 208 CG GLU A 13 -4.283 -10.796 -15.103 1.00 0.00 C ATOM 209 CD GLU A 13 -4.007 -9.575 -15.959 1.00 0.00 C ATOM 210 OE1 GLU A 13 -2.823 -9.202 -16.097 1.00 0.00 O ATOM 211 OE2 GLU A 13 -4.976 -8.990 -16.489 1.00 0.00 O ATOM 0 H GLU A 13 -6.573 -11.047 -13.005 1.00 0.00 H new ATOM 0 HA GLU A 13 -4.270 -12.604 -13.217 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -4.959 -9.681 -13.407 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -3.263 -10.118 -13.349 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -3.543 -11.565 -15.325 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -5.258 -11.206 -15.366 1.00 0.00 H new ATOM 218 N ALA A 14 -4.366 -10.687 -10.530 1.00 0.00 N ATOM 219 CA ALA A 14 -3.759 -10.477 -9.223 1.00 0.00 C ATOM 220 C ALA A 14 -3.891 -11.728 -8.361 1.00 0.00 C ATOM 221 O ALA A 14 -3.024 -12.025 -7.539 1.00 0.00 O ATOM 222 CB ALA A 14 -4.402 -9.282 -8.532 1.00 0.00 C ATOM 0 H ALA A 14 -5.192 -10.116 -10.709 1.00 0.00 H new ATOM 0 HA ALA A 14 -2.698 -10.271 -9.362 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -3.940 -9.134 -7.556 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -4.258 -8.389 -9.140 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -5.469 -9.466 -8.405 1.00 0.00 H new ATOM 228 N LEU A 15 -4.981 -12.462 -8.564 1.00 0.00 N ATOM 229 CA LEU A 15 -5.236 -13.686 -7.813 1.00 0.00 C ATOM 230 C LEU A 15 -4.247 -14.779 -8.209 1.00 0.00 C ATOM 231 O LEU A 15 -3.770 -15.544 -7.364 1.00 0.00 O ATOM 232 CB LEU A 15 -6.671 -14.158 -8.055 1.00 0.00 C ATOM 233 CG LEU A 15 -7.723 -13.512 -7.155 1.00 0.00 C ATOM 234 CD1 LEU A 15 -9.112 -13.686 -7.750 1.00 0.00 C ATOM 235 CD2 LEU A 15 -7.658 -14.109 -5.758 1.00 0.00 C ATOM 0 H LEU A 15 -5.704 -12.229 -9.245 1.00 0.00 H new ATOM 0 HA LEU A 15 -5.105 -13.475 -6.752 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -6.932 -13.960 -9.094 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -6.710 -15.239 -7.917 1.00 0.00 H new ATOM 0 HG LEU A 15 -7.514 -12.445 -7.084 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -9.849 -13.220 -7.096 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -9.149 -13.215 -8.732 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -9.335 -14.748 -7.849 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -8.413 -13.640 -5.126 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -7.845 -15.181 -5.812 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -6.670 -13.934 -5.333 1.00 0.00 H new ATOM 247 N ASP A 16 -3.930 -14.840 -9.498 1.00 0.00 N ATOM 248 CA ASP A 16 -2.992 -15.832 -10.004 1.00 0.00 C ATOM 249 C ASP A 16 -1.631 -15.650 -9.342 1.00 0.00 C ATOM 250 O ASP A 16 -0.922 -16.619 -9.077 1.00 0.00 O ATOM 251 CB ASP A 16 -2.860 -15.707 -11.524 1.00 0.00 C ATOM 252 CG ASP A 16 -2.727 -17.053 -12.207 1.00 0.00 C ATOM 253 OD1 ASP A 16 -1.743 -17.769 -11.921 1.00 0.00 O ATOM 254 OD2 ASP A 16 -3.605 -17.394 -13.027 1.00 0.00 O ATOM 0 H ASP A 16 -4.309 -14.215 -10.209 1.00 0.00 H new ATOM 0 HA ASP A 16 -3.369 -16.827 -9.766 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -3.732 -15.187 -11.920 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -1.990 -15.095 -11.761 1.00 0.00 H new ATOM 259 N ALA A 17 -1.286 -14.397 -9.060 1.00 0.00 N ATOM 260 CA ALA A 17 -0.025 -14.077 -8.405 1.00 0.00 C ATOM 261 C ALA A 17 -0.088 -14.390 -6.911 1.00 0.00 C ATOM 262 O ALA A 17 0.941 -14.596 -6.267 1.00 0.00 O ATOM 263 CB ALA A 17 0.325 -12.613 -8.627 1.00 0.00 C ATOM 0 H ALA A 17 -1.865 -13.586 -9.276 1.00 0.00 H new ATOM 0 HA ALA A 17 0.756 -14.697 -8.846 1.00 0.00 H new ATOM 0 HB1 ALA A 17 1.270 -12.386 -8.133 1.00 0.00 H new ATOM 0 HB2 ALA A 17 0.419 -12.419 -9.696 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -0.462 -11.984 -8.212 1.00 0.00 H new ATOM 269 N ALA A 18 -1.304 -14.431 -6.366 1.00 0.00 N ATOM 270 CA ALA A 18 -1.499 -14.723 -4.950 1.00 0.00 C ATOM 271 C ALA A 18 -1.114 -16.156 -4.627 1.00 0.00 C ATOM 272 O ALA A 18 -0.589 -16.432 -3.548 1.00 0.00 O ATOM 273 CB ALA A 18 -2.938 -14.449 -4.537 1.00 0.00 C ATOM 0 H ALA A 18 -2.166 -14.266 -6.885 1.00 0.00 H new ATOM 0 HA ALA A 18 -0.845 -14.063 -4.380 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -3.061 -14.673 -3.478 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -3.174 -13.400 -4.716 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -3.610 -15.077 -5.122 1.00 0.00 H new ATOM 279 N GLY A 19 -1.355 -17.074 -5.561 1.00 0.00 N ATOM 280 CA GLY A 19 -0.997 -18.461 -5.336 1.00 0.00 C ATOM 281 C GLY A 19 -1.667 -19.061 -4.122 1.00 0.00 C ATOM 282 O GLY A 19 -2.893 -19.074 -4.018 1.00 0.00 O ATOM 0 H GLY A 19 -1.789 -16.882 -6.464 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -1.264 -19.046 -6.216 1.00 0.00 H new ATOM 0 HA3 GLY A 19 0.084 -18.536 -5.220 1.00 0.00 H new ATOM 286 N ASP A 20 -0.853 -19.567 -3.206 1.00 0.00 N ATOM 287 CA ASP A 20 -1.360 -20.186 -1.993 1.00 0.00 C ATOM 288 C ASP A 20 -1.434 -19.182 -0.847 1.00 0.00 C ATOM 289 O ASP A 20 -1.769 -19.543 0.282 1.00 0.00 O ATOM 290 CB ASP A 20 -0.472 -21.369 -1.606 1.00 0.00 C ATOM 291 CG ASP A 20 0.936 -20.944 -1.235 1.00 0.00 C ATOM 292 OD1 ASP A 20 1.091 -20.204 -0.239 1.00 0.00 O ATOM 293 OD2 ASP A 20 1.885 -21.348 -1.940 1.00 0.00 O ATOM 0 H ASP A 20 0.164 -19.560 -3.282 1.00 0.00 H new ATOM 0 HA ASP A 20 -2.372 -20.542 -2.188 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -0.922 -21.897 -0.765 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -0.428 -22.073 -2.437 1.00 0.00 H new ATOM 298 N LYS A 21 -1.143 -17.917 -1.142 1.00 0.00 N ATOM 299 CA LYS A 21 -1.197 -16.868 -0.140 1.00 0.00 C ATOM 300 C LYS A 21 -2.636 -16.433 0.083 1.00 0.00 C ATOM 301 O LYS A 21 -3.456 -16.481 -0.833 1.00 0.00 O ATOM 302 CB LYS A 21 -0.359 -15.665 -0.579 1.00 0.00 C ATOM 303 CG LYS A 21 1.113 -15.985 -0.776 1.00 0.00 C ATOM 304 CD LYS A 21 1.795 -14.946 -1.651 1.00 0.00 C ATOM 305 CE LYS A 21 3.274 -15.247 -1.816 1.00 0.00 C ATOM 306 NZ LYS A 21 3.786 -14.805 -3.142 1.00 0.00 N ATOM 0 H LYS A 21 -0.867 -17.598 -2.071 1.00 0.00 H new ATOM 0 HA LYS A 21 -0.791 -17.261 0.792 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -0.764 -15.272 -1.511 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -0.453 -14.876 0.167 1.00 0.00 H new ATOM 0 HG2 LYS A 21 1.610 -16.029 0.193 1.00 0.00 H new ATOM 0 HG3 LYS A 21 1.215 -16.970 -1.232 1.00 0.00 H new ATOM 0 HD2 LYS A 21 1.316 -14.921 -2.630 1.00 0.00 H new ATOM 0 HD3 LYS A 21 1.670 -13.957 -1.209 1.00 0.00 H new ATOM 0 HE2 LYS A 21 3.836 -14.749 -1.026 1.00 0.00 H new ATOM 0 HE3 LYS A 21 3.442 -16.318 -1.701 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 4.799 -15.028 -3.215 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 3.267 -15.298 -3.896 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 3.650 -13.779 -3.242 1.00 0.00 H new ATOM 320 N LEU A 22 -2.931 -15.984 1.291 1.00 0.00 N ATOM 321 CA LEU A 22 -4.269 -15.517 1.618 1.00 0.00 C ATOM 322 C LEU A 22 -4.467 -14.125 1.034 1.00 0.00 C ATOM 323 O LEU A 22 -3.607 -13.256 1.178 1.00 0.00 O ATOM 324 CB LEU A 22 -4.472 -15.506 3.139 1.00 0.00 C ATOM 325 CG LEU A 22 -5.740 -14.807 3.647 1.00 0.00 C ATOM 326 CD1 LEU A 22 -6.941 -15.149 2.774 1.00 0.00 C ATOM 327 CD2 LEU A 22 -6.008 -15.191 5.094 1.00 0.00 C ATOM 0 H LEU A 22 -2.264 -15.933 2.061 1.00 0.00 H new ATOM 0 HA LEU A 22 -5.009 -16.192 1.188 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -4.485 -16.538 3.491 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -3.608 -15.024 3.597 1.00 0.00 H new ATOM 0 HG LEU A 22 -5.581 -13.730 3.592 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -7.826 -14.640 3.157 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -6.751 -14.826 1.751 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -7.107 -16.226 2.789 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -6.910 -14.689 5.443 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -6.143 -16.270 5.165 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -5.163 -14.890 5.713 1.00 0.00 H new ATOM 339 N VAL A 23 -5.585 -13.918 0.352 1.00 0.00 N ATOM 340 CA VAL A 23 -5.854 -12.630 -0.265 1.00 0.00 C ATOM 341 C VAL A 23 -7.014 -11.922 0.410 1.00 0.00 C ATOM 342 O VAL A 23 -8.175 -12.304 0.264 1.00 0.00 O ATOM 343 CB VAL A 23 -6.143 -12.767 -1.774 1.00 0.00 C ATOM 344 CG1 VAL A 23 -6.042 -11.415 -2.462 1.00 0.00 C ATOM 345 CG2 VAL A 23 -5.190 -13.765 -2.416 1.00 0.00 C ATOM 0 H VAL A 23 -6.313 -14.619 0.214 1.00 0.00 H new ATOM 0 HA VAL A 23 -4.952 -12.032 -0.137 1.00 0.00 H new ATOM 0 HB VAL A 23 -7.160 -13.140 -1.894 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -6.249 -11.532 -3.526 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -6.767 -10.729 -2.024 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -5.037 -11.014 -2.330 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -5.411 -13.846 -3.480 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -4.163 -13.424 -2.284 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -5.312 -14.740 -1.944 1.00 0.00 H new ATOM 355 N VAL A 24 -6.681 -10.870 1.139 1.00 0.00 N ATOM 356 CA VAL A 24 -7.676 -10.075 1.824 1.00 0.00 C ATOM 357 C VAL A 24 -7.888 -8.796 1.039 1.00 0.00 C ATOM 358 O VAL A 24 -6.972 -7.992 0.878 1.00 0.00 O ATOM 359 CB VAL A 24 -7.250 -9.749 3.269 1.00 0.00 C ATOM 360 CG1 VAL A 24 -5.911 -9.026 3.283 1.00 0.00 C ATOM 361 CG2 VAL A 24 -8.317 -8.928 3.978 1.00 0.00 C ATOM 0 H VAL A 24 -5.722 -10.548 1.270 1.00 0.00 H new ATOM 0 HA VAL A 24 -8.604 -10.644 1.885 1.00 0.00 H new ATOM 0 HB VAL A 24 -7.136 -10.688 3.810 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -5.628 -8.805 4.312 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -5.151 -9.659 2.826 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -5.994 -8.095 2.721 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -7.993 -8.711 4.996 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -8.474 -7.993 3.440 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -9.250 -9.491 4.007 1.00 0.00 H new ATOM 371 N VAL A 25 -9.090 -8.633 0.515 1.00 0.00 N ATOM 372 CA VAL A 25 -9.406 -7.475 -0.298 1.00 0.00 C ATOM 373 C VAL A 25 -10.616 -6.721 0.239 1.00 0.00 C ATOM 374 O VAL A 25 -11.341 -7.213 1.105 1.00 0.00 O ATOM 375 CB VAL A 25 -9.638 -7.891 -1.764 1.00 0.00 C ATOM 376 CG1 VAL A 25 -8.315 -8.201 -2.439 1.00 0.00 C ATOM 377 CG2 VAL A 25 -10.546 -9.101 -1.847 1.00 0.00 C ATOM 0 H VAL A 25 -9.862 -9.288 0.639 1.00 0.00 H new ATOM 0 HA VAL A 25 -8.551 -6.800 -0.254 1.00 0.00 H new ATOM 0 HB VAL A 25 -10.119 -7.058 -2.277 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -8.494 -8.493 -3.474 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -7.679 -7.316 -2.417 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -7.820 -9.017 -1.912 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -10.694 -9.374 -2.892 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -10.090 -9.936 -1.315 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -11.509 -8.865 -1.394 1.00 0.00 H new ATOM 387 N ASP A 26 -10.823 -5.517 -0.277 1.00 0.00 N ATOM 388 CA ASP A 26 -11.937 -4.689 0.161 1.00 0.00 C ATOM 389 C ASP A 26 -12.654 -4.031 -1.012 1.00 0.00 C ATOM 390 O ASP A 26 -12.022 -3.493 -1.920 1.00 0.00 O ATOM 391 CB ASP A 26 -11.444 -3.622 1.138 1.00 0.00 C ATOM 392 CG ASP A 26 -12.577 -2.790 1.704 1.00 0.00 C ATOM 393 OD1 ASP A 26 -13.714 -3.303 1.769 1.00 0.00 O ATOM 394 OD2 ASP A 26 -12.328 -1.626 2.083 1.00 0.00 O ATOM 0 H ASP A 26 -10.237 -5.094 -0.996 1.00 0.00 H new ATOM 0 HA ASP A 26 -12.654 -5.340 0.662 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -10.906 -4.102 1.955 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -10.735 -2.968 0.630 1.00 0.00 H new ATOM 399 N PHE A 27 -13.984 -4.043 -0.957 1.00 0.00 N ATOM 400 CA PHE A 27 -14.811 -3.422 -1.989 1.00 0.00 C ATOM 401 C PHE A 27 -15.273 -2.048 -1.506 1.00 0.00 C ATOM 402 O PHE A 27 -16.025 -1.950 -0.534 1.00 0.00 O ATOM 403 CB PHE A 27 -16.019 -4.305 -2.306 1.00 0.00 C ATOM 404 CG PHE A 27 -15.753 -5.276 -3.419 1.00 0.00 C ATOM 405 CD1 PHE A 27 -14.990 -6.411 -3.196 1.00 0.00 C ATOM 406 CD2 PHE A 27 -16.245 -5.042 -4.695 1.00 0.00 C ATOM 407 CE1 PHE A 27 -14.723 -7.296 -4.224 1.00 0.00 C ATOM 408 CE2 PHE A 27 -15.983 -5.926 -5.726 1.00 0.00 C ATOM 409 CZ PHE A 27 -15.221 -7.055 -5.490 1.00 0.00 C ATOM 0 H PHE A 27 -14.515 -4.479 -0.203 1.00 0.00 H new ATOM 0 HA PHE A 27 -14.223 -3.307 -2.900 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -16.306 -4.856 -1.410 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -16.865 -3.673 -2.576 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -14.600 -6.606 -2.208 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -16.839 -4.160 -4.885 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -14.125 -8.176 -4.037 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -16.373 -5.734 -6.715 1.00 0.00 H new ATOM 0 HZ PHE A 27 -15.015 -7.747 -6.293 1.00 0.00 H new ATOM 419 N SER A 28 -14.803 -0.991 -2.162 1.00 0.00 N ATOM 420 CA SER A 28 -15.156 0.366 -1.762 1.00 0.00 C ATOM 421 C SER A 28 -15.808 1.152 -2.899 1.00 0.00 C ATOM 422 O SER A 28 -16.203 0.590 -3.920 1.00 0.00 O ATOM 423 CB SER A 28 -13.906 1.101 -1.269 1.00 0.00 C ATOM 424 OG SER A 28 -13.101 0.258 -0.464 1.00 0.00 O ATOM 0 H SER A 28 -14.181 -1.048 -2.968 1.00 0.00 H new ATOM 0 HA SER A 28 -15.887 0.293 -0.956 1.00 0.00 H new ATOM 0 HB2 SER A 28 -13.328 1.454 -2.123 1.00 0.00 H new ATOM 0 HB3 SER A 28 -14.200 1.981 -0.698 1.00 0.00 H new ATOM 0 HG SER A 28 -12.309 0.751 -0.164 1.00 0.00 H new ATOM 430 N ALA A 29 -15.902 2.463 -2.701 1.00 0.00 N ATOM 431 CA ALA A 29 -16.486 3.367 -3.686 1.00 0.00 C ATOM 432 C ALA A 29 -15.875 4.756 -3.552 1.00 0.00 C ATOM 433 O ALA A 29 -15.440 5.145 -2.469 1.00 0.00 O ATOM 434 CB ALA A 29 -18.001 3.429 -3.523 1.00 0.00 C ATOM 0 H ALA A 29 -15.576 2.928 -1.854 1.00 0.00 H new ATOM 0 HA ALA A 29 -16.266 2.986 -4.683 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -18.419 4.108 -4.266 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -18.423 2.434 -3.663 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -18.245 3.790 -2.524 1.00 0.00 H new ATOM 440 N THR A 30 -15.874 5.522 -4.637 1.00 0.00 N ATOM 441 CA THR A 30 -15.345 6.879 -4.600 1.00 0.00 C ATOM 442 C THR A 30 -16.302 7.784 -3.828 1.00 0.00 C ATOM 443 O THR A 30 -15.887 8.708 -3.130 1.00 0.00 O ATOM 444 CB THR A 30 -15.139 7.412 -6.020 1.00 0.00 C ATOM 445 OG1 THR A 30 -14.534 6.429 -6.843 1.00 0.00 O ATOM 446 CG2 THR A 30 -14.270 8.651 -6.074 1.00 0.00 C ATOM 0 H THR A 30 -16.231 5.229 -5.546 1.00 0.00 H new ATOM 0 HA THR A 30 -14.379 6.868 -4.095 1.00 0.00 H new ATOM 0 HB THR A 30 -16.136 7.669 -6.378 1.00 0.00 H new ATOM 0 HG1 THR A 30 -14.413 6.788 -7.747 1.00 0.00 H new ATOM 0 HG21 THR A 30 -14.164 8.976 -7.109 1.00 0.00 H new ATOM 0 HG22 THR A 30 -14.733 9.446 -5.489 1.00 0.00 H new ATOM 0 HG23 THR A 30 -13.286 8.424 -5.663 1.00 0.00 H new ATOM 454 N TRP A 31 -17.595 7.500 -3.980 1.00 0.00 N ATOM 455 CA TRP A 31 -18.657 8.273 -3.334 1.00 0.00 C ATOM 456 C TRP A 31 -18.974 7.762 -1.924 1.00 0.00 C ATOM 457 O TRP A 31 -19.974 8.166 -1.328 1.00 0.00 O ATOM 458 CB TRP A 31 -19.927 8.185 -4.185 1.00 0.00 C ATOM 459 CG TRP A 31 -20.476 6.791 -4.247 1.00 0.00 C ATOM 460 CD1 TRP A 31 -20.082 5.788 -5.089 1.00 0.00 C ATOM 461 CD2 TRP A 31 -21.505 6.239 -3.418 1.00 0.00 C ATOM 462 NE1 TRP A 31 -20.799 4.644 -4.823 1.00 0.00 N ATOM 463 CE2 TRP A 31 -21.678 4.899 -3.807 1.00 0.00 C ATOM 464 CE3 TRP A 31 -22.295 6.746 -2.382 1.00 0.00 C ATOM 465 CZ2 TRP A 31 -22.606 4.060 -3.198 1.00 0.00 C ATOM 466 CZ3 TRP A 31 -23.217 5.911 -1.779 1.00 0.00 C ATOM 467 CH2 TRP A 31 -23.364 4.581 -2.189 1.00 0.00 C ATOM 0 H TRP A 31 -17.936 6.729 -4.554 1.00 0.00 H new ATOM 0 HA TRP A 31 -18.309 9.302 -3.247 1.00 0.00 H new ATOM 0 HB2 TRP A 31 -20.684 8.853 -3.774 1.00 0.00 H new ATOM 0 HB3 TRP A 31 -19.710 8.533 -5.195 1.00 0.00 H new ATOM 0 HD1 TRP A 31 -19.321 5.880 -5.850 1.00 0.00 H new ATOM 0 HE1 TRP A 31 -20.692 3.751 -5.305 1.00 0.00 H new ATOM 0 HE3 TRP A 31 -22.187 7.771 -2.059 1.00 0.00 H new ATOM 0 HZ2 TRP A 31 -22.723 3.033 -3.512 1.00 0.00 H new ATOM 0 HZ3 TRP A 31 -23.834 6.291 -0.978 1.00 0.00 H new ATOM 0 HH2 TRP A 31 -24.092 3.954 -1.697 1.00 0.00 H new ATOM 478 N CYS A 32 -18.140 6.875 -1.392 1.00 0.00 N ATOM 479 CA CYS A 32 -18.370 6.338 -0.055 1.00 0.00 C ATOM 480 C CYS A 32 -17.564 7.089 0.997 1.00 0.00 C ATOM 481 O CYS A 32 -16.541 7.701 0.692 1.00 0.00 O ATOM 482 CB CYS A 32 -18.036 4.844 -0.007 1.00 0.00 C ATOM 483 SG CYS A 32 -18.573 4.013 1.525 1.00 0.00 S ATOM 0 H CYS A 32 -17.308 6.516 -1.859 1.00 0.00 H new ATOM 0 HA CYS A 32 -19.428 6.472 0.172 1.00 0.00 H new ATOM 0 HB2 CYS A 32 -18.503 4.350 -0.859 1.00 0.00 H new ATOM 0 HB3 CYS A 32 -16.959 4.719 -0.118 1.00 0.00 H new ATOM 488 N GLY A 33 -18.032 7.025 2.240 1.00 0.00 N ATOM 489 CA GLY A 33 -17.345 7.693 3.329 1.00 0.00 C ATOM 490 C GLY A 33 -16.618 6.716 4.237 1.00 0.00 C ATOM 491 O GLY A 33 -15.389 6.660 4.232 1.00 0.00 O ATOM 0 H GLY A 33 -18.876 6.521 2.512 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -16.630 8.407 2.921 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -18.066 8.263 3.915 1.00 0.00 H new ATOM 495 N PRO A 34 -17.358 5.924 5.033 1.00 0.00 N ATOM 496 CA PRO A 34 -16.759 4.943 5.945 1.00 0.00 C ATOM 497 C PRO A 34 -15.820 3.982 5.223 1.00 0.00 C ATOM 498 O PRO A 34 -14.893 3.434 5.821 1.00 0.00 O ATOM 499 CB PRO A 34 -17.968 4.185 6.501 1.00 0.00 C ATOM 500 CG PRO A 34 -19.112 5.127 6.350 1.00 0.00 C ATOM 501 CD PRO A 34 -18.831 5.919 5.105 1.00 0.00 C ATOM 0 HA PRO A 34 -16.149 5.421 6.712 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -18.142 3.260 5.951 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -17.817 3.911 7.545 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -20.055 4.586 6.265 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -19.197 5.781 7.218 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -19.275 5.456 4.224 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -19.234 6.930 5.171 1.00 0.00 H new ATOM 509 N CYS A 35 -16.070 3.778 3.932 1.00 0.00 N ATOM 510 CA CYS A 35 -15.254 2.880 3.123 1.00 0.00 C ATOM 511 C CYS A 35 -13.793 3.317 3.111 1.00 0.00 C ATOM 512 O CYS A 35 -12.888 2.496 3.252 1.00 0.00 O ATOM 513 CB CYS A 35 -15.785 2.828 1.687 1.00 0.00 C ATOM 514 SG CYS A 35 -17.516 2.280 1.546 1.00 0.00 S ATOM 0 H CYS A 35 -16.833 4.224 3.424 1.00 0.00 H new ATOM 0 HA CYS A 35 -15.313 1.887 3.569 1.00 0.00 H new ATOM 0 HB2 CYS A 35 -15.693 3.819 1.242 1.00 0.00 H new ATOM 0 HB3 CYS A 35 -15.155 2.157 1.103 1.00 0.00 H new ATOM 519 N LYS A 36 -13.571 4.615 2.935 1.00 0.00 N ATOM 520 CA LYS A 36 -12.219 5.163 2.895 1.00 0.00 C ATOM 521 C LYS A 36 -11.518 5.018 4.244 1.00 0.00 C ATOM 522 O LYS A 36 -10.290 5.010 4.312 1.00 0.00 O ATOM 523 CB LYS A 36 -12.259 6.635 2.479 1.00 0.00 C ATOM 524 CG LYS A 36 -11.882 6.862 1.024 1.00 0.00 C ATOM 525 CD LYS A 36 -13.111 6.901 0.131 1.00 0.00 C ATOM 526 CE LYS A 36 -12.752 7.300 -1.291 1.00 0.00 C ATOM 527 NZ LYS A 36 -12.900 8.765 -1.513 1.00 0.00 N ATOM 0 H LYS A 36 -14.310 5.308 2.818 1.00 0.00 H new ATOM 0 HA LYS A 36 -11.650 4.596 2.158 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -13.261 7.027 2.652 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -11.580 7.203 3.115 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -11.333 7.799 0.931 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -11.214 6.067 0.692 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -13.590 5.922 0.126 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -13.835 7.608 0.537 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -11.725 7.003 -1.503 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -13.390 6.761 -1.991 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -12.645 8.995 -2.495 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -13.886 9.045 -1.336 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -12.272 9.280 -0.863 1.00 0.00 H new ATOM 541 N MET A 37 -12.300 4.919 5.315 1.00 0.00 N ATOM 542 CA MET A 37 -11.741 4.793 6.656 1.00 0.00 C ATOM 543 C MET A 37 -11.034 3.455 6.854 1.00 0.00 C ATOM 544 O MET A 37 -10.222 3.311 7.766 1.00 0.00 O ATOM 545 CB MET A 37 -12.841 4.953 7.708 1.00 0.00 C ATOM 546 CG MET A 37 -13.417 6.358 7.779 1.00 0.00 C ATOM 547 SD MET A 37 -12.188 7.593 8.244 1.00 0.00 S ATOM 548 CE MET A 37 -13.222 8.812 9.049 1.00 0.00 C ATOM 0 H MET A 37 -13.319 4.924 5.280 1.00 0.00 H new ATOM 0 HA MET A 37 -11.002 5.586 6.774 1.00 0.00 H new ATOM 0 HB2 MET A 37 -13.645 4.250 7.490 1.00 0.00 H new ATOM 0 HB3 MET A 37 -12.439 4.684 8.685 1.00 0.00 H new ATOM 0 HG2 MET A 37 -13.842 6.621 6.810 1.00 0.00 H new ATOM 0 HG3 MET A 37 -14.234 6.375 8.500 1.00 0.00 H new ATOM 0 HE1 MET A 37 -12.605 9.642 9.394 1.00 0.00 H new ATOM 0 HE2 MET A 37 -13.966 9.181 8.343 1.00 0.00 H new ATOM 0 HE3 MET A 37 -13.726 8.356 9.901 1.00 0.00 H new ATOM 558 N ILE A 38 -11.331 2.478 6.000 1.00 0.00 N ATOM 559 CA ILE A 38 -10.703 1.165 6.110 1.00 0.00 C ATOM 560 C ILE A 38 -9.380 1.122 5.347 1.00 0.00 C ATOM 561 O ILE A 38 -8.500 0.321 5.660 1.00 0.00 O ATOM 562 CB ILE A 38 -11.623 0.054 5.561 1.00 0.00 C ATOM 563 CG1 ILE A 38 -13.042 0.197 6.121 1.00 0.00 C ATOM 564 CG2 ILE A 38 -11.049 -1.318 5.887 1.00 0.00 C ATOM 565 CD1 ILE A 38 -13.164 -0.161 7.588 1.00 0.00 C ATOM 0 H ILE A 38 -11.996 2.569 5.232 1.00 0.00 H new ATOM 0 HA ILE A 38 -10.520 0.992 7.171 1.00 0.00 H new ATOM 0 HB ILE A 38 -11.677 0.156 4.477 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -13.376 1.225 5.979 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -13.715 -0.439 5.545 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -11.709 -2.091 5.494 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -10.063 -1.417 5.433 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -10.964 -1.429 6.968 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -14.198 -0.034 7.909 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -12.863 -1.198 7.736 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -12.519 0.491 8.177 1.00 0.00 H new ATOM 577 N LYS A 39 -9.247 1.991 4.347 1.00 0.00 N ATOM 578 CA LYS A 39 -8.032 2.054 3.536 1.00 0.00 C ATOM 579 C LYS A 39 -6.781 2.202 4.407 1.00 0.00 C ATOM 580 O LYS A 39 -5.837 1.423 4.281 1.00 0.00 O ATOM 581 CB LYS A 39 -8.117 3.210 2.534 1.00 0.00 C ATOM 582 CG LYS A 39 -8.530 2.774 1.137 1.00 0.00 C ATOM 583 CD LYS A 39 -9.239 3.893 0.392 1.00 0.00 C ATOM 584 CE LYS A 39 -9.513 3.515 -1.055 1.00 0.00 C ATOM 585 NZ LYS A 39 -8.279 3.569 -1.890 1.00 0.00 N ATOM 0 H LYS A 39 -9.966 2.662 4.078 1.00 0.00 H new ATOM 0 HA LYS A 39 -7.951 1.114 2.990 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -8.831 3.947 2.902 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -7.147 3.705 2.480 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -7.649 2.463 0.576 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -9.187 1.907 1.204 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -10.179 4.126 0.892 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -8.629 4.796 0.424 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -9.933 2.510 -1.094 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -10.262 4.190 -1.470 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -8.519 3.354 -2.879 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -7.863 4.521 -1.834 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -7.593 2.870 -1.541 1.00 0.00 H new ATOM 599 N PRO A 40 -6.754 3.211 5.295 1.00 0.00 N ATOM 600 CA PRO A 40 -5.608 3.461 6.176 1.00 0.00 C ATOM 601 C PRO A 40 -5.116 2.205 6.893 1.00 0.00 C ATOM 602 O PRO A 40 -3.919 1.916 6.900 1.00 0.00 O ATOM 603 CB PRO A 40 -6.153 4.477 7.180 1.00 0.00 C ATOM 604 CG PRO A 40 -7.209 5.209 6.430 1.00 0.00 C ATOM 605 CD PRO A 40 -7.834 4.198 5.507 1.00 0.00 C ATOM 0 HA PRO A 40 -4.740 3.810 5.617 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -6.562 3.984 8.062 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -5.371 5.153 7.526 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -7.951 5.629 7.109 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -6.784 6.041 5.868 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -8.716 3.738 5.953 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -8.152 4.653 4.569 1.00 0.00 H new ATOM 613 N PHE A 41 -6.033 1.472 7.520 1.00 0.00 N ATOM 614 CA PHE A 41 -5.665 0.271 8.271 1.00 0.00 C ATOM 615 C PHE A 41 -5.455 -0.938 7.362 1.00 0.00 C ATOM 616 O PHE A 41 -4.695 -1.844 7.700 1.00 0.00 O ATOM 617 CB PHE A 41 -6.747 -0.065 9.297 1.00 0.00 C ATOM 618 CG PHE A 41 -7.270 1.125 10.049 1.00 0.00 C ATOM 619 CD1 PHE A 41 -6.452 1.825 10.921 1.00 0.00 C ATOM 620 CD2 PHE A 41 -8.580 1.541 9.883 1.00 0.00 C ATOM 621 CE1 PHE A 41 -6.932 2.922 11.612 1.00 0.00 C ATOM 622 CE2 PHE A 41 -9.066 2.637 10.572 1.00 0.00 C ATOM 623 CZ PHE A 41 -8.241 3.327 11.437 1.00 0.00 C ATOM 0 H PHE A 41 -7.030 1.685 7.524 1.00 0.00 H new ATOM 0 HA PHE A 41 -4.722 0.490 8.772 1.00 0.00 H new ATOM 0 HB2 PHE A 41 -7.578 -0.552 8.787 1.00 0.00 H new ATOM 0 HB3 PHE A 41 -6.345 -0.784 10.011 1.00 0.00 H new ATOM 0 HD1 PHE A 41 -5.429 1.510 11.062 1.00 0.00 H new ATOM 0 HD2 PHE A 41 -9.230 1.004 9.208 1.00 0.00 H new ATOM 0 HE1 PHE A 41 -6.285 3.461 12.288 1.00 0.00 H new ATOM 0 HE2 PHE A 41 -10.090 2.953 10.433 1.00 0.00 H new ATOM 0 HZ PHE A 41 -8.619 4.183 11.977 1.00 0.00 H new ATOM 633 N PHE A 42 -6.124 -0.961 6.216 1.00 0.00 N ATOM 634 CA PHE A 42 -5.983 -2.078 5.288 1.00 0.00 C ATOM 635 C PHE A 42 -4.567 -2.121 4.726 1.00 0.00 C ATOM 636 O PHE A 42 -3.945 -3.181 4.649 1.00 0.00 O ATOM 637 CB PHE A 42 -6.998 -1.952 4.149 1.00 0.00 C ATOM 638 CG PHE A 42 -7.457 -3.270 3.586 1.00 0.00 C ATOM 639 CD1 PHE A 42 -8.337 -4.071 4.299 1.00 0.00 C ATOM 640 CD2 PHE A 42 -7.024 -3.699 2.342 1.00 0.00 C ATOM 641 CE1 PHE A 42 -8.775 -5.275 3.780 1.00 0.00 C ATOM 642 CE2 PHE A 42 -7.457 -4.905 1.819 1.00 0.00 C ATOM 643 CZ PHE A 42 -8.333 -5.693 2.540 1.00 0.00 C ATOM 0 H PHE A 42 -6.763 -0.228 5.908 1.00 0.00 H new ATOM 0 HA PHE A 42 -6.175 -3.006 5.827 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -7.867 -1.401 4.510 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -6.556 -1.361 3.347 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -8.684 -3.750 5.270 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -6.341 -3.085 1.774 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -9.462 -5.888 4.344 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -7.111 -5.229 0.849 1.00 0.00 H new ATOM 0 HZ PHE A 42 -8.672 -6.635 2.135 1.00 0.00 H new ATOM 653 N HIS A 43 -4.071 -0.955 4.325 1.00 0.00 N ATOM 654 CA HIS A 43 -2.733 -0.840 3.753 1.00 0.00 C ATOM 655 C HIS A 43 -1.647 -1.134 4.787 1.00 0.00 C ATOM 656 O HIS A 43 -0.664 -1.811 4.484 1.00 0.00 O ATOM 657 CB HIS A 43 -2.531 0.556 3.160 1.00 0.00 C ATOM 658 CG HIS A 43 -2.080 0.539 1.731 1.00 0.00 C ATOM 659 ND1 HIS A 43 -2.918 0.755 0.659 1.00 0.00 N ATOM 660 CD2 HIS A 43 -0.847 0.327 1.204 1.00 0.00 C ATOM 661 CE1 HIS A 43 -2.186 0.669 -0.461 1.00 0.00 C ATOM 662 NE2 HIS A 43 -0.922 0.410 -0.184 1.00 0.00 N ATOM 0 H HIS A 43 -4.578 -0.072 4.386 1.00 0.00 H new ATOM 0 HA HIS A 43 -2.647 -1.585 2.962 1.00 0.00 H new ATOM 0 HB2 HIS A 43 -3.466 1.111 3.231 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -1.795 1.093 3.759 1.00 0.00 H new ATOM 0 HD2 HIS A 43 0.050 0.126 1.771 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -2.579 0.795 -1.459 1.00 0.00 H new ATOM 0 HE2 HIS A 43 -0.158 0.294 -0.849 1.00 0.00 H new ATOM 670 N SER A 44 -1.815 -0.619 6.005 1.00 0.00 N ATOM 671 CA SER A 44 -0.829 -0.833 7.062 1.00 0.00 C ATOM 672 C SER A 44 -0.667 -2.319 7.356 1.00 0.00 C ATOM 673 O SER A 44 0.450 -2.816 7.506 1.00 0.00 O ATOM 674 CB SER A 44 -1.240 -0.088 8.334 1.00 0.00 C ATOM 675 OG SER A 44 -2.647 0.038 8.419 1.00 0.00 O ATOM 0 H SER A 44 -2.618 -0.055 6.282 1.00 0.00 H new ATOM 0 HA SER A 44 0.128 -0.442 6.718 1.00 0.00 H new ATOM 0 HB2 SER A 44 -0.866 -0.621 9.208 1.00 0.00 H new ATOM 0 HB3 SER A 44 -0.782 0.901 8.344 1.00 0.00 H new ATOM 0 HG SER A 44 -2.934 0.839 7.933 1.00 0.00 H new ATOM 681 N LEU A 45 -1.787 -3.029 7.433 1.00 0.00 N ATOM 682 CA LEU A 45 -1.755 -4.458 7.706 1.00 0.00 C ATOM 683 C LEU A 45 -0.967 -5.173 6.616 1.00 0.00 C ATOM 684 O LEU A 45 -0.194 -6.091 6.890 1.00 0.00 O ATOM 685 CB LEU A 45 -3.178 -5.017 7.783 1.00 0.00 C ATOM 686 CG LEU A 45 -4.014 -4.485 8.950 1.00 0.00 C ATOM 687 CD1 LEU A 45 -5.498 -4.536 8.618 1.00 0.00 C ATOM 688 CD2 LEU A 45 -3.719 -5.275 10.216 1.00 0.00 C ATOM 0 H LEU A 45 -2.722 -2.640 7.311 1.00 0.00 H new ATOM 0 HA LEU A 45 -1.266 -4.624 8.666 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -3.694 -4.788 6.851 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -3.123 -6.103 7.859 1.00 0.00 H new ATOM 0 HG LEU A 45 -3.742 -3.444 9.121 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -6.073 -4.153 9.461 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -5.695 -3.925 7.737 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -5.791 -5.567 8.417 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -4.321 -4.885 11.037 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -3.962 -6.325 10.055 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -2.662 -5.182 10.465 1.00 0.00 H new ATOM 700 N SER A 46 -1.163 -4.730 5.379 1.00 0.00 N ATOM 701 CA SER A 46 -0.468 -5.299 4.232 1.00 0.00 C ATOM 702 C SER A 46 1.045 -5.233 4.414 1.00 0.00 C ATOM 703 O SER A 46 1.780 -6.053 3.864 1.00 0.00 O ATOM 704 CB SER A 46 -0.865 -4.550 2.958 1.00 0.00 C ATOM 705 OG SER A 46 -0.239 -5.112 1.817 1.00 0.00 O ATOM 0 H SER A 46 -1.804 -3.972 5.145 1.00 0.00 H new ATOM 0 HA SER A 46 -0.758 -6.346 4.148 1.00 0.00 H new ATOM 0 HB2 SER A 46 -1.948 -4.584 2.836 1.00 0.00 H new ATOM 0 HB3 SER A 46 -0.587 -3.500 3.049 1.00 0.00 H new ATOM 0 HG SER A 46 0.539 -4.569 1.570 1.00 0.00 H new ATOM 711 N GLU A 47 1.510 -4.249 5.183 1.00 0.00 N ATOM 712 CA GLU A 47 2.940 -4.082 5.423 1.00 0.00 C ATOM 713 C GLU A 47 3.411 -4.902 6.620 1.00 0.00 C ATOM 714 O GLU A 47 4.604 -5.163 6.767 1.00 0.00 O ATOM 715 CB GLU A 47 3.273 -2.603 5.632 1.00 0.00 C ATOM 716 CG GLU A 47 2.968 -1.740 4.419 1.00 0.00 C ATOM 717 CD GLU A 47 2.618 -0.313 4.789 1.00 0.00 C ATOM 718 OE1 GLU A 47 3.502 0.401 5.306 1.00 0.00 O ATOM 719 OE2 GLU A 47 1.459 0.092 4.558 1.00 0.00 O ATOM 0 H GLU A 47 0.919 -3.559 5.648 1.00 0.00 H new ATOM 0 HA GLU A 47 3.468 -4.448 4.542 1.00 0.00 H new ATOM 0 HB2 GLU A 47 2.710 -2.228 6.487 1.00 0.00 H new ATOM 0 HB3 GLU A 47 4.330 -2.507 5.880 1.00 0.00 H new ATOM 0 HG2 GLU A 47 3.832 -1.737 3.754 1.00 0.00 H new ATOM 0 HG3 GLU A 47 2.140 -2.181 3.864 1.00 0.00 H new ATOM 726 N LYS A 48 2.472 -5.321 7.468 1.00 0.00 N ATOM 727 CA LYS A 48 2.813 -6.126 8.638 1.00 0.00 C ATOM 728 C LYS A 48 2.631 -7.610 8.325 1.00 0.00 C ATOM 729 O LYS A 48 3.205 -8.472 8.989 1.00 0.00 O ATOM 730 CB LYS A 48 1.943 -5.737 9.837 1.00 0.00 C ATOM 731 CG LYS A 48 2.250 -6.533 11.098 1.00 0.00 C ATOM 732 CD LYS A 48 1.000 -7.187 11.672 1.00 0.00 C ATOM 733 CE LYS A 48 1.164 -8.694 11.790 1.00 0.00 C ATOM 734 NZ LYS A 48 0.023 -9.323 12.510 1.00 0.00 N ATOM 0 H LYS A 48 1.477 -5.118 7.367 1.00 0.00 H new ATOM 0 HA LYS A 48 3.856 -5.937 8.891 1.00 0.00 H new ATOM 0 HB2 LYS A 48 2.080 -4.676 10.045 1.00 0.00 H new ATOM 0 HB3 LYS A 48 0.894 -5.878 9.575 1.00 0.00 H new ATOM 0 HG2 LYS A 48 2.991 -7.300 10.872 1.00 0.00 H new ATOM 0 HG3 LYS A 48 2.691 -5.874 11.846 1.00 0.00 H new ATOM 0 HD2 LYS A 48 0.786 -6.765 12.654 1.00 0.00 H new ATOM 0 HD3 LYS A 48 0.145 -6.962 11.035 1.00 0.00 H new ATOM 0 HE2 LYS A 48 1.249 -9.129 10.794 1.00 0.00 H new ATOM 0 HE3 LYS A 48 2.092 -8.918 12.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 0.299 -10.271 12.837 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -0.237 -8.736 13.328 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -0.791 -9.402 11.868 1.00 0.00 H new ATOM 748 N TYR A 49 1.834 -7.890 7.296 1.00 0.00 N ATOM 749 CA TYR A 49 1.570 -9.261 6.869 1.00 0.00 C ATOM 750 C TYR A 49 2.444 -9.625 5.671 1.00 0.00 C ATOM 751 O TYR A 49 2.066 -9.382 4.525 1.00 0.00 O ATOM 752 CB TYR A 49 0.098 -9.418 6.481 1.00 0.00 C ATOM 753 CG TYR A 49 -0.815 -9.761 7.638 1.00 0.00 C ATOM 754 CD1 TYR A 49 -1.277 -8.771 8.496 1.00 0.00 C ATOM 755 CD2 TYR A 49 -1.218 -11.073 7.871 1.00 0.00 C ATOM 756 CE1 TYR A 49 -2.113 -9.078 9.554 1.00 0.00 C ATOM 757 CE2 TYR A 49 -2.054 -11.384 8.926 1.00 0.00 C ATOM 758 CZ TYR A 49 -2.499 -10.384 9.763 1.00 0.00 C ATOM 759 OH TYR A 49 -3.335 -10.689 10.812 1.00 0.00 O ATOM 0 H TYR A 49 1.357 -7.180 6.740 1.00 0.00 H new ATOM 0 HA TYR A 49 1.802 -9.927 7.700 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -0.246 -8.491 6.023 1.00 0.00 H new ATOM 0 HB3 TYR A 49 0.015 -10.197 5.723 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -0.979 -7.746 8.334 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -0.872 -11.860 7.217 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -2.462 -8.297 10.214 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -2.358 -12.407 9.094 1.00 0.00 H new ATOM 0 HH TYR A 49 -3.512 -11.653 10.820 1.00 0.00 H new ATOM 769 N SER A 50 3.608 -10.213 5.932 1.00 0.00 N ATOM 770 CA SER A 50 4.517 -10.608 4.861 1.00 0.00 C ATOM 771 C SER A 50 4.199 -12.023 4.385 1.00 0.00 C ATOM 772 O SER A 50 5.084 -12.873 4.284 1.00 0.00 O ATOM 773 CB SER A 50 5.970 -10.524 5.335 1.00 0.00 C ATOM 774 OG SER A 50 6.236 -11.477 6.349 1.00 0.00 O ATOM 0 H SER A 50 3.943 -10.426 6.872 1.00 0.00 H new ATOM 0 HA SER A 50 4.382 -9.921 4.025 1.00 0.00 H new ATOM 0 HB2 SER A 50 6.640 -10.690 4.492 1.00 0.00 H new ATOM 0 HB3 SER A 50 6.175 -9.522 5.712 1.00 0.00 H new ATOM 0 HG SER A 50 6.077 -12.379 6.000 1.00 0.00 H new ATOM 780 N ASN A 51 2.924 -12.265 4.092 1.00 0.00 N ATOM 781 CA ASN A 51 2.472 -13.570 3.625 1.00 0.00 C ATOM 782 C ASN A 51 1.215 -13.439 2.769 1.00 0.00 C ATOM 783 O ASN A 51 1.065 -14.118 1.753 1.00 0.00 O ATOM 784 CB ASN A 51 2.194 -14.486 4.817 1.00 0.00 C ATOM 785 CG ASN A 51 2.166 -15.951 4.429 1.00 0.00 C ATOM 786 OD1 ASN A 51 1.508 -16.339 3.464 1.00 0.00 O ATOM 787 ND2 ASN A 51 2.880 -16.775 5.189 1.00 0.00 N ATOM 0 H ASN A 51 2.183 -11.569 4.171 1.00 0.00 H new ATOM 0 HA ASN A 51 3.262 -14.004 3.012 1.00 0.00 H new ATOM 0 HB2 ASN A 51 2.959 -14.329 5.578 1.00 0.00 H new ATOM 0 HB3 ASN A 51 1.238 -14.214 5.265 1.00 0.00 H new ATOM 0 HD21 ASN A 51 2.897 -17.774 4.982 1.00 0.00 H new ATOM 0 HD22 ASN A 51 3.411 -16.409 5.979 1.00 0.00 H new ATOM 794 N VAL A 52 0.305 -12.571 3.206 1.00 0.00 N ATOM 795 CA VAL A 52 -0.957 -12.358 2.506 1.00 0.00 C ATOM 796 C VAL A 52 -0.877 -11.188 1.539 1.00 0.00 C ATOM 797 O VAL A 52 -0.068 -10.275 1.712 1.00 0.00 O ATOM 798 CB VAL A 52 -2.097 -12.092 3.507 1.00 0.00 C ATOM 799 CG1 VAL A 52 -2.138 -13.178 4.566 1.00 0.00 C ATOM 800 CG2 VAL A 52 -1.939 -10.723 4.156 1.00 0.00 C ATOM 0 H VAL A 52 0.420 -12.002 4.045 1.00 0.00 H new ATOM 0 HA VAL A 52 -1.160 -13.268 1.942 1.00 0.00 H new ATOM 0 HB VAL A 52 -3.040 -12.104 2.960 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -2.949 -12.974 5.265 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -2.303 -14.144 4.090 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -1.191 -13.196 5.105 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -2.755 -10.557 4.859 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -0.988 -10.680 4.687 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -1.960 -9.951 3.387 1.00 0.00 H new ATOM 810 N ILE A 53 -1.726 -11.218 0.519 1.00 0.00 N ATOM 811 CA ILE A 53 -1.751 -10.157 -0.472 1.00 0.00 C ATOM 812 C ILE A 53 -2.966 -9.252 -0.282 1.00 0.00 C ATOM 813 O ILE A 53 -4.109 -9.667 -0.469 1.00 0.00 O ATOM 814 CB ILE A 53 -1.715 -10.728 -1.913 1.00 0.00 C ATOM 815 CG1 ILE A 53 -1.147 -9.688 -2.875 1.00 0.00 C ATOM 816 CG2 ILE A 53 -3.088 -11.193 -2.378 1.00 0.00 C ATOM 817 CD1 ILE A 53 0.366 -9.655 -2.900 1.00 0.00 C ATOM 0 H ILE A 53 -2.403 -11.964 0.359 1.00 0.00 H new ATOM 0 HA ILE A 53 -0.854 -9.556 -0.326 1.00 0.00 H new ATOM 0 HB ILE A 53 -1.065 -11.603 -1.906 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -1.515 -9.894 -3.880 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -1.520 -8.703 -2.595 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -3.015 -11.585 -3.392 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -3.452 -11.975 -1.712 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -3.781 -10.352 -2.363 1.00 0.00 H new ATOM 0 HD11 ILE A 53 0.702 -8.894 -3.604 1.00 0.00 H new ATOM 0 HD12 ILE A 53 0.741 -9.419 -1.904 1.00 0.00 H new ATOM 0 HD13 ILE A 53 0.746 -10.629 -3.209 1.00 0.00 H new ATOM 829 N PHE A 54 -2.696 -8.008 0.093 1.00 0.00 N ATOM 830 CA PHE A 54 -3.740 -7.016 0.314 1.00 0.00 C ATOM 831 C PHE A 54 -3.927 -6.186 -0.947 1.00 0.00 C ATOM 832 O PHE A 54 -3.019 -5.457 -1.340 1.00 0.00 O ATOM 833 CB PHE A 54 -3.327 -6.057 1.438 1.00 0.00 C ATOM 834 CG PHE A 54 -3.707 -6.456 2.843 1.00 0.00 C ATOM 835 CD1 PHE A 54 -3.206 -7.605 3.442 1.00 0.00 C ATOM 836 CD2 PHE A 54 -4.557 -5.641 3.576 1.00 0.00 C ATOM 837 CE1 PHE A 54 -3.553 -7.927 4.746 1.00 0.00 C ATOM 838 CE2 PHE A 54 -4.908 -5.962 4.873 1.00 0.00 C ATOM 839 CZ PHE A 54 -4.407 -7.105 5.459 1.00 0.00 C ATOM 0 H PHE A 54 -1.751 -7.659 0.252 1.00 0.00 H new ATOM 0 HA PHE A 54 -4.660 -7.538 0.578 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -2.245 -5.934 1.400 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -3.766 -5.081 1.231 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -2.542 -8.252 2.889 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -4.950 -4.742 3.126 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -3.156 -8.820 5.205 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -5.574 -5.318 5.428 1.00 0.00 H new ATOM 0 HZ PHE A 54 -4.681 -7.358 6.473 1.00 0.00 H new ATOM 849 N LEU A 55 -5.097 -6.261 -1.572 1.00 0.00 N ATOM 850 CA LEU A 55 -5.328 -5.468 -2.765 1.00 0.00 C ATOM 851 C LEU A 55 -6.599 -4.648 -2.653 1.00 0.00 C ATOM 852 O LEU A 55 -7.410 -4.849 -1.749 1.00 0.00 O ATOM 853 CB LEU A 55 -5.299 -6.323 -4.034 1.00 0.00 C ATOM 854 CG LEU A 55 -6.639 -6.674 -4.682 1.00 0.00 C ATOM 855 CD1 LEU A 55 -6.883 -5.781 -5.888 1.00 0.00 C ATOM 856 CD2 LEU A 55 -6.644 -8.135 -5.102 1.00 0.00 C ATOM 0 H LEU A 55 -5.879 -6.847 -1.280 1.00 0.00 H new ATOM 0 HA LEU A 55 -4.502 -4.761 -2.849 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -4.693 -5.803 -4.776 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -4.785 -7.255 -3.799 1.00 0.00 H new ATOM 0 HG LEU A 55 -7.438 -6.512 -3.958 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -7.839 -6.038 -6.343 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -6.900 -4.738 -5.571 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -6.084 -5.926 -6.615 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -7.602 -8.378 -5.563 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -5.842 -8.310 -5.819 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -6.492 -8.766 -4.226 1.00 0.00 H new ATOM 868 N GLU A 56 -6.728 -3.681 -3.545 1.00 0.00 N ATOM 869 CA GLU A 56 -7.856 -2.769 -3.517 1.00 0.00 C ATOM 870 C GLU A 56 -8.741 -2.868 -4.744 1.00 0.00 C ATOM 871 O GLU A 56 -8.305 -2.598 -5.862 1.00 0.00 O ATOM 872 CB GLU A 56 -7.310 -1.356 -3.434 1.00 0.00 C ATOM 873 CG GLU A 56 -8.142 -0.410 -2.584 1.00 0.00 C ATOM 874 CD GLU A 56 -7.716 -0.403 -1.129 1.00 0.00 C ATOM 875 OE1 GLU A 56 -6.518 -0.633 -0.860 1.00 0.00 O ATOM 876 OE2 GLU A 56 -8.579 -0.165 -0.260 1.00 0.00 O ATOM 0 H GLU A 56 -6.063 -3.508 -4.299 1.00 0.00 H new ATOM 0 HA GLU A 56 -8.471 -3.033 -2.657 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -6.298 -1.394 -3.030 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -7.235 -0.949 -4.442 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -8.062 0.600 -2.987 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -9.192 -0.697 -2.650 1.00 0.00 H new ATOM 883 N VAL A 57 -9.998 -3.220 -4.530 1.00 0.00 N ATOM 884 CA VAL A 57 -10.943 -3.310 -5.627 1.00 0.00 C ATOM 885 C VAL A 57 -12.044 -2.273 -5.478 1.00 0.00 C ATOM 886 O VAL A 57 -12.808 -2.290 -4.516 1.00 0.00 O ATOM 887 CB VAL A 57 -11.583 -4.703 -5.739 1.00 0.00 C ATOM 888 CG1 VAL A 57 -12.107 -4.906 -7.147 1.00 0.00 C ATOM 889 CG2 VAL A 57 -10.590 -5.795 -5.369 1.00 0.00 C ATOM 0 H VAL A 57 -10.384 -3.446 -3.613 1.00 0.00 H new ATOM 0 HA VAL A 57 -10.373 -3.121 -6.537 1.00 0.00 H new ATOM 0 HB VAL A 57 -12.413 -4.766 -5.036 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -12.561 -5.894 -7.227 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -12.854 -4.144 -7.371 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -11.284 -4.826 -7.857 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -11.071 -6.769 -5.457 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -9.733 -5.751 -6.041 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -10.254 -5.648 -4.343 1.00 0.00 H new ATOM 899 N ASP A 58 -12.115 -1.365 -6.439 1.00 0.00 N ATOM 900 CA ASP A 58 -13.123 -0.320 -6.426 1.00 0.00 C ATOM 901 C ASP A 58 -14.271 -0.722 -7.340 1.00 0.00 C ATOM 902 O ASP A 58 -14.069 -0.979 -8.527 1.00 0.00 O ATOM 903 CB ASP A 58 -12.514 1.010 -6.872 1.00 0.00 C ATOM 904 CG ASP A 58 -13.530 2.134 -6.908 1.00 0.00 C ATOM 905 OD1 ASP A 58 -14.405 2.172 -6.016 1.00 0.00 O ATOM 906 OD2 ASP A 58 -13.452 2.979 -7.824 1.00 0.00 O ATOM 0 H ASP A 58 -11.484 -1.332 -7.240 1.00 0.00 H new ATOM 0 HA ASP A 58 -13.503 -0.192 -5.412 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -11.704 1.279 -6.195 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -12.075 0.890 -7.862 1.00 0.00 H new ATOM 911 N VAL A 59 -15.466 -0.818 -6.774 1.00 0.00 N ATOM 912 CA VAL A 59 -16.633 -1.234 -7.538 1.00 0.00 C ATOM 913 C VAL A 59 -16.923 -0.292 -8.703 1.00 0.00 C ATOM 914 O VAL A 59 -17.639 -0.656 -9.636 1.00 0.00 O ATOM 915 CB VAL A 59 -17.879 -1.351 -6.641 1.00 0.00 C ATOM 916 CG1 VAL A 59 -18.256 0.005 -6.067 1.00 0.00 C ATOM 917 CG2 VAL A 59 -19.042 -1.959 -7.413 1.00 0.00 C ATOM 0 H VAL A 59 -15.652 -0.614 -5.792 1.00 0.00 H new ATOM 0 HA VAL A 59 -16.398 -2.217 -7.947 1.00 0.00 H new ATOM 0 HB VAL A 59 -17.642 -2.015 -5.810 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -19.139 -0.100 -5.436 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -17.428 0.391 -5.472 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -18.472 0.697 -6.881 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -19.912 -2.033 -6.761 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -19.282 -1.327 -8.268 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -18.766 -2.953 -7.764 1.00 0.00 H new ATOM 927 N ASP A 60 -16.364 0.914 -8.658 1.00 0.00 N ATOM 928 CA ASP A 60 -16.567 1.875 -9.733 1.00 0.00 C ATOM 929 C ASP A 60 -15.891 1.375 -11.004 1.00 0.00 C ATOM 930 O ASP A 60 -16.412 1.539 -12.108 1.00 0.00 O ATOM 931 CB ASP A 60 -16.008 3.246 -9.347 1.00 0.00 C ATOM 932 CG ASP A 60 -16.730 4.382 -10.046 1.00 0.00 C ATOM 933 OD1 ASP A 60 -17.067 4.228 -11.240 1.00 0.00 O ATOM 934 OD2 ASP A 60 -16.961 5.426 -9.401 1.00 0.00 O ATOM 0 H ASP A 60 -15.773 1.245 -7.896 1.00 0.00 H new ATOM 0 HA ASP A 60 -17.638 1.979 -9.910 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -16.088 3.377 -8.268 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -14.947 3.286 -9.595 1.00 0.00 H new ATOM 939 N ASP A 61 -14.729 0.756 -10.831 1.00 0.00 N ATOM 940 CA ASP A 61 -13.965 0.213 -11.949 1.00 0.00 C ATOM 941 C ASP A 61 -14.187 -1.292 -12.067 1.00 0.00 C ATOM 942 O ASP A 61 -14.222 -1.846 -13.167 1.00 0.00 O ATOM 943 CB ASP A 61 -12.477 0.510 -11.759 1.00 0.00 C ATOM 944 CG ASP A 61 -12.211 1.983 -11.506 1.00 0.00 C ATOM 945 OD1 ASP A 61 -12.255 2.399 -10.330 1.00 0.00 O ATOM 946 OD2 ASP A 61 -11.961 2.716 -12.484 1.00 0.00 O ATOM 0 H ASP A 61 -14.292 0.617 -9.920 1.00 0.00 H new ATOM 0 HA ASP A 61 -14.308 0.688 -12.868 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -12.096 -0.075 -10.922 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -11.929 0.191 -12.646 1.00 0.00 H new ATOM 951 N ALA A 62 -14.333 -1.945 -10.919 1.00 0.00 N ATOM 952 CA ALA A 62 -14.555 -3.384 -10.871 1.00 0.00 C ATOM 953 C ALA A 62 -16.043 -3.692 -10.744 1.00 0.00 C ATOM 954 O ALA A 62 -16.451 -4.549 -9.959 1.00 0.00 O ATOM 955 CB ALA A 62 -13.780 -3.990 -9.711 1.00 0.00 C ATOM 0 H ALA A 62 -14.301 -1.496 -10.004 1.00 0.00 H new ATOM 0 HA ALA A 62 -14.196 -3.827 -11.800 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -13.951 -5.066 -9.682 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -12.716 -3.795 -9.843 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -14.117 -3.544 -8.776 1.00 0.00 H new ATOM 961 N GLN A 63 -16.847 -2.973 -11.518 1.00 0.00 N ATOM 962 CA GLN A 63 -18.295 -3.147 -11.496 1.00 0.00 C ATOM 963 C GLN A 63 -18.711 -4.495 -12.080 1.00 0.00 C ATOM 964 O GLN A 63 -19.874 -4.888 -11.973 1.00 0.00 O ATOM 965 CB GLN A 63 -18.971 -2.018 -12.273 1.00 0.00 C ATOM 966 CG GLN A 63 -20.416 -1.779 -11.865 1.00 0.00 C ATOM 967 CD GLN A 63 -20.849 -0.340 -12.064 1.00 0.00 C ATOM 968 OE1 GLN A 63 -20.294 0.378 -12.895 1.00 0.00 O ATOM 969 NE2 GLN A 63 -21.846 0.089 -11.299 1.00 0.00 N ATOM 0 H GLN A 63 -16.520 -2.261 -12.171 1.00 0.00 H new ATOM 0 HA GLN A 63 -18.615 -3.118 -10.454 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -18.404 -1.098 -12.128 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -18.936 -2.249 -13.338 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -21.066 -2.433 -12.445 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -20.543 -2.051 -10.817 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -22.277 -0.541 -10.623 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -22.180 1.049 -11.388 1.00 0.00 H new ATOM 978 N ASP A 64 -17.769 -5.200 -12.701 1.00 0.00 N ATOM 979 CA ASP A 64 -18.068 -6.496 -13.299 1.00 0.00 C ATOM 980 C ASP A 64 -17.743 -7.641 -12.341 1.00 0.00 C ATOM 981 O ASP A 64 -18.297 -8.733 -12.466 1.00 0.00 O ATOM 982 CB ASP A 64 -17.291 -6.673 -14.606 1.00 0.00 C ATOM 983 CG ASP A 64 -17.991 -6.025 -15.784 1.00 0.00 C ATOM 984 OD1 ASP A 64 -17.927 -4.783 -15.902 1.00 0.00 O ATOM 985 OD2 ASP A 64 -18.606 -6.758 -16.586 1.00 0.00 O ATOM 0 H ASP A 64 -16.800 -4.898 -12.802 1.00 0.00 H new ATOM 0 HA ASP A 64 -19.137 -6.523 -13.511 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -16.296 -6.242 -14.496 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -17.158 -7.736 -14.806 1.00 0.00 H new ATOM 990 N VAL A 65 -16.853 -7.393 -11.381 1.00 0.00 N ATOM 991 CA VAL A 65 -16.486 -8.426 -10.418 1.00 0.00 C ATOM 992 C VAL A 65 -17.547 -8.573 -9.331 1.00 0.00 C ATOM 993 O VAL A 65 -17.948 -9.688 -8.998 1.00 0.00 O ATOM 994 CB VAL A 65 -15.106 -8.178 -9.763 1.00 0.00 C ATOM 995 CG1 VAL A 65 -13.989 -8.628 -10.693 1.00 0.00 C ATOM 996 CG2 VAL A 65 -14.924 -6.721 -9.379 1.00 0.00 C ATOM 0 H VAL A 65 -16.380 -6.499 -11.251 1.00 0.00 H new ATOM 0 HA VAL A 65 -16.420 -9.352 -10.989 1.00 0.00 H new ATOM 0 HB VAL A 65 -15.062 -8.768 -8.848 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -13.025 -8.447 -10.218 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -14.096 -9.692 -10.902 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -14.045 -8.068 -11.626 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -13.944 -6.585 -8.922 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -14.999 -6.098 -10.270 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -15.699 -6.432 -8.669 1.00 0.00 H new ATOM 1006 N ALA A 66 -17.993 -7.452 -8.759 1.00 0.00 N ATOM 1007 CA ALA A 66 -18.994 -7.482 -7.694 1.00 0.00 C ATOM 1008 C ALA A 66 -20.195 -8.347 -8.068 1.00 0.00 C ATOM 1009 O ALA A 66 -20.539 -9.285 -7.351 1.00 0.00 O ATOM 1010 CB ALA A 66 -19.452 -6.064 -7.386 1.00 0.00 C ATOM 0 H ALA A 66 -17.677 -6.517 -9.015 1.00 0.00 H new ATOM 0 HA ALA A 66 -18.532 -7.924 -6.811 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -20.198 -6.087 -6.592 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -18.598 -5.468 -7.064 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -19.888 -5.620 -8.281 1.00 0.00 H new ATOM 1016 N PRO A 67 -20.849 -8.042 -9.196 1.00 0.00 N ATOM 1017 CA PRO A 67 -22.014 -8.800 -9.662 1.00 0.00 C ATOM 1018 C PRO A 67 -21.738 -10.299 -9.719 1.00 0.00 C ATOM 1019 O PRO A 67 -22.643 -11.115 -9.552 1.00 0.00 O ATOM 1020 CB PRO A 67 -22.261 -8.232 -11.062 1.00 0.00 C ATOM 1021 CG PRO A 67 -21.722 -6.846 -10.986 1.00 0.00 C ATOM 1022 CD PRO A 67 -20.508 -6.939 -10.113 1.00 0.00 C ATOM 0 HA PRO A 67 -22.870 -8.700 -8.995 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -21.751 -8.818 -11.827 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -23.322 -8.235 -11.313 1.00 0.00 H new ATOM 0 HG2 PRO A 67 -21.466 -6.469 -11.976 1.00 0.00 H new ATOM 0 HG3 PRO A 67 -22.458 -6.161 -10.565 1.00 0.00 H new ATOM 0 HD2 PRO A 67 -19.610 -7.157 -10.691 1.00 0.00 H new ATOM 0 HD3 PRO A 67 -20.324 -6.009 -9.576 1.00 0.00 H new ATOM 1030 N LYS A 68 -20.475 -10.652 -9.928 1.00 0.00 N ATOM 1031 CA LYS A 68 -20.068 -12.051 -9.978 1.00 0.00 C ATOM 1032 C LYS A 68 -19.987 -12.649 -8.572 1.00 0.00 C ATOM 1033 O LYS A 68 -19.928 -13.867 -8.413 1.00 0.00 O ATOM 1034 CB LYS A 68 -18.715 -12.192 -10.679 1.00 0.00 C ATOM 1035 CG LYS A 68 -18.828 -12.593 -12.140 1.00 0.00 C ATOM 1036 CD LYS A 68 -17.462 -12.823 -12.767 1.00 0.00 C ATOM 1037 CE LYS A 68 -17.488 -13.986 -13.747 1.00 0.00 C ATOM 1038 NZ LYS A 68 -17.122 -15.273 -13.095 1.00 0.00 N ATOM 0 H LYS A 68 -19.714 -9.987 -10.066 1.00 0.00 H new ATOM 0 HA LYS A 68 -20.822 -12.597 -10.545 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -18.179 -11.245 -10.611 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -18.117 -12.935 -10.152 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -19.424 -13.502 -12.223 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -19.355 -11.814 -12.691 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -17.140 -11.918 -13.283 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -16.730 -13.021 -11.984 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -18.484 -14.071 -14.183 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -16.797 -13.785 -14.566 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -17.152 -16.039 -13.798 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -16.162 -15.202 -12.701 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -17.796 -15.478 -12.330 1.00 0.00 H new ATOM 1052 N TYR A 69 -19.971 -11.781 -7.557 1.00 0.00 N ATOM 1053 CA TYR A 69 -19.878 -12.210 -6.155 1.00 0.00 C ATOM 1054 C TYR A 69 -21.106 -11.781 -5.351 1.00 0.00 C ATOM 1055 O TYR A 69 -21.274 -12.178 -4.197 1.00 0.00 O ATOM 1056 CB TYR A 69 -18.636 -11.594 -5.517 1.00 0.00 C ATOM 1057 CG TYR A 69 -17.334 -12.128 -6.066 1.00 0.00 C ATOM 1058 CD1 TYR A 69 -17.015 -13.476 -5.969 1.00 0.00 C ATOM 1059 CD2 TYR A 69 -16.424 -11.282 -6.689 1.00 0.00 C ATOM 1060 CE1 TYR A 69 -15.828 -13.965 -6.478 1.00 0.00 C ATOM 1061 CE2 TYR A 69 -15.236 -11.764 -7.198 1.00 0.00 C ATOM 1062 CZ TYR A 69 -14.943 -13.106 -7.091 1.00 0.00 C ATOM 1063 OH TYR A 69 -13.759 -13.589 -7.598 1.00 0.00 O ATOM 0 H TYR A 69 -20.022 -10.770 -7.679 1.00 0.00 H new ATOM 0 HA TYR A 69 -19.819 -13.298 -6.143 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -18.664 -10.514 -5.662 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -18.666 -11.773 -4.442 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -17.706 -14.153 -5.488 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -16.651 -10.230 -6.776 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -15.595 -15.016 -6.396 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -14.539 -11.093 -7.678 1.00 0.00 H new ATOM 0 HH TYR A 69 -13.121 -13.725 -6.867 1.00 0.00 H new ATOM 1073 N GLY A 70 -21.959 -10.979 -5.969 1.00 0.00 N ATOM 1074 CA GLY A 70 -23.163 -10.515 -5.303 1.00 0.00 C ATOM 1075 C GLY A 70 -22.882 -9.614 -4.112 1.00 0.00 C ATOM 1076 O GLY A 70 -23.566 -9.701 -3.092 1.00 0.00 O ATOM 0 H GLY A 70 -21.840 -10.639 -6.923 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -23.781 -9.975 -6.020 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -23.740 -11.377 -4.969 1.00 0.00 H new ATOM 1080 N ILE A 71 -21.888 -8.735 -4.236 1.00 0.00 N ATOM 1081 CA ILE A 71 -21.545 -7.810 -3.159 1.00 0.00 C ATOM 1082 C ILE A 71 -22.524 -6.640 -3.114 1.00 0.00 C ATOM 1083 O ILE A 71 -22.228 -5.554 -3.615 1.00 0.00 O ATOM 1084 CB ILE A 71 -20.115 -7.257 -3.323 1.00 0.00 C ATOM 1085 CG1 ILE A 71 -19.112 -8.402 -3.446 1.00 0.00 C ATOM 1086 CG2 ILE A 71 -19.753 -6.350 -2.153 1.00 0.00 C ATOM 1087 CD1 ILE A 71 -17.747 -7.952 -3.918 1.00 0.00 C ATOM 0 H ILE A 71 -21.308 -8.645 -5.070 1.00 0.00 H new ATOM 0 HA ILE A 71 -21.603 -8.373 -2.227 1.00 0.00 H new ATOM 0 HB ILE A 71 -20.077 -6.665 -4.238 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -19.011 -8.893 -2.478 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -19.503 -9.145 -4.141 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -18.740 -5.970 -2.287 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -20.452 -5.514 -2.111 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -19.808 -6.916 -1.223 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -17.083 -8.814 -3.984 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -17.837 -7.487 -4.900 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -17.337 -7.231 -3.211 1.00 0.00 H new ATOM 1099 N ARG A 72 -23.694 -6.871 -2.535 1.00 0.00 N ATOM 1100 CA ARG A 72 -24.714 -5.833 -2.454 1.00 0.00 C ATOM 1101 C ARG A 72 -24.521 -4.949 -1.223 1.00 0.00 C ATOM 1102 O ARG A 72 -25.223 -5.093 -0.221 1.00 0.00 O ATOM 1103 CB ARG A 72 -26.105 -6.475 -2.436 1.00 0.00 C ATOM 1104 CG ARG A 72 -27.247 -5.472 -2.405 1.00 0.00 C ATOM 1105 CD ARG A 72 -28.573 -6.154 -2.104 1.00 0.00 C ATOM 1106 NE ARG A 72 -29.696 -5.493 -2.765 1.00 0.00 N ATOM 1107 CZ ARG A 72 -29.976 -5.622 -4.060 1.00 0.00 C ATOM 1108 NH1 ARG A 72 -29.217 -6.383 -4.839 1.00 0.00 N ATOM 1109 NH2 ARG A 72 -31.022 -4.994 -4.577 1.00 0.00 N ATOM 0 H ARG A 72 -23.960 -7.762 -2.116 1.00 0.00 H new ATOM 0 HA ARG A 72 -24.620 -5.195 -3.333 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -26.214 -7.107 -3.317 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -26.183 -7.126 -1.565 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -27.046 -4.712 -1.649 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -27.309 -4.959 -3.364 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -28.526 -7.194 -2.425 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -28.740 -6.160 -1.027 1.00 0.00 H new ATOM 0 HE ARG A 72 -30.302 -4.897 -2.200 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -28.414 -6.873 -4.446 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -29.437 -6.477 -5.830 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -31.612 -4.412 -3.983 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -31.237 -5.093 -5.569 1.00 0.00 H new ATOM 1123 N GLY A 73 -23.564 -4.027 -1.318 1.00 0.00 N ATOM 1124 CA GLY A 73 -23.292 -3.120 -0.216 1.00 0.00 C ATOM 1125 C GLY A 73 -21.814 -2.823 -0.025 1.00 0.00 C ATOM 1126 O GLY A 73 -20.956 -3.506 -0.583 1.00 0.00 O ATOM 0 H GLY A 73 -22.973 -3.893 -2.138 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -23.823 -2.184 -0.387 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -23.690 -3.549 0.704 1.00 0.00 H new ATOM 1130 N ILE A 74 -21.526 -1.791 0.767 1.00 0.00 N ATOM 1131 CA ILE A 74 -20.151 -1.380 1.046 1.00 0.00 C ATOM 1132 C ILE A 74 -20.039 -0.783 2.452 1.00 0.00 C ATOM 1133 O ILE A 74 -21.024 -0.271 2.984 1.00 0.00 O ATOM 1134 CB ILE A 74 -19.669 -0.350 0.006 1.00 0.00 C ATOM 1135 CG1 ILE A 74 -20.672 0.801 -0.106 1.00 0.00 C ATOM 1136 CG2 ILE A 74 -19.485 -1.024 -1.345 1.00 0.00 C ATOM 1137 CD1 ILE A 74 -20.230 1.901 -1.046 1.00 0.00 C ATOM 0 H ILE A 74 -22.233 -1.220 1.230 1.00 0.00 H new ATOM 0 HA ILE A 74 -19.519 -2.266 0.986 1.00 0.00 H new ATOM 0 HB ILE A 74 -18.711 0.057 0.330 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -21.629 0.406 -0.447 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -20.837 1.225 0.884 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -19.144 -0.289 -2.075 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -18.744 -1.819 -1.257 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -20.434 -1.447 -1.673 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -20.990 2.682 -1.075 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -19.289 2.323 -0.695 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -20.093 1.491 -2.047 1.00 0.00 H new ATOM 1149 N PRO A 75 -18.846 -0.832 3.087 1.00 0.00 N ATOM 1150 CA PRO A 75 -17.632 -1.423 2.516 1.00 0.00 C ATOM 1151 C PRO A 75 -17.528 -2.921 2.783 1.00 0.00 C ATOM 1152 O PRO A 75 -17.411 -3.349 3.932 1.00 0.00 O ATOM 1153 CB PRO A 75 -16.527 -0.686 3.270 1.00 0.00 C ATOM 1154 CG PRO A 75 -17.103 -0.444 4.623 1.00 0.00 C ATOM 1155 CD PRO A 75 -18.596 -0.295 4.439 1.00 0.00 C ATOM 0 HA PRO A 75 -17.595 -1.324 1.431 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -15.617 -1.283 3.326 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -16.264 0.250 2.776 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -16.877 -1.273 5.294 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -16.677 0.454 5.070 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -19.149 -0.850 5.197 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -18.906 0.747 4.518 1.00 0.00 H new ATOM 1163 N THR A 76 -17.564 -3.716 1.720 1.00 0.00 N ATOM 1164 CA THR A 76 -17.460 -5.163 1.849 1.00 0.00 C ATOM 1165 C THR A 76 -16.006 -5.627 1.851 1.00 0.00 C ATOM 1166 O THR A 76 -15.197 -5.175 1.041 1.00 0.00 O ATOM 1167 CB THR A 76 -18.221 -5.858 0.719 1.00 0.00 C ATOM 1168 OG1 THR A 76 -19.255 -5.027 0.224 1.00 0.00 O ATOM 1169 CG2 THR A 76 -18.849 -7.169 1.141 1.00 0.00 C ATOM 0 H THR A 76 -17.664 -3.383 0.761 1.00 0.00 H new ATOM 0 HA THR A 76 -17.905 -5.435 2.806 1.00 0.00 H new ATOM 0 HB THR A 76 -17.475 -6.060 -0.050 1.00 0.00 H new ATOM 0 HG1 THR A 76 -19.792 -4.692 0.972 1.00 0.00 H new ATOM 0 HG21 THR A 76 -19.373 -7.611 0.294 1.00 0.00 H new ATOM 0 HG22 THR A 76 -18.071 -7.852 1.482 1.00 0.00 H new ATOM 0 HG23 THR A 76 -19.555 -6.990 1.952 1.00 0.00 H new ATOM 1177 N LEU A 77 -15.692 -6.559 2.740 1.00 0.00 N ATOM 1178 CA LEU A 77 -14.353 -7.118 2.816 1.00 0.00 C ATOM 1179 C LEU A 77 -14.394 -8.542 2.293 1.00 0.00 C ATOM 1180 O LEU A 77 -15.192 -9.361 2.749 1.00 0.00 O ATOM 1181 CB LEU A 77 -13.818 -7.074 4.255 1.00 0.00 C ATOM 1182 CG LEU A 77 -12.566 -6.215 4.459 1.00 0.00 C ATOM 1183 CD1 LEU A 77 -12.905 -4.737 4.355 1.00 0.00 C ATOM 1184 CD2 LEU A 77 -11.926 -6.519 5.807 1.00 0.00 C ATOM 0 H LEU A 77 -16.349 -6.943 3.419 1.00 0.00 H new ATOM 0 HA LEU A 77 -13.674 -6.524 2.205 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -14.607 -6.699 4.908 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -13.597 -8.092 4.575 1.00 0.00 H new ATOM 0 HG LEU A 77 -11.852 -6.459 3.672 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -12.002 -4.145 4.503 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -13.319 -4.527 3.369 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -13.638 -4.477 5.119 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -11.038 -5.900 5.936 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -12.637 -6.304 6.604 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -11.644 -7.571 5.847 1.00 0.00 H new ATOM 1196 N LEU A 78 -13.552 -8.824 1.309 1.00 0.00 N ATOM 1197 CA LEU A 78 -13.526 -10.144 0.696 1.00 0.00 C ATOM 1198 C LEU A 78 -12.216 -10.869 0.970 1.00 0.00 C ATOM 1199 O LEU A 78 -11.130 -10.302 0.841 1.00 0.00 O ATOM 1200 CB LEU A 78 -13.733 -10.022 -0.820 1.00 0.00 C ATOM 1201 CG LEU A 78 -15.188 -9.881 -1.301 1.00 0.00 C ATOM 1202 CD1 LEU A 78 -15.297 -10.251 -2.772 1.00 0.00 C ATOM 1203 CD2 LEU A 78 -16.137 -10.740 -0.475 1.00 0.00 C ATOM 0 H LEU A 78 -12.882 -8.161 0.920 1.00 0.00 H new ATOM 0 HA LEU A 78 -14.335 -10.727 1.138 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -13.171 -9.158 -1.173 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -13.299 -10.901 -1.296 1.00 0.00 H new ATOM 0 HG LEU A 78 -15.479 -8.839 -1.170 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -16.332 -10.146 -3.098 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -14.662 -9.589 -3.362 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -14.975 -11.283 -2.912 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -17.155 -10.615 -0.843 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -15.847 -11.787 -0.560 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -16.089 -10.433 0.570 1.00 0.00 H new ATOM 1215 N LEU A 79 -12.334 -12.136 1.339 1.00 0.00 N ATOM 1216 CA LEU A 79 -11.177 -12.966 1.623 1.00 0.00 C ATOM 1217 C LEU A 79 -11.091 -14.096 0.606 1.00 0.00 C ATOM 1218 O LEU A 79 -12.012 -14.901 0.489 1.00 0.00 O ATOM 1219 CB LEU A 79 -11.276 -13.539 3.039 1.00 0.00 C ATOM 1220 CG LEU A 79 -10.472 -12.797 4.109 1.00 0.00 C ATOM 1221 CD1 LEU A 79 -8.982 -13.023 3.913 1.00 0.00 C ATOM 1222 CD2 LEU A 79 -10.799 -11.311 4.088 1.00 0.00 C ATOM 0 H LEU A 79 -13.229 -12.613 1.449 1.00 0.00 H new ATOM 0 HA LEU A 79 -10.276 -12.356 1.554 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -12.325 -13.545 3.337 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -10.945 -14.577 3.016 1.00 0.00 H new ATOM 0 HG LEU A 79 -10.750 -13.195 5.085 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -8.428 -12.487 4.684 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -8.763 -14.088 3.984 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -8.684 -12.656 2.931 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -10.218 -10.800 4.856 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -10.552 -10.898 3.110 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -11.862 -11.170 4.283 1.00 0.00 H new ATOM 1234 N PHE A 80 -9.991 -14.141 -0.137 1.00 0.00 N ATOM 1235 CA PHE A 80 -9.807 -15.164 -1.161 1.00 0.00 C ATOM 1236 C PHE A 80 -8.678 -16.128 -0.804 1.00 0.00 C ATOM 1237 O PHE A 80 -7.699 -15.752 -0.162 1.00 0.00 O ATOM 1238 CB PHE A 80 -9.515 -14.497 -2.506 1.00 0.00 C ATOM 1239 CG PHE A 80 -10.738 -13.950 -3.185 1.00 0.00 C ATOM 1240 CD1 PHE A 80 -11.188 -12.670 -2.898 1.00 0.00 C ATOM 1241 CD2 PHE A 80 -11.438 -14.712 -4.108 1.00 0.00 C ATOM 1242 CE1 PHE A 80 -12.313 -12.160 -3.519 1.00 0.00 C ATOM 1243 CE2 PHE A 80 -12.564 -14.206 -4.733 1.00 0.00 C ATOM 1244 CZ PHE A 80 -13.002 -12.928 -4.437 1.00 0.00 C ATOM 0 H PHE A 80 -9.216 -13.484 -0.051 1.00 0.00 H new ATOM 0 HA PHE A 80 -10.728 -15.743 -1.225 1.00 0.00 H new ATOM 0 HB2 PHE A 80 -8.802 -13.687 -2.353 1.00 0.00 H new ATOM 0 HB3 PHE A 80 -9.037 -15.222 -3.165 1.00 0.00 H new ATOM 0 HD1 PHE A 80 -10.653 -12.065 -2.181 1.00 0.00 H new ATOM 0 HD2 PHE A 80 -11.101 -15.711 -4.342 1.00 0.00 H new ATOM 0 HE1 PHE A 80 -12.653 -11.162 -3.286 1.00 0.00 H new ATOM 0 HE2 PHE A 80 -13.100 -14.808 -5.451 1.00 0.00 H new ATOM 0 HZ PHE A 80 -13.881 -12.531 -4.923 1.00 0.00 H new ATOM 1254 N LYS A 81 -8.833 -17.377 -1.231 1.00 0.00 N ATOM 1255 CA LYS A 81 -7.844 -18.417 -0.972 1.00 0.00 C ATOM 1256 C LYS A 81 -7.806 -19.411 -2.128 1.00 0.00 C ATOM 1257 O LYS A 81 -8.773 -20.135 -2.362 1.00 0.00 O ATOM 1258 CB LYS A 81 -8.178 -19.146 0.330 1.00 0.00 C ATOM 1259 CG LYS A 81 -6.955 -19.554 1.135 1.00 0.00 C ATOM 1260 CD LYS A 81 -7.176 -19.344 2.624 1.00 0.00 C ATOM 1261 CE LYS A 81 -5.866 -19.389 3.394 1.00 0.00 C ATOM 1262 NZ LYS A 81 -5.059 -20.591 3.047 1.00 0.00 N ATOM 0 H LYS A 81 -9.643 -17.695 -1.763 1.00 0.00 H new ATOM 0 HA LYS A 81 -6.864 -17.950 -0.877 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -8.808 -18.503 0.944 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -8.762 -20.036 0.098 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -6.725 -20.602 0.944 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -6.092 -18.974 0.808 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -7.663 -18.383 2.789 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -7.849 -20.112 3.005 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -5.288 -18.490 3.180 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -6.074 -19.388 4.464 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -4.311 -20.724 3.758 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -5.674 -21.429 3.030 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -4.627 -20.460 2.110 1.00 0.00 H new ATOM 1276 N ASN A 82 -6.695 -19.442 -2.857 1.00 0.00 N ATOM 1277 CA ASN A 82 -6.566 -20.352 -3.991 1.00 0.00 C ATOM 1278 C ASN A 82 -7.638 -20.050 -5.033 1.00 0.00 C ATOM 1279 O ASN A 82 -8.276 -20.957 -5.569 1.00 0.00 O ATOM 1280 CB ASN A 82 -6.678 -21.807 -3.525 1.00 0.00 C ATOM 1281 CG ASN A 82 -5.898 -22.073 -2.251 1.00 0.00 C ATOM 1282 OD1 ASN A 82 -6.453 -22.531 -1.254 1.00 0.00 O ATOM 1283 ND2 ASN A 82 -4.603 -21.781 -2.280 1.00 0.00 N ATOM 0 H ASN A 82 -5.879 -18.855 -2.686 1.00 0.00 H new ATOM 0 HA ASN A 82 -5.585 -20.206 -4.443 1.00 0.00 H new ATOM 0 HB2 ASN A 82 -7.727 -22.053 -3.362 1.00 0.00 H new ATOM 0 HB3 ASN A 82 -6.315 -22.466 -4.313 1.00 0.00 H new ATOM 0 HD21 ASN A 82 -4.027 -21.935 -1.453 1.00 0.00 H new ATOM 0 HD22 ASN A 82 -4.184 -21.403 -3.130 1.00 0.00 H new ATOM 1290 N GLY A 83 -7.809 -18.766 -5.336 1.00 0.00 N ATOM 1291 CA GLY A 83 -8.785 -18.358 -6.328 1.00 0.00 C ATOM 1292 C GLY A 83 -10.225 -18.513 -5.867 1.00 0.00 C ATOM 1293 O GLY A 83 -11.153 -18.260 -6.636 1.00 0.00 O ATOM 0 H GLY A 83 -7.287 -18.000 -4.910 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -8.608 -17.316 -6.592 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -8.637 -18.946 -7.234 1.00 0.00 H new ATOM 1297 N GLU A 84 -10.424 -18.944 -4.623 1.00 0.00 N ATOM 1298 CA GLU A 84 -11.772 -19.139 -4.103 1.00 0.00 C ATOM 1299 C GLU A 84 -12.003 -18.351 -2.815 1.00 0.00 C ATOM 1300 O GLU A 84 -11.147 -18.308 -1.933 1.00 0.00 O ATOM 1301 CB GLU A 84 -12.030 -20.628 -3.856 1.00 0.00 C ATOM 1302 CG GLU A 84 -13.481 -21.038 -4.051 1.00 0.00 C ATOM 1303 CD GLU A 84 -13.863 -22.245 -3.218 1.00 0.00 C ATOM 1304 OE1 GLU A 84 -14.167 -22.067 -2.020 1.00 0.00 O ATOM 1305 OE2 GLU A 84 -13.859 -23.368 -3.763 1.00 0.00 O ATOM 0 H GLU A 84 -9.677 -19.162 -3.964 1.00 0.00 H new ATOM 0 HA GLU A 84 -12.471 -18.766 -4.852 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -11.403 -21.213 -4.529 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -11.725 -20.877 -2.840 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -14.129 -20.201 -3.790 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -13.654 -21.259 -5.104 1.00 0.00 H new ATOM 1312 N VAL A 85 -13.185 -17.749 -2.712 1.00 0.00 N ATOM 1313 CA VAL A 85 -13.555 -16.969 -1.533 1.00 0.00 C ATOM 1314 C VAL A 85 -13.701 -17.877 -0.309 1.00 0.00 C ATOM 1315 O VAL A 85 -14.561 -18.758 -0.285 1.00 0.00 O ATOM 1316 CB VAL A 85 -14.878 -16.214 -1.759 1.00 0.00 C ATOM 1317 CG1 VAL A 85 -15.198 -15.327 -0.566 1.00 0.00 C ATOM 1318 CG2 VAL A 85 -14.801 -15.392 -3.034 1.00 0.00 C ATOM 0 H VAL A 85 -13.906 -17.786 -3.433 1.00 0.00 H new ATOM 0 HA VAL A 85 -12.758 -16.246 -1.358 1.00 0.00 H new ATOM 0 HB VAL A 85 -15.682 -16.943 -1.865 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -16.136 -14.802 -0.744 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -15.291 -15.941 0.330 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -14.397 -14.601 -0.427 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -15.742 -14.863 -3.183 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -13.988 -14.671 -2.953 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -14.618 -16.052 -3.882 1.00 0.00 H new ATOM 1328 N ALA A 86 -12.861 -17.670 0.704 1.00 0.00 N ATOM 1329 CA ALA A 86 -12.918 -18.490 1.912 1.00 0.00 C ATOM 1330 C ALA A 86 -13.363 -17.683 3.127 1.00 0.00 C ATOM 1331 O ALA A 86 -13.276 -18.149 4.264 1.00 0.00 O ATOM 1332 CB ALA A 86 -11.568 -19.144 2.166 1.00 0.00 C ATOM 0 H ALA A 86 -12.140 -16.949 0.713 1.00 0.00 H new ATOM 0 HA ALA A 86 -13.665 -19.267 1.751 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -11.623 -19.752 3.069 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -11.304 -19.776 1.318 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -10.808 -18.373 2.294 1.00 0.00 H new ATOM 1338 N ALA A 87 -13.846 -16.475 2.875 1.00 0.00 N ATOM 1339 CA ALA A 87 -14.317 -15.596 3.939 1.00 0.00 C ATOM 1340 C ALA A 87 -14.973 -14.342 3.366 1.00 0.00 C ATOM 1341 O ALA A 87 -14.467 -13.750 2.413 1.00 0.00 O ATOM 1342 CB ALA A 87 -13.168 -15.229 4.865 1.00 0.00 C ATOM 0 H ALA A 87 -13.923 -16.078 1.938 1.00 0.00 H new ATOM 0 HA ALA A 87 -15.072 -16.131 4.516 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -13.533 -14.573 5.655 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -12.754 -16.135 5.308 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -12.392 -14.716 4.297 1.00 0.00 H new ATOM 1348 N THR A 88 -16.091 -13.929 3.957 1.00 0.00 N ATOM 1349 CA THR A 88 -16.796 -12.734 3.498 1.00 0.00 C ATOM 1350 C THR A 88 -17.244 -11.875 4.675 1.00 0.00 C ATOM 1351 O THR A 88 -17.936 -12.351 5.574 1.00 0.00 O ATOM 1352 CB THR A 88 -18.008 -13.120 2.647 1.00 0.00 C ATOM 1353 OG1 THR A 88 -18.877 -12.014 2.480 1.00 0.00 O ATOM 1354 CG2 THR A 88 -18.820 -14.255 3.234 1.00 0.00 C ATOM 0 H THR A 88 -16.527 -14.400 4.750 1.00 0.00 H new ATOM 0 HA THR A 88 -16.103 -12.153 2.889 1.00 0.00 H new ATOM 0 HB THR A 88 -17.595 -13.447 1.693 1.00 0.00 H new ATOM 0 HG1 THR A 88 -19.644 -12.281 1.932 1.00 0.00 H new ATOM 0 HG21 THR A 88 -19.663 -14.476 2.579 1.00 0.00 H new ATOM 0 HG22 THR A 88 -18.192 -15.141 3.328 1.00 0.00 H new ATOM 0 HG23 THR A 88 -19.190 -13.967 4.218 1.00 0.00 H new ATOM 1362 N LYS A 89 -16.856 -10.601 4.659 1.00 0.00 N ATOM 1363 CA LYS A 89 -17.227 -9.672 5.719 1.00 0.00 C ATOM 1364 C LYS A 89 -17.877 -8.425 5.126 1.00 0.00 C ATOM 1365 O LYS A 89 -17.441 -7.918 4.093 1.00 0.00 O ATOM 1366 CB LYS A 89 -15.997 -9.284 6.543 1.00 0.00 C ATOM 1367 CG LYS A 89 -16.194 -9.444 8.043 1.00 0.00 C ATOM 1368 CD LYS A 89 -17.043 -8.322 8.623 1.00 0.00 C ATOM 1369 CE LYS A 89 -16.791 -8.147 10.113 1.00 0.00 C ATOM 1370 NZ LYS A 89 -18.013 -7.690 10.829 1.00 0.00 N ATOM 0 H LYS A 89 -16.284 -10.190 3.921 1.00 0.00 H new ATOM 0 HA LYS A 89 -17.945 -10.164 6.375 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -15.152 -9.896 6.229 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -15.738 -8.247 6.327 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -16.670 -10.403 8.247 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -15.223 -9.458 8.538 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -16.821 -7.390 8.103 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -18.098 -8.538 8.454 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -16.452 -9.092 10.538 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -15.989 -7.424 10.264 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -17.802 -7.582 11.842 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -18.322 -6.776 10.440 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -18.770 -8.392 10.706 1.00 0.00 H new ATOM 1384 N VAL A 90 -18.926 -7.942 5.779 1.00 0.00 N ATOM 1385 CA VAL A 90 -19.646 -6.762 5.311 1.00 0.00 C ATOM 1386 C VAL A 90 -19.645 -5.652 6.356 1.00 0.00 C ATOM 1387 O VAL A 90 -19.687 -5.921 7.556 1.00 0.00 O ATOM 1388 CB VAL A 90 -21.100 -7.108 4.945 1.00 0.00 C ATOM 1389 CG1 VAL A 90 -21.772 -5.931 4.257 1.00 0.00 C ATOM 1390 CG2 VAL A 90 -21.142 -8.345 4.063 1.00 0.00 C ATOM 0 H VAL A 90 -19.299 -8.349 6.637 1.00 0.00 H new ATOM 0 HA VAL A 90 -19.124 -6.409 4.422 1.00 0.00 H new ATOM 0 HB VAL A 90 -21.648 -7.322 5.862 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -22.799 -6.195 4.006 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -21.771 -5.070 4.925 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -21.228 -5.683 3.346 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -22.177 -8.578 3.812 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -20.580 -8.159 3.148 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -20.700 -9.187 4.596 1.00 0.00 H new ATOM 1400 N GLY A 91 -19.606 -4.402 5.896 1.00 0.00 N ATOM 1401 CA GLY A 91 -19.604 -3.279 6.810 1.00 0.00 C ATOM 1402 C GLY A 91 -18.231 -2.969 7.368 1.00 0.00 C ATOM 1403 O GLY A 91 -17.308 -3.777 7.268 1.00 0.00 O ATOM 0 H GLY A 91 -19.576 -4.151 4.908 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -19.987 -2.398 6.295 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -20.286 -3.488 7.634 1.00 0.00 H new ATOM 1407 N ALA A 92 -18.099 -1.777 7.938 1.00 0.00 N ATOM 1408 CA ALA A 92 -16.833 -1.324 8.499 1.00 0.00 C ATOM 1409 C ALA A 92 -16.417 -2.161 9.701 1.00 0.00 C ATOM 1410 O ALA A 92 -17.217 -2.913 10.259 1.00 0.00 O ATOM 1411 CB ALA A 92 -16.933 0.142 8.891 1.00 0.00 C ATOM 0 H ALA A 92 -18.860 -1.103 8.024 1.00 0.00 H new ATOM 0 HA ALA A 92 -16.067 -1.444 7.733 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -15.982 0.472 9.309 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -17.169 0.739 8.010 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -17.720 0.267 9.635 1.00 0.00 H new ATOM 1417 N LEU A 93 -15.155 -2.021 10.091 1.00 0.00 N ATOM 1418 CA LEU A 93 -14.612 -2.758 11.221 1.00 0.00 C ATOM 1419 C LEU A 93 -13.314 -2.120 11.705 1.00 0.00 C ATOM 1420 O LEU A 93 -12.528 -1.608 10.907 1.00 0.00 O ATOM 1421 CB LEU A 93 -14.365 -4.220 10.837 1.00 0.00 C ATOM 1422 CG LEU A 93 -13.753 -4.435 9.450 1.00 0.00 C ATOM 1423 CD1 LEU A 93 -13.004 -5.758 9.394 1.00 0.00 C ATOM 1424 CD2 LEU A 93 -14.832 -4.388 8.378 1.00 0.00 C ATOM 0 H LEU A 93 -14.487 -1.399 9.636 1.00 0.00 H new ATOM 0 HA LEU A 93 -15.341 -2.724 12.031 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -13.706 -4.668 11.581 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -15.312 -4.757 10.886 1.00 0.00 H new ATOM 0 HG LEU A 93 -13.043 -3.630 9.260 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -12.576 -5.892 8.400 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -12.205 -5.755 10.135 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -13.693 -6.575 9.606 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -14.379 -4.543 7.399 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -15.566 -5.171 8.566 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -15.325 -3.416 8.400 1.00 0.00 H new ATOM 1436 N SER A 94 -13.096 -2.156 13.014 1.00 0.00 N ATOM 1437 CA SER A 94 -11.890 -1.585 13.600 1.00 0.00 C ATOM 1438 C SER A 94 -10.652 -2.339 13.124 1.00 0.00 C ATOM 1439 O SER A 94 -10.752 -3.263 12.317 1.00 0.00 O ATOM 1440 CB SER A 94 -11.977 -1.617 15.127 1.00 0.00 C ATOM 1441 OG SER A 94 -12.747 -0.534 15.618 1.00 0.00 O ATOM 0 H SER A 94 -13.737 -2.574 13.688 1.00 0.00 H new ATOM 0 HA SER A 94 -11.807 -0.548 13.275 1.00 0.00 H new ATOM 0 HB2 SER A 94 -12.422 -2.559 15.449 1.00 0.00 H new ATOM 0 HB3 SER A 94 -10.974 -1.576 15.552 1.00 0.00 H new ATOM 0 HG SER A 94 -12.788 -0.579 16.596 1.00 0.00 H new ATOM 1447 N LYS A 95 -9.487 -1.940 13.623 1.00 0.00 N ATOM 1448 CA LYS A 95 -8.231 -2.580 13.238 1.00 0.00 C ATOM 1449 C LYS A 95 -8.094 -3.963 13.868 1.00 0.00 C ATOM 1450 O LYS A 95 -7.462 -4.853 13.295 1.00 0.00 O ATOM 1451 CB LYS A 95 -7.041 -1.707 13.637 1.00 0.00 C ATOM 1452 CG LYS A 95 -5.701 -2.253 13.164 1.00 0.00 C ATOM 1453 CD LYS A 95 -4.801 -1.148 12.634 1.00 0.00 C ATOM 1454 CE LYS A 95 -3.456 -1.693 12.177 1.00 0.00 C ATOM 1455 NZ LYS A 95 -2.600 -0.632 11.577 1.00 0.00 N ATOM 0 H LYS A 95 -9.385 -1.178 14.294 1.00 0.00 H new ATOM 0 HA LYS A 95 -8.241 -2.699 12.155 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -7.181 -0.706 13.228 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -7.021 -1.608 14.722 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -5.204 -2.763 13.989 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -5.865 -2.995 12.383 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -5.293 -0.645 11.801 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -4.646 -0.400 13.411 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -2.938 -2.140 13.026 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -3.615 -2.487 11.447 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -1.599 -0.859 11.742 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -2.779 -0.579 10.554 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -2.824 0.284 12.016 1.00 0.00 H new ATOM 1469 N GLY A 96 -8.670 -4.135 15.052 1.00 0.00 N ATOM 1470 CA GLY A 96 -8.587 -5.413 15.726 1.00 0.00 C ATOM 1471 C GLY A 96 -9.541 -6.442 15.153 1.00 0.00 C ATOM 1472 O GLY A 96 -9.255 -7.641 15.177 1.00 0.00 O ATOM 0 H GLY A 96 -9.190 -3.415 15.554 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -7.567 -5.791 15.655 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -8.803 -5.275 16.785 1.00 0.00 H new ATOM 1476 N GLN A 97 -10.670 -5.982 14.630 1.00 0.00 N ATOM 1477 CA GLN A 97 -11.660 -6.880 14.044 1.00 0.00 C ATOM 1478 C GLN A 97 -11.210 -7.352 12.667 1.00 0.00 C ATOM 1479 O GLN A 97 -11.489 -8.479 12.262 1.00 0.00 O ATOM 1480 CB GLN A 97 -13.018 -6.186 13.944 1.00 0.00 C ATOM 1481 CG GLN A 97 -13.520 -5.638 15.270 1.00 0.00 C ATOM 1482 CD GLN A 97 -14.489 -4.484 15.095 1.00 0.00 C ATOM 1483 OE1 GLN A 97 -15.182 -4.391 14.082 1.00 0.00 O ATOM 1484 NE2 GLN A 97 -14.540 -3.595 16.080 1.00 0.00 N ATOM 0 H GLN A 97 -10.924 -4.995 14.599 1.00 0.00 H new ATOM 0 HA GLN A 97 -11.757 -7.750 14.694 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -12.947 -5.369 13.226 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -13.750 -6.892 13.552 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -14.009 -6.437 15.827 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -12.670 -5.307 15.867 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -13.948 -3.711 16.902 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -15.171 -2.797 16.014 1.00 0.00 H new ATOM 1493 N LEU A 98 -10.503 -6.483 11.957 1.00 0.00 N ATOM 1494 CA LEU A 98 -10.003 -6.826 10.633 1.00 0.00 C ATOM 1495 C LEU A 98 -8.883 -7.855 10.754 1.00 0.00 C ATOM 1496 O LEU A 98 -8.899 -8.890 10.089 1.00 0.00 O ATOM 1497 CB LEU A 98 -9.508 -5.583 9.890 1.00 0.00 C ATOM 1498 CG LEU A 98 -9.898 -5.527 8.410 1.00 0.00 C ATOM 1499 CD1 LEU A 98 -10.166 -4.093 7.978 1.00 0.00 C ATOM 1500 CD2 LEU A 98 -8.809 -6.150 7.549 1.00 0.00 C ATOM 0 H LEU A 98 -10.264 -5.543 12.272 1.00 0.00 H new ATOM 0 HA LEU A 98 -10.822 -7.254 10.056 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -9.900 -4.697 10.389 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -8.422 -5.538 9.968 1.00 0.00 H new ATOM 0 HG LEU A 98 -10.815 -6.100 8.275 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -10.441 -4.076 6.923 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -10.981 -3.680 8.573 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -9.268 -3.494 8.128 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -9.102 -6.102 6.500 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -7.876 -5.604 7.690 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -8.667 -7.191 7.839 1.00 0.00 H new ATOM 1512 N LYS A 99 -7.909 -7.550 11.605 1.00 0.00 N ATOM 1513 CA LYS A 99 -6.771 -8.436 11.823 1.00 0.00 C ATOM 1514 C LYS A 99 -7.221 -9.790 12.361 1.00 0.00 C ATOM 1515 O LYS A 99 -6.710 -10.832 11.949 1.00 0.00 O ATOM 1516 CB LYS A 99 -5.787 -7.794 12.799 1.00 0.00 C ATOM 1517 CG LYS A 99 -4.337 -8.162 12.533 1.00 0.00 C ATOM 1518 CD LYS A 99 -3.388 -7.325 13.375 1.00 0.00 C ATOM 1519 CE LYS A 99 -3.316 -7.838 14.802 1.00 0.00 C ATOM 1520 NZ LYS A 99 -3.161 -6.729 15.783 1.00 0.00 N ATOM 0 H LYS A 99 -7.885 -6.693 12.157 1.00 0.00 H new ATOM 0 HA LYS A 99 -6.280 -8.595 10.863 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -5.893 -6.710 12.748 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -6.048 -8.093 13.814 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -4.183 -9.219 12.751 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -4.112 -8.018 11.476 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -2.393 -7.342 12.930 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -3.719 -6.287 13.376 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -4.220 -8.402 15.031 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -2.477 -8.528 14.898 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -3.116 -7.121 16.745 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -2.285 -6.206 15.580 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -3.974 -6.084 15.709 1.00 0.00 H new ATOM 1534 N GLU A 100 -8.187 -9.775 13.277 1.00 0.00 N ATOM 1535 CA GLU A 100 -8.696 -11.012 13.850 1.00 0.00 C ATOM 1536 C GLU A 100 -9.300 -11.890 12.754 1.00 0.00 C ATOM 1537 O GLU A 100 -9.109 -13.105 12.744 1.00 0.00 O ATOM 1538 CB GLU A 100 -9.706 -10.727 14.975 1.00 0.00 C ATOM 1539 CG GLU A 100 -11.136 -10.499 14.511 1.00 0.00 C ATOM 1540 CD GLU A 100 -12.008 -11.726 14.690 1.00 0.00 C ATOM 1541 OE1 GLU A 100 -11.479 -12.852 14.566 1.00 0.00 O ATOM 1542 OE2 GLU A 100 -13.216 -11.562 14.959 1.00 0.00 O ATOM 0 H GLU A 100 -8.627 -8.927 13.634 1.00 0.00 H new ATOM 0 HA GLU A 100 -7.866 -11.557 14.299 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -9.695 -11.564 15.673 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -9.374 -9.847 15.527 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -11.567 -9.667 15.068 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -11.132 -10.211 13.460 1.00 0.00 H new ATOM 1549 N PHE A 101 -9.995 -11.262 11.806 1.00 0.00 N ATOM 1550 CA PHE A 101 -10.588 -11.987 10.688 1.00 0.00 C ATOM 1551 C PHE A 101 -9.495 -12.682 9.878 1.00 0.00 C ATOM 1552 O PHE A 101 -9.652 -13.821 9.435 1.00 0.00 O ATOM 1553 CB PHE A 101 -11.381 -11.028 9.791 1.00 0.00 C ATOM 1554 CG PHE A 101 -12.306 -11.720 8.826 1.00 0.00 C ATOM 1555 CD1 PHE A 101 -13.081 -12.794 9.233 1.00 0.00 C ATOM 1556 CD2 PHE A 101 -12.395 -11.296 7.510 1.00 0.00 C ATOM 1557 CE1 PHE A 101 -13.925 -13.433 8.345 1.00 0.00 C ATOM 1558 CE2 PHE A 101 -13.240 -11.931 6.618 1.00 0.00 C ATOM 1559 CZ PHE A 101 -14.006 -13.001 7.036 1.00 0.00 C ATOM 0 H PHE A 101 -10.160 -10.255 11.792 1.00 0.00 H new ATOM 0 HA PHE A 101 -11.271 -12.740 11.081 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -11.965 -10.356 10.420 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -10.681 -10.410 9.229 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -13.025 -13.136 10.256 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -11.798 -10.460 7.177 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -14.522 -14.271 8.675 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -13.301 -11.590 5.595 1.00 0.00 H new ATOM 0 HZ PHE A 101 -14.666 -13.499 6.341 1.00 0.00 H new ATOM 1569 N LEU A 102 -8.376 -11.981 9.706 1.00 0.00 N ATOM 1570 CA LEU A 102 -7.241 -12.514 8.960 1.00 0.00 C ATOM 1571 C LEU A 102 -6.623 -13.691 9.705 1.00 0.00 C ATOM 1572 O LEU A 102 -6.553 -14.798 9.179 1.00 0.00 O ATOM 1573 CB LEU A 102 -6.193 -11.419 8.741 1.00 0.00 C ATOM 1574 CG LEU A 102 -6.252 -10.728 7.376 1.00 0.00 C ATOM 1575 CD1 LEU A 102 -5.122 -9.720 7.235 1.00 0.00 C ATOM 1576 CD2 LEU A 102 -6.196 -11.757 6.257 1.00 0.00 C ATOM 0 H LEU A 102 -8.232 -11.041 10.074 1.00 0.00 H new ATOM 0 HA LEU A 102 -7.594 -12.863 7.990 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -6.311 -10.664 9.518 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -5.202 -11.855 8.868 1.00 0.00 H new ATOM 0 HG LEU A 102 -7.198 -10.191 7.303 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -5.182 -9.240 6.258 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -5.209 -8.965 8.016 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -4.164 -10.232 7.330 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -6.239 -11.249 5.293 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -5.267 -12.322 6.328 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -7.042 -12.438 6.346 1.00 0.00 H new ATOM 1588 N ASP A 103 -6.185 -13.447 10.938 1.00 0.00 N ATOM 1589 CA ASP A 103 -5.580 -14.496 11.755 1.00 0.00 C ATOM 1590 C ASP A 103 -6.461 -15.743 11.777 1.00 0.00 C ATOM 1591 O ASP A 103 -5.961 -16.869 11.784 1.00 0.00 O ATOM 1592 CB ASP A 103 -5.349 -13.992 13.183 1.00 0.00 C ATOM 1593 CG ASP A 103 -3.995 -14.407 13.728 1.00 0.00 C ATOM 1594 OD1 ASP A 103 -3.740 -15.626 13.814 1.00 0.00 O ATOM 1595 OD2 ASP A 103 -3.191 -13.513 14.067 1.00 0.00 O ATOM 0 H ASP A 103 -6.237 -12.535 11.392 1.00 0.00 H new ATOM 0 HA ASP A 103 -4.619 -14.759 11.312 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -5.427 -12.905 13.199 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -6.134 -14.378 13.834 1.00 0.00 H new ATOM 1600 N ALA A 104 -7.774 -15.532 11.786 1.00 0.00 N ATOM 1601 CA ALA A 104 -8.731 -16.634 11.807 1.00 0.00 C ATOM 1602 C ALA A 104 -8.754 -17.398 10.485 1.00 0.00 C ATOM 1603 O ALA A 104 -9.150 -18.563 10.444 1.00 0.00 O ATOM 1604 CB ALA A 104 -10.124 -16.117 12.139 1.00 0.00 C ATOM 0 H ALA A 104 -8.201 -14.605 11.779 1.00 0.00 H new ATOM 0 HA ALA A 104 -8.410 -17.330 12.582 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -10.828 -16.949 12.151 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -10.111 -15.639 13.118 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -10.432 -15.392 11.385 1.00 0.00 H new ATOM 1610 N ASN A 105 -8.344 -16.745 9.400 1.00 0.00 N ATOM 1611 CA ASN A 105 -8.343 -17.383 8.083 1.00 0.00 C ATOM 1612 C ASN A 105 -6.925 -17.742 7.639 1.00 0.00 C ATOM 1613 O ASN A 105 -6.648 -18.888 7.281 1.00 0.00 O ATOM 1614 CB ASN A 105 -8.992 -16.455 7.054 1.00 0.00 C ATOM 1615 CG ASN A 105 -9.893 -17.198 6.086 1.00 0.00 C ATOM 1616 OD1 ASN A 105 -10.391 -18.283 6.390 1.00 0.00 O ATOM 1617 ND2 ASN A 105 -10.106 -16.617 4.910 1.00 0.00 N ATOM 0 H ASN A 105 -8.010 -15.781 9.404 1.00 0.00 H new ATOM 0 HA ASN A 105 -8.918 -18.306 8.155 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -9.573 -15.692 7.573 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -8.213 -15.937 6.495 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -10.702 -17.071 4.218 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -9.673 -15.718 4.700 1.00 0.00 H new ATOM 1624 N LEU A 106 -6.031 -16.757 7.664 1.00 0.00 N ATOM 1625 CA LEU A 106 -4.637 -16.961 7.267 1.00 0.00 C ATOM 1626 C LEU A 106 -4.057 -18.213 7.925 1.00 0.00 C ATOM 1627 O LEU A 106 -3.356 -18.996 7.284 1.00 0.00 O ATOM 1628 CB LEU A 106 -3.809 -15.729 7.645 1.00 0.00 C ATOM 1629 CG LEU A 106 -2.546 -15.496 6.814 1.00 0.00 C ATOM 1630 CD1 LEU A 106 -1.771 -14.307 7.358 1.00 0.00 C ATOM 1631 CD2 LEU A 106 -1.671 -16.740 6.801 1.00 0.00 C ATOM 0 H LEU A 106 -6.247 -15.804 7.956 1.00 0.00 H new ATOM 0 HA LEU A 106 -4.600 -17.103 6.187 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -4.445 -14.847 7.561 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -3.521 -15.815 8.693 1.00 0.00 H new ATOM 0 HG LEU A 106 -2.844 -15.280 5.788 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -0.874 -14.152 6.758 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -2.396 -13.415 7.315 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -1.486 -14.501 8.392 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -0.779 -16.551 6.204 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -1.379 -16.990 7.821 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -2.227 -17.572 6.369 1.00 0.00 H new