USER MOD reduce.3.24.130724 H: found=0, std=0, add=800, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 799 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 Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 10 GLN : amide:sc= -1.38 K(o=-1.4,f=-5.3!) USER MOD Single : A 14 LYS NZ :NH3+ -152:sc= 0 (180deg=-0.00657) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 25 GLN : amide:sc= -1.52! K(o=-1.5!,f=-0.67) USER MOD Single : A 26 ASN : amide:sc= -2.49 K(o=-2.5,f=-3.2!) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 GLN : amide:sc= -0.167 K(o=-0.17,f=-2.7!) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 MET CE :methyl 179:sc= -2.66 (180deg=-2.83) USER MOD Single : A 49 THR OG1 : rot 180:sc= -0.013 USER MOD Single : A 52 HIS : no HD1:sc= -11.9! C(o=-12!,f=-18!) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 TYR OH : rot 110:sc= -0.294 USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 THR OG1 : rot 180:sc=-0.00199 USER MOD Single : A 68 THR OG1 : rot 180:sc= -0.134 USER MOD Single : A 73 LYS NZ :NH3+ 129:sc= -0.0239 (180deg=-0.623) USER MOD Single : A 74 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 76 THR OG1 : rot 103:sc= 0.0737 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 THR OG1 : rot 180:sc= -0.239 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 96 HIS : no HD1:sc= -0.102 X(o=-0.1,f=-0.014) USER MOD Single : A 100 LYS NZ :NH3+ 159:sc= 0 (180deg=-0.0613) USER MOD ----------------------------------------------------------------- ATOM 34 N VAL A 3 -24.693 -12.232 6.521 1.00 0.00 N ATOM 35 CA VAL A 3 -24.374 -13.060 5.323 1.00 0.00 C ATOM 36 C VAL A 3 -22.890 -12.933 4.972 1.00 0.00 C ATOM 37 O VAL A 3 -22.245 -11.958 5.302 1.00 0.00 O ATOM 38 CB VAL A 3 -25.241 -12.484 4.203 1.00 0.00 C ATOM 39 CG1 VAL A 3 -26.717 -12.591 4.593 1.00 0.00 C ATOM 40 CG2 VAL A 3 -24.879 -11.014 3.984 1.00 0.00 C ATOM 0 HA VAL A 3 -24.571 -14.119 5.488 1.00 0.00 H new ATOM 0 HB VAL A 3 -25.066 -13.044 3.284 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -27.335 -12.180 3.795 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -26.977 -13.638 4.751 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -26.892 -12.031 5.512 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -25.496 -10.602 3.186 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -25.054 -10.455 4.903 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -23.828 -10.936 3.707 1.00 0.00 H new ATOM 50 N LYS A 4 -22.343 -13.912 4.304 1.00 0.00 N ATOM 51 CA LYS A 4 -20.900 -13.846 3.932 1.00 0.00 C ATOM 52 C LYS A 4 -20.726 -14.123 2.437 1.00 0.00 C ATOM 53 O LYS A 4 -21.568 -14.731 1.806 1.00 0.00 O ATOM 54 CB LYS A 4 -20.227 -14.941 4.763 1.00 0.00 C ATOM 55 CG LYS A 4 -21.047 -16.230 4.670 1.00 0.00 C ATOM 56 CD LYS A 4 -20.363 -17.329 5.484 1.00 0.00 C ATOM 57 CE LYS A 4 -21.311 -18.522 5.629 1.00 0.00 C ATOM 58 NZ LYS A 4 -21.052 -19.054 6.996 1.00 0.00 N ATOM 0 H LYS A 4 -22.832 -14.754 4.000 1.00 0.00 H new ATOM 0 HA LYS A 4 -20.468 -12.864 4.125 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -19.214 -15.115 4.402 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -20.145 -14.624 5.803 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -22.056 -16.060 5.045 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -21.142 -16.539 3.629 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -19.442 -17.641 4.992 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -20.086 -16.949 6.467 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -22.351 -18.216 5.515 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -21.115 -19.277 4.868 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -21.665 -19.875 7.171 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -20.056 -19.343 7.073 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -21.254 -18.315 7.700 1.00 0.00 H new ATOM 72 N CYS A 5 -19.638 -13.682 1.865 1.00 0.00 N ATOM 73 CA CYS A 5 -19.412 -13.922 0.411 1.00 0.00 C ATOM 74 C CYS A 5 -18.172 -14.805 0.209 1.00 0.00 C ATOM 75 O CYS A 5 -17.225 -14.713 0.965 1.00 0.00 O ATOM 76 CB CYS A 5 -19.183 -12.533 -0.188 1.00 0.00 C ATOM 77 SG CYS A 5 -20.475 -11.403 0.388 1.00 0.00 S ATOM 0 H CYS A 5 -18.897 -13.167 2.341 1.00 0.00 H new ATOM 0 HA CYS A 5 -20.250 -14.436 -0.059 1.00 0.00 H new ATOM 0 HB2 CYS A 5 -18.202 -12.158 0.102 1.00 0.00 H new ATOM 0 HB3 CYS A 5 -19.193 -12.589 -1.277 1.00 0.00 H new ATOM 82 N PRO A 6 -18.209 -15.633 -0.809 1.00 0.00 N ATOM 83 CA PRO A 6 -19.389 -15.713 -1.710 1.00 0.00 C ATOM 84 C PRO A 6 -20.533 -16.465 -1.024 1.00 0.00 C ATOM 85 O PRO A 6 -20.380 -16.993 0.059 1.00 0.00 O ATOM 86 CB PRO A 6 -18.870 -16.499 -2.910 1.00 0.00 C ATOM 87 CG PRO A 6 -17.729 -17.311 -2.383 1.00 0.00 C ATOM 88 CD PRO A 6 -17.149 -16.566 -1.208 1.00 0.00 C ATOM 0 HA PRO A 6 -19.786 -14.736 -1.984 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -19.648 -17.138 -3.329 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -18.543 -15.831 -3.707 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -18.070 -18.301 -2.079 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -16.974 -17.458 -3.155 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -16.890 -17.245 -0.395 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -16.237 -16.037 -1.484 1.00 0.00 H new ATOM 96 N GLY A 7 -21.680 -16.517 -1.646 1.00 0.00 N ATOM 97 CA GLY A 7 -22.829 -17.236 -1.024 1.00 0.00 C ATOM 98 C GLY A 7 -24.021 -17.231 -1.984 1.00 0.00 C ATOM 99 O GLY A 7 -23.998 -16.591 -3.016 1.00 0.00 O ATOM 0 H GLY A 7 -21.871 -16.094 -2.555 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -22.544 -18.261 -0.788 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -23.104 -16.757 -0.084 1.00 0.00 H new ATOM 103 N GLU A 8 -25.064 -17.940 -1.649 1.00 0.00 N ATOM 104 CA GLU A 8 -26.261 -17.979 -2.539 1.00 0.00 C ATOM 105 C GLU A 8 -27.525 -18.209 -1.708 1.00 0.00 C ATOM 106 O GLU A 8 -27.540 -19.007 -0.791 1.00 0.00 O ATOM 107 CB GLU A 8 -26.016 -19.157 -3.482 1.00 0.00 C ATOM 108 CG GLU A 8 -27.324 -19.529 -4.186 1.00 0.00 C ATOM 109 CD GLU A 8 -27.847 -20.853 -3.626 1.00 0.00 C ATOM 110 OE1 GLU A 8 -27.768 -21.037 -2.422 1.00 0.00 O ATOM 111 OE2 GLU A 8 -28.318 -21.660 -4.410 1.00 0.00 O ATOM 0 H GLU A 8 -25.140 -18.495 -0.797 1.00 0.00 H new ATOM 0 HA GLU A 8 -26.403 -17.046 -3.084 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -25.256 -18.895 -4.218 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -25.636 -20.012 -2.922 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -28.064 -18.742 -4.040 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -27.159 -19.616 -5.260 1.00 0.00 H new ATOM 118 N TYR A 9 -28.586 -17.517 -2.019 1.00 0.00 N ATOM 119 CA TYR A 9 -29.847 -17.699 -1.242 1.00 0.00 C ATOM 120 C TYR A 9 -31.063 -17.550 -2.160 1.00 0.00 C ATOM 121 O TYR A 9 -30.945 -17.162 -3.305 1.00 0.00 O ATOM 122 CB TYR A 9 -29.828 -16.589 -0.192 1.00 0.00 C ATOM 123 CG TYR A 9 -28.546 -16.670 0.604 1.00 0.00 C ATOM 124 CD1 TYR A 9 -28.288 -17.791 1.403 1.00 0.00 C ATOM 125 CD2 TYR A 9 -27.616 -15.624 0.540 1.00 0.00 C ATOM 126 CE1 TYR A 9 -27.098 -17.866 2.140 1.00 0.00 C ATOM 127 CE2 TYR A 9 -26.426 -15.699 1.278 1.00 0.00 C ATOM 128 CZ TYR A 9 -26.168 -16.820 2.078 1.00 0.00 C ATOM 129 OH TYR A 9 -24.997 -16.895 2.803 1.00 0.00 O ATOM 0 H TYR A 9 -28.636 -16.835 -2.775 1.00 0.00 H new ATOM 0 HA TYR A 9 -29.913 -18.688 -0.789 1.00 0.00 H new ATOM 0 HB2 TYR A 9 -29.908 -15.615 -0.675 1.00 0.00 H new ATOM 0 HB3 TYR A 9 -30.687 -16.687 0.471 1.00 0.00 H new ATOM 0 HD1 TYR A 9 -29.005 -18.597 1.451 1.00 0.00 H new ATOM 0 HD2 TYR A 9 -27.816 -14.761 -0.077 1.00 0.00 H new ATOM 0 HE1 TYR A 9 -26.898 -18.730 2.756 1.00 0.00 H new ATOM 0 HE2 TYR A 9 -25.709 -14.893 1.230 1.00 0.00 H new ATOM 0 HH TYR A 9 -24.463 -16.088 2.647 1.00 0.00 H new ATOM 139 N GLN A 10 -32.231 -17.853 -1.665 1.00 0.00 N ATOM 140 CA GLN A 10 -33.454 -17.729 -2.508 1.00 0.00 C ATOM 141 C GLN A 10 -34.248 -16.483 -2.104 1.00 0.00 C ATOM 142 O GLN A 10 -34.808 -16.414 -1.028 1.00 0.00 O ATOM 143 CB GLN A 10 -34.261 -18.995 -2.224 1.00 0.00 C ATOM 144 CG GLN A 10 -34.634 -19.671 -3.545 1.00 0.00 C ATOM 145 CD GLN A 10 -33.421 -20.423 -4.095 1.00 0.00 C ATOM 146 OE1 GLN A 10 -32.527 -19.826 -4.660 1.00 0.00 O ATOM 147 NE2 GLN A 10 -33.353 -21.719 -3.954 1.00 0.00 N ATOM 0 H GLN A 10 -32.392 -18.181 -0.713 1.00 0.00 H new ATOM 0 HA GLN A 10 -33.218 -17.626 -3.567 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -33.679 -19.678 -1.605 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -35.162 -18.746 -1.664 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -35.464 -20.361 -3.391 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -34.970 -18.925 -4.265 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -34.104 -22.220 -3.479 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -32.549 -22.230 -4.318 1.00 0.00 H new ATOM 156 N VAL A 11 -34.299 -15.497 -2.958 1.00 0.00 N ATOM 157 CA VAL A 11 -35.056 -14.257 -2.622 1.00 0.00 C ATOM 158 C VAL A 11 -36.190 -14.040 -3.626 1.00 0.00 C ATOM 159 O VAL A 11 -35.964 -13.688 -4.767 1.00 0.00 O ATOM 160 CB VAL A 11 -34.031 -13.128 -2.720 1.00 0.00 C ATOM 161 CG1 VAL A 11 -34.729 -11.784 -2.503 1.00 0.00 C ATOM 162 CG2 VAL A 11 -32.955 -13.321 -1.649 1.00 0.00 C ATOM 0 H VAL A 11 -33.849 -15.496 -3.874 1.00 0.00 H new ATOM 0 HA VAL A 11 -35.513 -14.308 -1.634 1.00 0.00 H new ATOM 0 HB VAL A 11 -33.569 -13.143 -3.707 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -33.998 -10.979 -2.573 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -35.496 -11.645 -3.265 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -35.192 -11.769 -1.516 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -32.224 -12.516 -1.719 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -33.417 -13.307 -0.662 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -32.456 -14.278 -1.802 1.00 0.00 H new ATOM 172 N ASP A 12 -37.410 -14.247 -3.212 1.00 0.00 N ATOM 173 CA ASP A 12 -38.557 -14.051 -4.144 1.00 0.00 C ATOM 174 C ASP A 12 -38.507 -15.087 -5.271 1.00 0.00 C ATOM 175 O ASP A 12 -38.336 -14.754 -6.426 1.00 0.00 O ATOM 176 CB ASP A 12 -38.376 -12.641 -4.704 1.00 0.00 C ATOM 177 CG ASP A 12 -39.742 -12.054 -5.064 1.00 0.00 C ATOM 178 OD1 ASP A 12 -40.693 -12.815 -5.134 1.00 0.00 O ATOM 179 OD2 ASP A 12 -39.815 -10.852 -5.265 1.00 0.00 O ATOM 0 H ASP A 12 -37.662 -14.543 -2.269 1.00 0.00 H new ATOM 0 HA ASP A 12 -39.519 -14.171 -3.645 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -37.879 -12.008 -3.969 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -37.736 -12.668 -5.586 1.00 0.00 H new ATOM 184 N GLY A 13 -38.656 -16.342 -4.943 1.00 0.00 N ATOM 185 CA GLY A 13 -38.617 -17.397 -5.995 1.00 0.00 C ATOM 186 C GLY A 13 -37.451 -17.128 -6.947 1.00 0.00 C ATOM 187 O GLY A 13 -37.515 -17.428 -8.122 1.00 0.00 O ATOM 0 H GLY A 13 -38.803 -16.682 -3.993 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -38.506 -18.379 -5.536 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -39.556 -17.408 -6.548 1.00 0.00 H new ATOM 191 N LYS A 14 -36.384 -16.565 -6.449 1.00 0.00 N ATOM 192 CA LYS A 14 -35.213 -16.279 -7.326 1.00 0.00 C ATOM 193 C LYS A 14 -33.933 -16.833 -6.697 1.00 0.00 C ATOM 194 O LYS A 14 -33.899 -17.167 -5.529 1.00 0.00 O ATOM 195 CB LYS A 14 -35.151 -14.753 -7.416 1.00 0.00 C ATOM 196 CG LYS A 14 -35.343 -14.318 -8.869 1.00 0.00 C ATOM 197 CD LYS A 14 -36.145 -13.015 -8.912 1.00 0.00 C ATOM 198 CE LYS A 14 -36.427 -12.636 -10.367 1.00 0.00 C ATOM 199 NZ LYS A 14 -37.665 -13.381 -10.725 1.00 0.00 N ATOM 0 H LYS A 14 -36.272 -16.291 -5.473 1.00 0.00 H new ATOM 0 HA LYS A 14 -35.309 -16.742 -8.308 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -35.924 -14.310 -6.788 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -34.192 -14.395 -7.042 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -34.374 -14.177 -9.348 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -35.864 -15.096 -9.427 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -37.082 -13.134 -8.368 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -35.590 -12.217 -8.419 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -36.568 -11.561 -10.475 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -35.597 -12.915 -11.016 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -37.671 -13.573 -11.747 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -37.692 -14.281 -10.204 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -38.498 -12.811 -10.475 1.00 0.00 H new ATOM 213 N LYS A 15 -32.880 -16.934 -7.461 1.00 0.00 N ATOM 214 CA LYS A 15 -31.604 -17.469 -6.904 1.00 0.00 C ATOM 215 C LYS A 15 -30.480 -16.444 -7.073 1.00 0.00 C ATOM 216 O LYS A 15 -30.068 -16.135 -8.174 1.00 0.00 O ATOM 217 CB LYS A 15 -31.310 -18.727 -7.723 1.00 0.00 C ATOM 218 CG LYS A 15 -32.454 -19.728 -7.551 1.00 0.00 C ATOM 219 CD LYS A 15 -32.675 -20.481 -8.864 1.00 0.00 C ATOM 220 CE LYS A 15 -33.823 -21.478 -8.694 1.00 0.00 C ATOM 221 NZ LYS A 15 -33.699 -22.407 -9.852 1.00 0.00 N ATOM 0 H LYS A 15 -32.847 -16.670 -8.446 1.00 0.00 H new ATOM 0 HA LYS A 15 -31.678 -17.684 -5.838 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -31.194 -18.469 -8.776 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -30.370 -19.174 -7.398 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -32.219 -20.431 -6.752 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -33.366 -19.207 -7.260 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -32.906 -19.778 -9.664 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -31.764 -21.005 -9.153 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -33.744 -22.013 -7.748 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -34.789 -20.972 -8.695 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -34.453 -23.122 -9.806 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -33.784 -21.870 -10.739 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -32.773 -22.879 -9.821 1.00 0.00 H new ATOM 235 N VAL A 16 -29.981 -15.913 -5.991 1.00 0.00 N ATOM 236 CA VAL A 16 -28.883 -14.908 -6.089 1.00 0.00 C ATOM 237 C VAL A 16 -27.579 -15.498 -5.543 1.00 0.00 C ATOM 238 O VAL A 16 -27.582 -16.280 -4.613 1.00 0.00 O ATOM 239 CB VAL A 16 -29.344 -13.734 -5.227 1.00 0.00 C ATOM 240 CG1 VAL A 16 -28.238 -12.680 -5.166 1.00 0.00 C ATOM 241 CG2 VAL A 16 -30.602 -13.116 -5.842 1.00 0.00 C ATOM 0 H VAL A 16 -30.286 -16.131 -5.042 1.00 0.00 H new ATOM 0 HA VAL A 16 -28.688 -14.605 -7.118 1.00 0.00 H new ATOM 0 HB VAL A 16 -29.565 -14.087 -4.220 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -28.567 -11.842 -4.551 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -27.340 -13.119 -4.731 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -28.017 -12.326 -6.173 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -30.933 -12.278 -5.229 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -30.379 -12.763 -6.849 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -31.391 -13.866 -5.887 1.00 0.00 H new ATOM 251 N ILE A 17 -26.465 -15.130 -6.115 1.00 0.00 N ATOM 252 CA ILE A 17 -25.164 -15.673 -5.628 1.00 0.00 C ATOM 253 C ILE A 17 -24.115 -14.559 -5.567 1.00 0.00 C ATOM 254 O ILE A 17 -23.655 -14.069 -6.579 1.00 0.00 O ATOM 255 CB ILE A 17 -24.765 -16.729 -6.659 1.00 0.00 C ATOM 256 CG1 ILE A 17 -23.292 -17.096 -6.468 1.00 0.00 C ATOM 257 CG2 ILE A 17 -24.972 -16.171 -8.068 1.00 0.00 C ATOM 258 CD1 ILE A 17 -22.939 -18.278 -7.372 1.00 0.00 C ATOM 0 H ILE A 17 -26.399 -14.478 -6.897 1.00 0.00 H new ATOM 0 HA ILE A 17 -25.241 -16.091 -4.624 1.00 0.00 H new ATOM 0 HB ILE A 17 -25.382 -17.618 -6.526 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -22.659 -16.241 -6.706 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -23.102 -17.352 -5.426 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -24.687 -16.924 -8.803 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -26.021 -15.908 -8.205 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -24.355 -15.282 -8.202 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -21.890 -18.539 -7.236 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -23.563 -19.133 -7.113 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -23.113 -18.005 -8.413 1.00 0.00 H new ATOM 270 N LEU A 18 -23.732 -14.156 -4.386 1.00 0.00 N ATOM 271 CA LEU A 18 -22.712 -13.075 -4.261 1.00 0.00 C ATOM 272 C LEU A 18 -21.311 -13.640 -4.511 1.00 0.00 C ATOM 273 O LEU A 18 -20.952 -14.683 -4.003 1.00 0.00 O ATOM 274 CB LEU A 18 -22.841 -12.575 -2.822 1.00 0.00 C ATOM 275 CG LEU A 18 -24.098 -11.711 -2.693 1.00 0.00 C ATOM 276 CD1 LEU A 18 -24.383 -11.441 -1.215 1.00 0.00 C ATOM 277 CD2 LEU A 18 -23.879 -10.383 -3.421 1.00 0.00 C ATOM 0 H LEU A 18 -24.081 -14.528 -3.503 1.00 0.00 H new ATOM 0 HA LEU A 18 -22.865 -12.275 -4.985 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -22.895 -13.420 -2.136 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -21.959 -11.997 -2.546 1.00 0.00 H new ATOM 0 HG LEU A 18 -24.946 -12.234 -3.136 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -25.278 -10.826 -1.124 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -24.538 -12.387 -0.696 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -23.536 -10.918 -0.771 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -24.773 -9.766 -3.330 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -23.031 -9.860 -2.978 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -23.676 -10.575 -4.475 1.00 0.00 H new ATOM 289 N ASP A 19 -20.517 -12.958 -5.292 1.00 0.00 N ATOM 290 CA ASP A 19 -19.140 -13.456 -5.578 1.00 0.00 C ATOM 291 C ASP A 19 -18.287 -13.412 -4.308 1.00 0.00 C ATOM 292 O ASP A 19 -18.790 -13.222 -3.218 1.00 0.00 O ATOM 293 CB ASP A 19 -18.583 -12.499 -6.632 1.00 0.00 C ATOM 294 CG ASP A 19 -17.760 -13.287 -7.652 1.00 0.00 C ATOM 295 OD1 ASP A 19 -17.556 -14.470 -7.433 1.00 0.00 O ATOM 296 OD2 ASP A 19 -17.347 -12.694 -8.634 1.00 0.00 O ATOM 0 H ASP A 19 -20.762 -12.077 -5.745 1.00 0.00 H new ATOM 0 HA ASP A 19 -19.139 -14.489 -5.925 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -19.399 -11.977 -7.132 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -17.962 -11.739 -6.157 1.00 0.00 H new ATOM 301 N GLU A 20 -17.000 -13.585 -4.439 1.00 0.00 N ATOM 302 CA GLU A 20 -16.116 -13.554 -3.238 1.00 0.00 C ATOM 303 C GLU A 20 -16.095 -12.147 -2.633 1.00 0.00 C ATOM 304 O GLU A 20 -15.715 -11.957 -1.494 1.00 0.00 O ATOM 305 CB GLU A 20 -14.728 -13.936 -3.756 1.00 0.00 C ATOM 306 CG GLU A 20 -13.829 -14.314 -2.577 1.00 0.00 C ATOM 307 CD GLU A 20 -12.550 -13.476 -2.620 1.00 0.00 C ATOM 308 OE1 GLU A 20 -11.710 -13.756 -3.458 1.00 0.00 O ATOM 309 OE2 GLU A 20 -12.434 -12.567 -1.814 1.00 0.00 O ATOM 0 H GLU A 20 -16.522 -13.746 -5.325 1.00 0.00 H new ATOM 0 HA GLU A 20 -16.459 -14.231 -2.456 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -14.805 -14.772 -4.451 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -14.292 -13.103 -4.307 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -14.355 -14.146 -1.637 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -13.583 -15.375 -2.620 1.00 0.00 H new ATOM 316 N ASP A 21 -16.499 -11.161 -3.386 1.00 0.00 N ATOM 317 CA ASP A 21 -16.501 -9.768 -2.853 1.00 0.00 C ATOM 318 C ASP A 21 -17.936 -9.245 -2.743 1.00 0.00 C ATOM 319 O ASP A 21 -18.207 -8.091 -3.009 1.00 0.00 O ATOM 320 CB ASP A 21 -15.709 -8.952 -3.875 1.00 0.00 C ATOM 321 CG ASP A 21 -14.221 -8.998 -3.525 1.00 0.00 C ATOM 322 OD1 ASP A 21 -13.549 -9.899 -3.999 1.00 0.00 O ATOM 323 OD2 ASP A 21 -13.779 -8.131 -2.789 1.00 0.00 O ATOM 0 H ASP A 21 -16.828 -11.259 -4.347 1.00 0.00 H new ATOM 0 HA ASP A 21 -16.064 -9.707 -1.856 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -15.870 -9.350 -4.877 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -16.060 -7.920 -3.882 1.00 0.00 H new ATOM 328 N CYS A 22 -18.856 -10.085 -2.356 1.00 0.00 N ATOM 329 CA CYS A 22 -20.271 -9.635 -2.231 1.00 0.00 C ATOM 330 C CYS A 22 -20.691 -8.860 -3.484 1.00 0.00 C ATOM 331 O CYS A 22 -21.396 -7.873 -3.407 1.00 0.00 O ATOM 332 CB CYS A 22 -20.292 -8.723 -1.004 1.00 0.00 C ATOM 333 SG CYS A 22 -19.575 -9.595 0.411 1.00 0.00 S ATOM 0 H CYS A 22 -18.689 -11.063 -2.121 1.00 0.00 H new ATOM 0 HA CYS A 22 -20.962 -10.471 -2.127 1.00 0.00 H new ATOM 0 HB2 CYS A 22 -19.729 -7.812 -1.206 1.00 0.00 H new ATOM 0 HB3 CYS A 22 -21.315 -8.423 -0.779 1.00 0.00 H new ATOM 338 N PHE A 23 -20.263 -9.299 -4.635 1.00 0.00 N ATOM 339 CA PHE A 23 -20.638 -8.587 -5.891 1.00 0.00 C ATOM 340 C PHE A 23 -21.838 -9.273 -6.549 1.00 0.00 C ATOM 341 O PHE A 23 -22.084 -10.445 -6.343 1.00 0.00 O ATOM 342 CB PHE A 23 -19.403 -8.688 -6.787 1.00 0.00 C ATOM 343 CG PHE A 23 -18.805 -7.315 -6.976 1.00 0.00 C ATOM 344 CD1 PHE A 23 -18.196 -6.662 -5.897 1.00 0.00 C ATOM 345 CD2 PHE A 23 -18.858 -6.694 -8.231 1.00 0.00 C ATOM 346 CE1 PHE A 23 -17.640 -5.387 -6.071 1.00 0.00 C ATOM 347 CE2 PHE A 23 -18.302 -5.419 -8.406 1.00 0.00 C ATOM 348 CZ PHE A 23 -17.694 -4.766 -7.326 1.00 0.00 C ATOM 0 H PHE A 23 -19.670 -10.119 -4.761 1.00 0.00 H new ATOM 0 HA PHE A 23 -20.925 -7.551 -5.709 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -18.669 -9.357 -6.339 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -19.675 -9.114 -7.753 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -18.155 -7.141 -4.930 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -19.327 -7.198 -9.063 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -17.171 -4.884 -5.239 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -18.342 -4.940 -9.373 1.00 0.00 H new ATOM 0 HZ PHE A 23 -17.267 -3.783 -7.461 1.00 0.00 H new ATOM 358 N MET A 24 -22.586 -8.552 -7.338 1.00 0.00 N ATOM 359 CA MET A 24 -23.770 -9.166 -8.008 1.00 0.00 C ATOM 360 C MET A 24 -23.369 -9.747 -9.365 1.00 0.00 C ATOM 361 O MET A 24 -23.408 -9.074 -10.376 1.00 0.00 O ATOM 362 CB MET A 24 -24.763 -8.018 -8.188 1.00 0.00 C ATOM 363 CG MET A 24 -26.089 -8.379 -7.515 1.00 0.00 C ATOM 364 SD MET A 24 -27.426 -8.296 -8.731 1.00 0.00 S ATOM 365 CE MET A 24 -28.215 -9.868 -8.306 1.00 0.00 C ATOM 0 H MET A 24 -22.430 -7.566 -7.548 1.00 0.00 H new ATOM 0 HA MET A 24 -24.194 -9.984 -7.427 1.00 0.00 H new ATOM 0 HB2 MET A 24 -24.360 -7.103 -7.754 1.00 0.00 H new ATOM 0 HB3 MET A 24 -24.922 -7.824 -9.249 1.00 0.00 H new ATOM 0 HG2 MET A 24 -26.032 -9.381 -7.089 1.00 0.00 H new ATOM 0 HG3 MET A 24 -26.289 -7.694 -6.691 1.00 0.00 H new ATOM 0 HE1 MET A 24 -29.083 -10.025 -8.947 1.00 0.00 H new ATOM 0 HE2 MET A 24 -27.505 -10.682 -8.451 1.00 0.00 H new ATOM 0 HE3 MET A 24 -28.533 -9.845 -7.264 1.00 0.00 H new ATOM 375 N GLN A 25 -22.984 -10.994 -9.396 1.00 0.00 N ATOM 376 CA GLN A 25 -22.584 -11.619 -10.688 1.00 0.00 C ATOM 377 C GLN A 25 -23.821 -12.114 -11.440 1.00 0.00 C ATOM 378 O GLN A 25 -23.734 -12.589 -12.555 1.00 0.00 O ATOM 379 CB GLN A 25 -21.687 -12.795 -10.298 1.00 0.00 C ATOM 380 CG GLN A 25 -22.542 -13.910 -9.693 1.00 0.00 C ATOM 381 CD GLN A 25 -21.634 -15.028 -9.177 1.00 0.00 C ATOM 382 OE1 GLN A 25 -21.321 -15.953 -9.898 1.00 0.00 O ATOM 383 NE2 GLN A 25 -21.196 -14.981 -7.949 1.00 0.00 N ATOM 0 H GLN A 25 -22.929 -11.607 -8.582 1.00 0.00 H new ATOM 0 HA GLN A 25 -22.072 -10.917 -11.346 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -21.154 -13.165 -11.174 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -20.934 -12.469 -9.580 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -23.149 -13.515 -8.878 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -23.230 -14.302 -10.442 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -21.459 -14.204 -7.343 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -20.591 -15.722 -7.595 1.00 0.00 H new ATOM 392 N ASN A 26 -24.974 -12.005 -10.838 1.00 0.00 N ATOM 393 CA ASN A 26 -26.218 -12.470 -11.517 1.00 0.00 C ATOM 394 C ASN A 26 -27.212 -11.313 -11.651 1.00 0.00 C ATOM 395 O ASN A 26 -28.292 -11.354 -11.097 1.00 0.00 O ATOM 396 CB ASN A 26 -26.784 -13.558 -10.604 1.00 0.00 C ATOM 397 CG ASN A 26 -27.254 -14.742 -11.451 1.00 0.00 C ATOM 398 OD1 ASN A 26 -26.456 -15.416 -12.072 1.00 0.00 O ATOM 399 ND2 ASN A 26 -28.527 -15.026 -11.504 1.00 0.00 N ATOM 0 H ASN A 26 -25.109 -11.614 -9.906 1.00 0.00 H new ATOM 0 HA ASN A 26 -26.025 -12.841 -12.523 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -26.023 -13.884 -9.895 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -27.615 -13.162 -10.021 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -28.851 -15.813 -12.066 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -29.198 -14.461 -10.983 1.00 0.00 H new ATOM 406 N PRO A 27 -26.806 -10.314 -12.386 1.00 0.00 N ATOM 407 CA PRO A 27 -27.667 -9.126 -12.601 1.00 0.00 C ATOM 408 C PRO A 27 -28.822 -9.468 -13.547 1.00 0.00 C ATOM 409 O PRO A 27 -29.799 -8.751 -13.633 1.00 0.00 O ATOM 410 CB PRO A 27 -26.723 -8.111 -13.240 1.00 0.00 C ATOM 411 CG PRO A 27 -25.651 -8.931 -13.885 1.00 0.00 C ATOM 412 CD PRO A 27 -25.519 -10.199 -13.080 1.00 0.00 C ATOM 0 HA PRO A 27 -28.125 -8.756 -11.684 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -27.244 -7.495 -13.973 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -26.307 -7.435 -12.493 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -25.909 -9.157 -14.920 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -24.707 -8.386 -13.903 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -25.333 -11.061 -13.721 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -24.689 -10.140 -12.375 1.00 0.00 H new ATOM 420 N GLU A 28 -28.717 -10.558 -14.256 1.00 0.00 N ATOM 421 CA GLU A 28 -29.809 -10.944 -15.195 1.00 0.00 C ATOM 422 C GLU A 28 -31.095 -11.242 -14.419 1.00 0.00 C ATOM 423 O GLU A 28 -32.186 -11.133 -14.940 1.00 0.00 O ATOM 424 CB GLU A 28 -29.301 -12.205 -15.898 1.00 0.00 C ATOM 425 CG GLU A 28 -28.873 -13.236 -14.851 1.00 0.00 C ATOM 426 CD GLU A 28 -27.373 -13.508 -14.981 1.00 0.00 C ATOM 427 OE1 GLU A 28 -26.816 -13.165 -16.011 1.00 0.00 O ATOM 428 OE2 GLU A 28 -26.807 -14.054 -14.049 1.00 0.00 O ATOM 0 H GLU A 28 -27.923 -11.198 -14.226 1.00 0.00 H new ATOM 0 HA GLU A 28 -30.044 -10.149 -15.903 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -30.083 -12.620 -16.534 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -28.460 -11.959 -16.546 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -29.101 -12.869 -13.850 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -29.434 -14.161 -14.986 1.00 0.00 H new ATOM 435 N ASP A 29 -30.974 -11.616 -13.173 1.00 0.00 N ATOM 436 CA ASP A 29 -32.190 -11.918 -12.364 1.00 0.00 C ATOM 437 C ASP A 29 -32.485 -10.763 -11.403 1.00 0.00 C ATOM 438 O ASP A 29 -33.432 -10.803 -10.642 1.00 0.00 O ATOM 439 CB ASP A 29 -31.843 -13.188 -11.587 1.00 0.00 C ATOM 440 CG ASP A 29 -32.606 -14.374 -12.181 1.00 0.00 C ATOM 441 OD1 ASP A 29 -33.813 -14.422 -12.009 1.00 0.00 O ATOM 442 OD2 ASP A 29 -31.971 -15.213 -12.798 1.00 0.00 O ATOM 0 H ASP A 29 -30.087 -11.725 -12.681 1.00 0.00 H new ATOM 0 HA ASP A 29 -33.077 -12.050 -12.984 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -30.770 -13.373 -11.632 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -32.101 -13.066 -10.535 1.00 0.00 H new ATOM 447 N TRP A 30 -31.682 -9.735 -11.432 1.00 0.00 N ATOM 448 CA TRP A 30 -31.917 -8.578 -10.519 1.00 0.00 C ATOM 449 C TRP A 30 -33.395 -8.179 -10.543 1.00 0.00 C ATOM 450 O TRP A 30 -34.067 -8.312 -11.547 1.00 0.00 O ATOM 451 CB TRP A 30 -31.047 -7.451 -11.075 1.00 0.00 C ATOM 452 CG TRP A 30 -31.159 -6.252 -10.188 1.00 0.00 C ATOM 453 CD1 TRP A 30 -30.231 -5.869 -9.279 1.00 0.00 C ATOM 454 CD2 TRP A 30 -32.236 -5.275 -10.111 1.00 0.00 C ATOM 455 NE1 TRP A 30 -30.672 -4.719 -8.649 1.00 0.00 N ATOM 456 CE2 TRP A 30 -31.903 -4.314 -9.126 1.00 0.00 C ATOM 457 CE3 TRP A 30 -33.461 -5.131 -10.792 1.00 0.00 C ATOM 458 CZ2 TRP A 30 -32.755 -3.248 -8.828 1.00 0.00 C ATOM 459 CZ3 TRP A 30 -34.319 -4.060 -10.495 1.00 0.00 C ATOM 460 CH2 TRP A 30 -33.967 -3.119 -9.515 1.00 0.00 C ATOM 0 H TRP A 30 -30.874 -9.645 -12.048 1.00 0.00 H new ATOM 0 HA TRP A 30 -31.668 -8.811 -9.484 1.00 0.00 H new ATOM 0 HB2 TRP A 30 -30.008 -7.775 -11.137 1.00 0.00 H new ATOM 0 HB3 TRP A 30 -31.363 -7.199 -12.087 1.00 0.00 H new ATOM 0 HD1 TRP A 30 -29.300 -6.378 -9.079 1.00 0.00 H new ATOM 0 HE1 TRP A 30 -30.151 -4.230 -7.921 1.00 0.00 H new ATOM 0 HE3 TRP A 30 -33.742 -5.849 -11.548 1.00 0.00 H new ATOM 0 HZ2 TRP A 30 -32.480 -2.528 -8.072 1.00 0.00 H new ATOM 0 HZ3 TRP A 30 -35.255 -3.960 -11.024 1.00 0.00 H new ATOM 0 HH2 TRP A 30 -34.631 -2.297 -9.292 1.00 0.00 H new ATOM 471 N ASP A 31 -33.906 -7.689 -9.447 1.00 0.00 N ATOM 472 CA ASP A 31 -35.340 -7.282 -9.411 1.00 0.00 C ATOM 473 C ASP A 31 -35.574 -6.274 -8.283 1.00 0.00 C ATOM 474 O ASP A 31 -34.645 -5.751 -7.701 1.00 0.00 O ATOM 475 CB ASP A 31 -36.112 -8.575 -9.143 1.00 0.00 C ATOM 476 CG ASP A 31 -37.233 -8.729 -10.172 1.00 0.00 C ATOM 477 OD1 ASP A 31 -37.269 -7.942 -11.104 1.00 0.00 O ATOM 478 OD2 ASP A 31 -38.039 -9.631 -10.010 1.00 0.00 O ATOM 0 H ASP A 31 -33.394 -7.553 -8.576 1.00 0.00 H new ATOM 0 HA ASP A 31 -35.657 -6.802 -10.337 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -35.438 -9.430 -9.195 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -36.529 -8.559 -8.136 1.00 0.00 H new ATOM 483 N GLU A 32 -36.811 -5.996 -7.971 1.00 0.00 N ATOM 484 CA GLU A 32 -37.103 -5.021 -6.881 1.00 0.00 C ATOM 485 C GLU A 32 -36.839 -5.661 -5.515 1.00 0.00 C ATOM 486 O GLU A 32 -36.082 -5.148 -4.714 1.00 0.00 O ATOM 487 CB GLU A 32 -38.586 -4.684 -7.039 1.00 0.00 C ATOM 488 CG GLU A 32 -38.889 -3.365 -6.325 1.00 0.00 C ATOM 489 CD GLU A 32 -39.928 -2.577 -7.126 1.00 0.00 C ATOM 490 OE1 GLU A 32 -41.038 -3.064 -7.259 1.00 0.00 O ATOM 491 OE2 GLU A 32 -39.595 -1.500 -7.592 1.00 0.00 O ATOM 0 H GLU A 32 -37.631 -6.401 -8.423 1.00 0.00 H new ATOM 0 HA GLU A 32 -36.475 -4.132 -6.941 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -38.841 -4.605 -8.096 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -39.198 -5.484 -6.623 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -39.262 -3.561 -5.320 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -37.976 -2.779 -6.218 1.00 0.00 H new ATOM 498 N LYS A 33 -37.457 -6.777 -5.242 1.00 0.00 N ATOM 499 CA LYS A 33 -37.241 -7.450 -3.930 1.00 0.00 C ATOM 500 C LYS A 33 -35.771 -7.851 -3.777 1.00 0.00 C ATOM 501 O LYS A 33 -35.237 -7.887 -2.686 1.00 0.00 O ATOM 502 CB LYS A 33 -38.133 -8.691 -3.968 1.00 0.00 C ATOM 503 CG LYS A 33 -39.285 -8.525 -2.974 1.00 0.00 C ATOM 504 CD LYS A 33 -38.873 -9.095 -1.615 1.00 0.00 C ATOM 505 CE LYS A 33 -38.969 -7.999 -0.551 1.00 0.00 C ATOM 506 NZ LYS A 33 -37.592 -7.882 0.004 1.00 0.00 N ATOM 0 H LYS A 33 -38.103 -7.253 -5.872 1.00 0.00 H new ATOM 0 HA LYS A 33 -37.483 -6.800 -3.089 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -38.526 -8.839 -4.974 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -37.550 -9.578 -3.720 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -39.545 -7.471 -2.875 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -40.173 -9.039 -3.342 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -39.518 -9.932 -1.349 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -37.855 -9.481 -1.664 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -39.302 -7.056 -0.984 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -39.687 -8.264 0.225 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -37.576 -7.149 0.741 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -37.305 -8.793 0.415 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -36.932 -7.622 -0.757 1.00 0.00 H new ATOM 520 N VAL A 34 -35.113 -8.152 -4.863 1.00 0.00 N ATOM 521 CA VAL A 34 -33.678 -8.550 -4.780 1.00 0.00 C ATOM 522 C VAL A 34 -32.815 -7.344 -4.399 1.00 0.00 C ATOM 523 O VAL A 34 -32.008 -7.408 -3.493 1.00 0.00 O ATOM 524 CB VAL A 34 -33.324 -9.042 -6.183 1.00 0.00 C ATOM 525 CG1 VAL A 34 -31.809 -9.228 -6.291 1.00 0.00 C ATOM 526 CG2 VAL A 34 -34.020 -10.379 -6.445 1.00 0.00 C ATOM 0 H VAL A 34 -35.506 -8.140 -5.804 1.00 0.00 H new ATOM 0 HA VAL A 34 -33.504 -9.315 -4.023 1.00 0.00 H new ATOM 0 HB VAL A 34 -33.654 -8.309 -6.919 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -31.556 -9.579 -7.291 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -31.311 -8.277 -6.103 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -31.479 -9.961 -5.555 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -33.768 -10.730 -7.446 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -33.689 -11.112 -5.709 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -35.099 -10.249 -6.367 1.00 0.00 H new ATOM 536 N ALA A 35 -32.979 -6.245 -5.084 1.00 0.00 N ATOM 537 CA ALA A 35 -32.167 -5.037 -4.761 1.00 0.00 C ATOM 538 C ALA A 35 -32.420 -4.601 -3.315 1.00 0.00 C ATOM 539 O ALA A 35 -31.501 -4.397 -2.547 1.00 0.00 O ATOM 540 CB ALA A 35 -32.649 -3.963 -5.736 1.00 0.00 C ATOM 0 H ALA A 35 -33.640 -6.131 -5.853 1.00 0.00 H new ATOM 0 HA ALA A 35 -31.097 -5.222 -4.855 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -32.097 -3.039 -5.562 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -32.481 -4.299 -6.759 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -33.713 -3.784 -5.583 1.00 0.00 H new ATOM 546 N GLU A 36 -33.662 -4.458 -2.937 1.00 0.00 N ATOM 547 CA GLU A 36 -33.973 -4.035 -1.542 1.00 0.00 C ATOM 548 C GLU A 36 -33.360 -5.018 -0.540 1.00 0.00 C ATOM 549 O GLU A 36 -32.576 -4.644 0.310 1.00 0.00 O ATOM 550 CB GLU A 36 -35.499 -4.061 -1.452 1.00 0.00 C ATOM 551 CG GLU A 36 -35.944 -3.444 -0.124 1.00 0.00 C ATOM 552 CD GLU A 36 -37.384 -3.864 0.177 1.00 0.00 C ATOM 553 OE1 GLU A 36 -38.274 -3.393 -0.512 1.00 0.00 O ATOM 554 OE2 GLU A 36 -37.572 -4.650 1.091 1.00 0.00 O ATOM 0 H GLU A 36 -34.474 -4.616 -3.534 1.00 0.00 H new ATOM 0 HA GLU A 36 -33.567 -3.051 -1.309 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -35.932 -3.508 -2.285 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -35.861 -5.086 -1.528 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -35.284 -3.769 0.680 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -35.874 -2.357 -0.174 1.00 0.00 H new ATOM 561 N TRP A 37 -33.710 -6.271 -0.634 1.00 0.00 N ATOM 562 CA TRP A 37 -33.148 -7.275 0.315 1.00 0.00 C ATOM 563 C TRP A 37 -31.629 -7.113 0.421 1.00 0.00 C ATOM 564 O TRP A 37 -31.050 -7.275 1.476 1.00 0.00 O ATOM 565 CB TRP A 37 -33.502 -8.633 -0.292 1.00 0.00 C ATOM 566 CG TRP A 37 -32.748 -9.708 0.422 1.00 0.00 C ATOM 567 CD1 TRP A 37 -33.080 -10.217 1.631 1.00 0.00 C ATOM 568 CD2 TRP A 37 -31.547 -10.415 -0.004 1.00 0.00 C ATOM 569 NE1 TRP A 37 -32.158 -11.191 1.975 1.00 0.00 N ATOM 570 CE2 TRP A 37 -31.194 -11.349 0.999 1.00 0.00 C ATOM 571 CE3 TRP A 37 -30.737 -10.336 -1.153 1.00 0.00 C ATOM 572 CZ2 TRP A 37 -30.078 -12.177 0.866 1.00 0.00 C ATOM 573 CZ3 TRP A 37 -29.612 -11.167 -1.290 1.00 0.00 C ATOM 574 CH2 TRP A 37 -29.283 -12.084 -0.282 1.00 0.00 C ATOM 0 H TRP A 37 -34.360 -6.644 -1.326 1.00 0.00 H new ATOM 0 HA TRP A 37 -33.549 -7.161 1.322 1.00 0.00 H new ATOM 0 HB2 TRP A 37 -34.574 -8.811 -0.212 1.00 0.00 H new ATOM 0 HB3 TRP A 37 -33.256 -8.644 -1.354 1.00 0.00 H new ATOM 0 HD1 TRP A 37 -33.926 -9.913 2.230 1.00 0.00 H new ATOM 0 HE1 TRP A 37 -32.187 -11.726 2.843 1.00 0.00 H new ATOM 0 HE3 TRP A 37 -30.982 -9.632 -1.934 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 -29.830 -12.884 1.644 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 -28.998 -11.099 -2.176 1.00 0.00 H new ATOM 0 HH2 TRP A 37 -28.416 -12.719 -0.391 1.00 0.00 H new ATOM 585 N LEU A 38 -30.979 -6.796 -0.666 1.00 0.00 N ATOM 586 CA LEU A 38 -29.498 -6.626 -0.625 1.00 0.00 C ATOM 587 C LEU A 38 -29.126 -5.423 0.247 1.00 0.00 C ATOM 588 O LEU A 38 -28.386 -5.543 1.202 1.00 0.00 O ATOM 589 CB LEU A 38 -29.087 -6.384 -2.079 1.00 0.00 C ATOM 590 CG LEU A 38 -27.722 -7.024 -2.335 1.00 0.00 C ATOM 591 CD1 LEU A 38 -27.585 -7.359 -3.821 1.00 0.00 C ATOM 592 CD2 LEU A 38 -26.617 -6.045 -1.930 1.00 0.00 C ATOM 0 H LEU A 38 -31.408 -6.648 -1.579 1.00 0.00 H new ATOM 0 HA LEU A 38 -28.994 -7.493 -0.198 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -29.831 -6.807 -2.754 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -29.043 -5.314 -2.283 1.00 0.00 H new ATOM 0 HG LEU A 38 -27.634 -7.938 -1.747 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -26.612 -7.815 -4.003 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -28.372 -8.055 -4.111 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -27.673 -6.446 -4.409 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -25.643 -6.500 -2.112 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -26.706 -5.132 -2.518 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -26.713 -5.805 -0.871 1.00 0.00 H new ATOM 604 N ALA A 39 -29.634 -4.265 -0.076 1.00 0.00 N ATOM 605 CA ALA A 39 -29.306 -3.056 0.737 1.00 0.00 C ATOM 606 C ALA A 39 -29.559 -3.333 2.222 1.00 0.00 C ATOM 607 O ALA A 39 -28.928 -2.757 3.086 1.00 0.00 O ATOM 608 CB ALA A 39 -30.250 -1.968 0.225 1.00 0.00 C ATOM 0 H ALA A 39 -30.260 -4.102 -0.865 1.00 0.00 H new ATOM 0 HA ALA A 39 -28.260 -2.765 0.643 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -30.072 -1.043 0.774 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -30.070 -1.800 -0.837 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -31.283 -2.284 0.372 1.00 0.00 H new ATOM 614 N ARG A 40 -30.477 -4.208 2.524 1.00 0.00 N ATOM 615 CA ARG A 40 -30.769 -4.520 3.953 1.00 0.00 C ATOM 616 C ARG A 40 -29.620 -5.326 4.564 1.00 0.00 C ATOM 617 O ARG A 40 -28.964 -4.887 5.489 1.00 0.00 O ATOM 618 CB ARG A 40 -32.051 -5.353 3.923 1.00 0.00 C ATOM 619 CG ARG A 40 -32.754 -5.258 5.279 1.00 0.00 C ATOM 620 CD ARG A 40 -33.002 -6.666 5.826 1.00 0.00 C ATOM 621 NE ARG A 40 -34.400 -6.640 6.335 1.00 0.00 N ATOM 622 CZ ARG A 40 -34.797 -7.535 7.199 1.00 0.00 C ATOM 623 NH1 ARG A 40 -34.256 -8.723 7.203 1.00 0.00 N ATOM 624 NH2 ARG A 40 -35.735 -7.242 8.057 1.00 0.00 N ATOM 0 H ARG A 40 -31.038 -4.721 1.844 1.00 0.00 H new ATOM 0 HA ARG A 40 -30.882 -3.620 4.557 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -32.711 -4.995 3.133 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -31.816 -6.393 3.695 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -32.143 -4.687 5.978 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -33.699 -4.726 5.174 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -32.879 -7.419 5.048 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -32.297 -6.911 6.621 1.00 0.00 H new ATOM 0 HE ARG A 40 -35.048 -5.923 6.009 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -33.523 -8.952 6.531 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -34.566 -9.422 7.878 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -36.158 -6.314 8.053 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -36.045 -7.941 8.732 1.00 0.00 H new ATOM 638 N GLU A 41 -29.371 -6.502 4.055 1.00 0.00 N ATOM 639 CA GLU A 41 -28.264 -7.334 4.608 1.00 0.00 C ATOM 640 C GLU A 41 -26.983 -6.503 4.728 1.00 0.00 C ATOM 641 O GLU A 41 -26.218 -6.655 5.659 1.00 0.00 O ATOM 642 CB GLU A 41 -28.076 -8.464 3.594 1.00 0.00 C ATOM 643 CG GLU A 41 -28.775 -9.726 4.101 1.00 0.00 C ATOM 644 CD GLU A 41 -30.291 -9.534 4.032 1.00 0.00 C ATOM 645 OE1 GLU A 41 -30.765 -9.085 3.000 1.00 0.00 O ATOM 646 OE2 GLU A 41 -30.953 -9.837 5.011 1.00 0.00 O ATOM 0 H GLU A 41 -29.885 -6.922 3.281 1.00 0.00 H new ATOM 0 HA GLU A 41 -28.490 -7.712 5.605 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -28.486 -8.172 2.627 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -27.014 -8.659 3.444 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -28.479 -10.585 3.499 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -28.471 -9.936 5.126 1.00 0.00 H new ATOM 653 N LEU A 42 -26.744 -5.628 3.790 1.00 0.00 N ATOM 654 CA LEU A 42 -25.513 -4.790 3.849 1.00 0.00 C ATOM 655 C LEU A 42 -25.718 -3.610 4.805 1.00 0.00 C ATOM 656 O LEU A 42 -25.213 -3.601 5.911 1.00 0.00 O ATOM 657 CB LEU A 42 -25.304 -4.292 2.420 1.00 0.00 C ATOM 658 CG LEU A 42 -24.078 -4.976 1.814 1.00 0.00 C ATOM 659 CD1 LEU A 42 -22.859 -4.722 2.702 1.00 0.00 C ATOM 660 CD2 LEU A 42 -24.331 -6.482 1.719 1.00 0.00 C ATOM 0 H LEU A 42 -27.348 -5.457 2.986 1.00 0.00 H new ATOM 0 HA LEU A 42 -24.652 -5.348 4.216 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -26.187 -4.504 1.817 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -25.169 -3.210 2.417 1.00 0.00 H new ATOM 0 HG LEU A 42 -23.893 -4.572 0.819 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -21.986 -5.210 2.269 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -22.678 -3.650 2.773 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -23.044 -5.125 3.698 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -23.458 -6.971 1.287 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -24.516 -6.883 2.715 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -25.200 -6.666 1.087 1.00 0.00 H new ATOM 672 N GLU A 43 -26.453 -2.617 4.388 1.00 0.00 N ATOM 673 CA GLU A 43 -26.689 -1.440 5.273 1.00 0.00 C ATOM 674 C GLU A 43 -27.857 -1.716 6.223 1.00 0.00 C ATOM 675 O GLU A 43 -27.667 -1.997 7.391 1.00 0.00 O ATOM 676 CB GLU A 43 -27.028 -0.291 4.324 1.00 0.00 C ATOM 677 CG GLU A 43 -26.078 0.880 4.577 1.00 0.00 C ATOM 678 CD GLU A 43 -26.609 1.730 5.732 1.00 0.00 C ATOM 679 OE1 GLU A 43 -27.526 1.278 6.401 1.00 0.00 O ATOM 680 OE2 GLU A 43 -26.092 2.816 5.930 1.00 0.00 O ATOM 0 H GLU A 43 -26.901 -2.569 3.473 1.00 0.00 H new ATOM 0 HA GLU A 43 -25.823 -1.212 5.895 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -26.944 -0.624 3.289 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -28.060 0.026 4.474 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -25.081 0.508 4.814 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -25.986 1.488 3.677 1.00 0.00 H new ATOM 687 N GLY A 44 -29.064 -1.639 5.734 1.00 0.00 N ATOM 688 CA GLY A 44 -30.240 -1.898 6.611 1.00 0.00 C ATOM 689 C GLY A 44 -31.433 -1.072 6.127 1.00 0.00 C ATOM 690 O GLY A 44 -32.198 -0.551 6.914 1.00 0.00 O ATOM 0 H GLY A 44 -29.286 -1.408 4.766 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -30.490 -2.959 6.597 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -30.001 -1.640 7.643 1.00 0.00 H new ATOM 694 N ILE A 45 -31.601 -0.948 4.839 1.00 0.00 N ATOM 695 CA ILE A 45 -32.747 -0.156 4.310 1.00 0.00 C ATOM 696 C ILE A 45 -34.029 -0.993 4.356 1.00 0.00 C ATOM 697 O ILE A 45 -34.232 -1.880 3.551 1.00 0.00 O ATOM 698 CB ILE A 45 -32.369 0.174 2.866 1.00 0.00 C ATOM 699 CG1 ILE A 45 -31.273 1.243 2.859 1.00 0.00 C ATOM 700 CG2 ILE A 45 -33.598 0.700 2.123 1.00 0.00 C ATOM 701 CD1 ILE A 45 -30.875 1.560 1.416 1.00 0.00 C ATOM 0 H ILE A 45 -30.994 -1.361 4.130 1.00 0.00 H new ATOM 0 HA ILE A 45 -32.934 0.745 4.895 1.00 0.00 H new ATOM 0 HB ILE A 45 -32.004 -0.726 2.371 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -31.628 2.146 3.356 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -30.405 0.892 3.418 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -33.328 0.935 1.094 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -34.379 -0.060 2.129 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -33.964 1.600 2.617 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -30.095 2.321 1.413 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -30.502 0.656 0.934 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -31.744 1.929 0.872 1.00 0.00 H new ATOM 713 N GLN A 46 -34.893 -0.720 5.294 1.00 0.00 N ATOM 714 CA GLN A 46 -36.159 -1.503 5.397 1.00 0.00 C ATOM 715 C GLN A 46 -37.173 -1.015 4.357 1.00 0.00 C ATOM 716 O GLN A 46 -38.116 -1.704 4.027 1.00 0.00 O ATOM 717 CB GLN A 46 -36.674 -1.239 6.812 1.00 0.00 C ATOM 718 CG GLN A 46 -35.520 -1.367 7.808 1.00 0.00 C ATOM 719 CD GLN A 46 -36.070 -1.761 9.180 1.00 0.00 C ATOM 720 OE1 GLN A 46 -37.249 -2.016 9.325 1.00 0.00 O ATOM 721 NE2 GLN A 46 -35.259 -1.821 10.201 1.00 0.00 N ATOM 0 H GLN A 46 -34.778 0.012 5.995 1.00 0.00 H new ATOM 0 HA GLN A 46 -36.002 -2.565 5.211 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -37.110 -0.242 6.871 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -37.464 -1.948 7.061 1.00 0.00 H new ATOM 0 HG2 GLN A 46 -34.808 -2.116 7.461 1.00 0.00 H new ATOM 0 HG3 GLN A 46 -34.980 -0.423 7.878 1.00 0.00 H new ATOM 0 HE21 GLN A 46 -34.269 -1.607 10.079 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -35.615 -2.082 11.121 1.00 0.00 H new ATOM 730 N LYS A 47 -36.986 0.169 3.841 1.00 0.00 N ATOM 731 CA LYS A 47 -37.943 0.695 2.824 1.00 0.00 C ATOM 732 C LYS A 47 -37.233 1.671 1.883 1.00 0.00 C ATOM 733 O LYS A 47 -37.083 2.839 2.183 1.00 0.00 O ATOM 734 CB LYS A 47 -39.021 1.418 3.633 1.00 0.00 C ATOM 735 CG LYS A 47 -40.367 1.292 2.917 1.00 0.00 C ATOM 736 CD LYS A 47 -41.331 2.355 3.448 1.00 0.00 C ATOM 737 CE LYS A 47 -42.687 2.207 2.756 1.00 0.00 C ATOM 738 NZ LYS A 47 -43.442 3.437 3.123 1.00 0.00 N ATOM 0 H LYS A 47 -36.215 0.794 4.078 1.00 0.00 H new ATOM 0 HA LYS A 47 -38.361 -0.096 2.202 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -39.088 0.991 4.633 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -38.758 2.469 3.752 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -40.232 1.413 1.842 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -40.783 0.297 3.076 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -41.448 2.249 4.526 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -40.926 3.351 3.268 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -42.572 2.122 1.675 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -43.206 1.310 3.093 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -44.385 3.409 2.685 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -43.542 3.487 4.157 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -42.927 4.275 2.784 1.00 0.00 H new ATOM 752 N MET A 48 -36.798 1.202 0.746 1.00 0.00 N ATOM 753 CA MET A 48 -36.099 2.105 -0.214 1.00 0.00 C ATOM 754 C MET A 48 -36.949 3.353 -0.475 1.00 0.00 C ATOM 755 O MET A 48 -37.919 3.313 -1.206 1.00 0.00 O ATOM 756 CB MET A 48 -35.946 1.283 -1.493 1.00 0.00 C ATOM 757 CG MET A 48 -34.887 0.201 -1.280 1.00 0.00 C ATOM 758 SD MET A 48 -33.237 0.937 -1.411 1.00 0.00 S ATOM 759 CE MET A 48 -33.242 1.185 -3.204 1.00 0.00 C ATOM 0 H MET A 48 -36.896 0.234 0.440 1.00 0.00 H new ATOM 0 HA MET A 48 -35.136 2.448 0.165 1.00 0.00 H new ATOM 0 HB2 MET A 48 -36.899 0.827 -1.761 1.00 0.00 H new ATOM 0 HB3 MET A 48 -35.659 1.930 -2.322 1.00 0.00 H new ATOM 0 HG2 MET A 48 -35.015 -0.260 -0.301 1.00 0.00 H new ATOM 0 HG3 MET A 48 -35.004 -0.589 -2.022 1.00 0.00 H new ATOM 0 HE1 MET A 48 -32.307 1.654 -3.509 1.00 0.00 H new ATOM 0 HE2 MET A 48 -33.345 0.222 -3.704 1.00 0.00 H new ATOM 0 HE3 MET A 48 -34.077 1.828 -3.480 1.00 0.00 H new ATOM 769 N THR A 49 -36.591 4.459 0.116 1.00 0.00 N ATOM 770 CA THR A 49 -37.378 5.707 -0.099 1.00 0.00 C ATOM 771 C THR A 49 -37.466 6.024 -1.594 1.00 0.00 C ATOM 772 O THR A 49 -36.682 5.544 -2.388 1.00 0.00 O ATOM 773 CB THR A 49 -36.601 6.798 0.639 1.00 0.00 C ATOM 774 OG1 THR A 49 -37.151 8.069 0.320 1.00 0.00 O ATOM 775 CG2 THR A 49 -35.131 6.755 0.217 1.00 0.00 C ATOM 0 H THR A 49 -35.788 4.553 0.738 1.00 0.00 H new ATOM 0 HA THR A 49 -38.401 5.620 0.267 1.00 0.00 H new ATOM 0 HB THR A 49 -36.673 6.631 1.714 1.00 0.00 H new ATOM 0 HG1 THR A 49 -36.655 8.769 0.794 1.00 0.00 H new ATOM 0 HG21 THR A 49 -34.578 7.533 0.744 1.00 0.00 H new ATOM 0 HG22 THR A 49 -34.710 5.780 0.464 1.00 0.00 H new ATOM 0 HG23 THR A 49 -35.056 6.921 -0.858 1.00 0.00 H new ATOM 783 N GLU A 50 -38.418 6.828 -1.985 1.00 0.00 N ATOM 784 CA GLU A 50 -38.556 7.173 -3.430 1.00 0.00 C ATOM 785 C GLU A 50 -37.223 7.686 -3.983 1.00 0.00 C ATOM 786 O GLU A 50 -36.866 7.421 -5.113 1.00 0.00 O ATOM 787 CB GLU A 50 -39.614 8.275 -3.475 1.00 0.00 C ATOM 788 CG GLU A 50 -40.573 8.018 -4.639 1.00 0.00 C ATOM 789 CD GLU A 50 -41.993 7.831 -4.100 1.00 0.00 C ATOM 790 OE1 GLU A 50 -42.124 7.353 -2.986 1.00 0.00 O ATOM 791 OE2 GLU A 50 -42.925 8.171 -4.811 1.00 0.00 O ATOM 0 H GLU A 50 -39.105 7.260 -1.368 1.00 0.00 H new ATOM 0 HA GLU A 50 -38.839 6.311 -4.034 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -40.166 8.302 -2.535 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -39.136 9.248 -3.592 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -40.545 8.854 -5.338 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -40.262 7.131 -5.191 1.00 0.00 H new ATOM 798 N GLU A 51 -36.485 8.419 -3.195 1.00 0.00 N ATOM 799 CA GLU A 51 -35.177 8.949 -3.677 1.00 0.00 C ATOM 800 C GLU A 51 -34.221 7.796 -3.995 1.00 0.00 C ATOM 801 O GLU A 51 -33.430 7.867 -4.914 1.00 0.00 O ATOM 802 CB GLU A 51 -34.639 9.789 -2.517 1.00 0.00 C ATOM 803 CG GLU A 51 -35.187 11.213 -2.618 1.00 0.00 C ATOM 804 CD GLU A 51 -36.003 11.537 -1.364 1.00 0.00 C ATOM 805 OE1 GLU A 51 -35.405 11.654 -0.307 1.00 0.00 O ATOM 806 OE2 GLU A 51 -37.211 11.664 -1.483 1.00 0.00 O ATOM 0 H GLU A 51 -36.731 8.674 -2.238 1.00 0.00 H new ATOM 0 HA GLU A 51 -35.280 9.534 -4.591 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -34.930 9.343 -1.566 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -33.549 9.805 -2.541 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -34.367 11.923 -2.724 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -35.811 11.312 -3.506 1.00 0.00 H new ATOM 813 N HIS A 52 -34.284 6.735 -3.238 1.00 0.00 N ATOM 814 CA HIS A 52 -33.377 5.579 -3.493 1.00 0.00 C ATOM 815 C HIS A 52 -33.690 4.939 -4.850 1.00 0.00 C ATOM 816 O HIS A 52 -32.853 4.880 -5.727 1.00 0.00 O ATOM 817 CB HIS A 52 -33.668 4.593 -2.361 1.00 0.00 C ATOM 818 CG HIS A 52 -32.922 5.009 -1.124 1.00 0.00 C ATOM 819 ND1 HIS A 52 -33.398 4.727 0.164 1.00 0.00 N ATOM 820 CD2 HIS A 52 -31.733 5.683 -0.947 1.00 0.00 C ATOM 821 CE1 HIS A 52 -32.508 5.226 1.046 1.00 0.00 C ATOM 822 NE2 HIS A 52 -31.501 5.804 0.409 1.00 0.00 N ATOM 0 H HIS A 52 -34.925 6.618 -2.453 1.00 0.00 H new ATOM 0 HA HIS A 52 -32.329 5.879 -3.520 1.00 0.00 H new ATOM 0 HB2 HIS A 52 -34.739 4.562 -2.159 1.00 0.00 H new ATOM 0 HB3 HIS A 52 -33.370 3.587 -2.656 1.00 0.00 H new ATOM 0 HD2 HIS A 52 -31.092 6.053 -1.734 1.00 0.00 H new ATOM 0 HE1 HIS A 52 -32.603 5.163 2.120 1.00 0.00 H new ATOM 0 HE2 HIS A 52 -30.697 6.258 0.843 1.00 0.00 H new ATOM 830 N TRP A 53 -34.889 4.453 -5.023 1.00 0.00 N ATOM 831 CA TRP A 53 -35.257 3.808 -6.317 1.00 0.00 C ATOM 832 C TRP A 53 -35.043 4.776 -7.486 1.00 0.00 C ATOM 833 O TRP A 53 -34.684 4.374 -8.575 1.00 0.00 O ATOM 834 CB TRP A 53 -36.738 3.458 -6.176 1.00 0.00 C ATOM 835 CG TRP A 53 -36.873 2.082 -5.608 1.00 0.00 C ATOM 836 CD1 TRP A 53 -37.653 1.748 -4.555 1.00 0.00 C ATOM 837 CD2 TRP A 53 -36.224 0.851 -6.042 1.00 0.00 C ATOM 838 NE1 TRP A 53 -37.525 0.392 -4.314 1.00 0.00 N ATOM 839 CE2 TRP A 53 -36.655 -0.205 -5.205 1.00 0.00 C ATOM 840 CE3 TRP A 53 -35.312 0.552 -7.073 1.00 0.00 C ATOM 841 CZ2 TRP A 53 -36.198 -1.513 -5.383 1.00 0.00 C ATOM 842 CZ3 TRP A 53 -34.850 -0.763 -7.255 1.00 0.00 C ATOM 843 CH2 TRP A 53 -35.293 -1.792 -6.411 1.00 0.00 C ATOM 0 H TRP A 53 -35.631 4.475 -4.323 1.00 0.00 H new ATOM 0 HA TRP A 53 -34.644 2.930 -6.524 1.00 0.00 H new ATOM 0 HB2 TRP A 53 -37.233 4.181 -5.528 1.00 0.00 H new ATOM 0 HB3 TRP A 53 -37.229 3.512 -7.147 1.00 0.00 H new ATOM 0 HD1 TRP A 53 -38.275 2.429 -3.993 1.00 0.00 H new ATOM 0 HE1 TRP A 53 -38.013 -0.106 -3.570 1.00 0.00 H new ATOM 0 HE3 TRP A 53 -34.966 1.338 -7.728 1.00 0.00 H new ATOM 0 HZ2 TRP A 53 -36.541 -2.303 -4.731 1.00 0.00 H new ATOM 0 HZ3 TRP A 53 -34.151 -0.982 -8.048 1.00 0.00 H new ATOM 0 HH2 TRP A 53 -34.935 -2.800 -6.556 1.00 0.00 H new ATOM 854 N LYS A 54 -35.265 6.044 -7.274 1.00 0.00 N ATOM 855 CA LYS A 54 -35.077 7.027 -8.382 1.00 0.00 C ATOM 856 C LYS A 54 -33.614 7.050 -8.835 1.00 0.00 C ATOM 857 O LYS A 54 -33.303 6.777 -9.978 1.00 0.00 O ATOM 858 CB LYS A 54 -35.476 8.378 -7.787 1.00 0.00 C ATOM 859 CG LYS A 54 -36.507 9.050 -8.695 1.00 0.00 C ATOM 860 CD LYS A 54 -37.068 10.293 -8.002 1.00 0.00 C ATOM 861 CE LYS A 54 -38.594 10.195 -7.938 1.00 0.00 C ATOM 862 NZ LYS A 54 -39.078 11.588 -8.149 1.00 0.00 N ATOM 0 H LYS A 54 -35.567 6.443 -6.385 1.00 0.00 H new ATOM 0 HA LYS A 54 -35.673 6.775 -9.259 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -35.890 8.240 -6.788 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -34.598 9.015 -7.682 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -36.046 9.327 -9.643 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -37.314 8.354 -8.924 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -36.656 10.379 -6.997 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -36.773 11.190 -8.546 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -38.979 9.523 -8.705 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -38.925 9.804 -6.976 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -40.117 11.603 -8.119 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -38.701 12.204 -7.400 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -38.754 11.932 -9.076 1.00 0.00 H new ATOM 876 N LEU A 55 -32.713 7.376 -7.949 1.00 0.00 N ATOM 877 CA LEU A 55 -31.272 7.415 -8.332 1.00 0.00 C ATOM 878 C LEU A 55 -30.864 6.097 -8.993 1.00 0.00 C ATOM 879 O LEU A 55 -30.108 6.076 -9.943 1.00 0.00 O ATOM 880 CB LEU A 55 -30.517 7.613 -7.017 1.00 0.00 C ATOM 881 CG LEU A 55 -29.246 8.423 -7.274 1.00 0.00 C ATOM 882 CD1 LEU A 55 -29.573 9.916 -7.218 1.00 0.00 C ATOM 883 CD2 LEU A 55 -28.204 8.090 -6.204 1.00 0.00 C ATOM 0 H LEU A 55 -32.911 7.617 -6.978 1.00 0.00 H new ATOM 0 HA LEU A 55 -31.057 8.208 -9.048 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -31.151 8.130 -6.296 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -30.263 6.646 -6.582 1.00 0.00 H new ATOM 0 HG LEU A 55 -28.849 8.174 -8.258 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -28.667 10.494 -7.401 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -30.316 10.155 -7.979 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -29.969 10.165 -6.234 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -27.298 8.667 -6.387 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -28.601 8.339 -5.220 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -27.970 7.026 -6.242 1.00 0.00 H new ATOM 895 N VAL A 56 -31.358 4.996 -8.497 1.00 0.00 N ATOM 896 CA VAL A 56 -30.999 3.679 -9.099 1.00 0.00 C ATOM 897 C VAL A 56 -31.614 3.551 -10.494 1.00 0.00 C ATOM 898 O VAL A 56 -31.072 2.902 -11.366 1.00 0.00 O ATOM 899 CB VAL A 56 -31.591 2.636 -8.152 1.00 0.00 C ATOM 900 CG1 VAL A 56 -31.253 1.234 -8.662 1.00 0.00 C ATOM 901 CG2 VAL A 56 -31.001 2.825 -6.753 1.00 0.00 C ATOM 0 H VAL A 56 -31.995 4.950 -7.701 1.00 0.00 H new ATOM 0 HA VAL A 56 -29.922 3.557 -9.215 1.00 0.00 H new ATOM 0 HB VAL A 56 -32.674 2.756 -8.110 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -31.675 0.490 -7.987 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -31.672 1.099 -9.659 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -30.171 1.113 -8.704 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -31.423 2.081 -6.077 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -29.919 2.704 -6.795 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -31.241 3.824 -6.389 1.00 0.00 H new ATOM 911 N LYS A 57 -32.745 4.163 -10.710 1.00 0.00 N ATOM 912 CA LYS A 57 -33.397 4.075 -12.049 1.00 0.00 C ATOM 913 C LYS A 57 -32.544 4.793 -13.098 1.00 0.00 C ATOM 914 O LYS A 57 -32.253 4.256 -14.148 1.00 0.00 O ATOM 915 CB LYS A 57 -34.744 4.778 -11.880 1.00 0.00 C ATOM 916 CG LYS A 57 -35.875 3.786 -12.164 1.00 0.00 C ATOM 917 CD LYS A 57 -36.942 3.903 -11.073 1.00 0.00 C ATOM 918 CE LYS A 57 -37.914 5.031 -11.426 1.00 0.00 C ATOM 919 NZ LYS A 57 -39.128 4.763 -10.607 1.00 0.00 N ATOM 0 H LYS A 57 -33.247 4.720 -10.018 1.00 0.00 H new ATOM 0 HA LYS A 57 -33.515 3.045 -12.386 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -34.837 5.172 -10.868 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -34.811 5.627 -12.560 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -36.314 3.989 -13.141 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -35.482 2.770 -12.196 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -37.482 2.961 -10.975 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -36.472 4.102 -10.110 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -37.488 6.007 -11.193 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -38.148 5.032 -12.491 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -39.842 5.496 -10.794 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -39.516 3.830 -10.856 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -38.876 4.775 -9.598 1.00 0.00 H new ATOM 933 N TYR A 58 -32.142 6.004 -12.823 1.00 0.00 N ATOM 934 CA TYR A 58 -31.308 6.751 -13.808 1.00 0.00 C ATOM 935 C TYR A 58 -29.937 6.086 -13.954 1.00 0.00 C ATOM 936 O TYR A 58 -29.354 6.070 -15.019 1.00 0.00 O ATOM 937 CB TYR A 58 -31.164 8.157 -13.222 1.00 0.00 C ATOM 938 CG TYR A 58 -31.284 9.177 -14.328 1.00 0.00 C ATOM 939 CD1 TYR A 58 -32.454 9.241 -15.098 1.00 0.00 C ATOM 940 CD2 TYR A 58 -30.227 10.059 -14.586 1.00 0.00 C ATOM 941 CE1 TYR A 58 -32.566 10.188 -16.125 1.00 0.00 C ATOM 942 CE2 TYR A 58 -30.338 11.006 -15.614 1.00 0.00 C ATOM 943 CZ TYR A 58 -31.508 11.069 -16.384 1.00 0.00 C ATOM 944 OH TYR A 58 -31.617 12.002 -17.395 1.00 0.00 O ATOM 0 H TYR A 58 -32.354 6.507 -11.962 1.00 0.00 H new ATOM 0 HA TYR A 58 -31.759 6.768 -14.800 1.00 0.00 H new ATOM 0 HB2 TYR A 58 -31.933 8.329 -12.469 1.00 0.00 H new ATOM 0 HB3 TYR A 58 -30.200 8.258 -12.723 1.00 0.00 H new ATOM 0 HD1 TYR A 58 -33.269 8.561 -14.900 1.00 0.00 H new ATOM 0 HD2 TYR A 58 -29.326 10.010 -13.993 1.00 0.00 H new ATOM 0 HE1 TYR A 58 -33.468 10.239 -16.717 1.00 0.00 H new ATOM 0 HE2 TYR A 58 -29.523 11.686 -15.813 1.00 0.00 H new ATOM 0 HH TYR A 58 -31.690 12.899 -17.006 1.00 0.00 H new ATOM 954 N LEU A 59 -29.418 5.535 -12.889 1.00 0.00 N ATOM 955 CA LEU A 59 -28.086 4.870 -12.968 1.00 0.00 C ATOM 956 C LEU A 59 -28.146 3.675 -13.924 1.00 0.00 C ATOM 957 O LEU A 59 -27.182 3.349 -14.588 1.00 0.00 O ATOM 958 CB LEU A 59 -27.794 4.401 -11.542 1.00 0.00 C ATOM 959 CG LEU A 59 -26.572 5.146 -11.000 1.00 0.00 C ATOM 960 CD1 LEU A 59 -25.387 4.941 -11.945 1.00 0.00 C ATOM 961 CD2 LEU A 59 -26.891 6.639 -10.898 1.00 0.00 C ATOM 0 H LEU A 59 -29.859 5.517 -11.969 1.00 0.00 H new ATOM 0 HA LEU A 59 -27.312 5.539 -13.345 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -28.658 4.585 -10.903 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -27.612 3.326 -11.531 1.00 0.00 H new ATOM 0 HG LEU A 59 -26.319 4.759 -10.013 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -24.517 5.472 -11.558 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -25.160 3.877 -12.018 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -25.638 5.327 -12.933 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -26.022 7.171 -10.512 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -27.144 7.025 -11.885 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -27.735 6.786 -10.224 1.00 0.00 H new ATOM 973 N ARG A 60 -29.272 3.019 -13.997 1.00 0.00 N ATOM 974 CA ARG A 60 -29.392 1.845 -14.910 1.00 0.00 C ATOM 975 C ARG A 60 -29.282 2.297 -16.369 1.00 0.00 C ATOM 976 O ARG A 60 -28.531 1.742 -17.145 1.00 0.00 O ATOM 977 CB ARG A 60 -30.780 1.268 -14.630 1.00 0.00 C ATOM 978 CG ARG A 60 -30.794 -0.221 -14.978 1.00 0.00 C ATOM 979 CD ARG A 60 -32.199 -0.784 -14.756 1.00 0.00 C ATOM 980 NE ARG A 60 -31.984 -2.188 -14.308 1.00 0.00 N ATOM 981 CZ ARG A 60 -32.975 -3.038 -14.327 1.00 0.00 C ATOM 982 NH1 ARG A 60 -33.873 -3.015 -13.381 1.00 0.00 N ATOM 983 NH2 ARG A 60 -33.067 -3.910 -15.294 1.00 0.00 N ATOM 0 H ARG A 60 -30.113 3.244 -13.465 1.00 0.00 H new ATOM 0 HA ARG A 60 -28.604 1.110 -14.746 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -31.039 1.409 -13.581 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -31.530 1.797 -15.218 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -30.493 -0.366 -16.015 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -30.074 -0.757 -14.359 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -32.741 -0.209 -14.005 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -32.788 -0.748 -15.672 1.00 0.00 H new ATOM 0 HE ARG A 60 -31.063 -2.485 -13.986 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -33.801 -2.333 -12.626 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -34.647 -3.679 -13.396 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -32.365 -3.927 -16.034 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -33.841 -4.574 -15.310 1.00 0.00 H new ATOM 997 N GLU A 61 -30.026 3.300 -16.747 1.00 0.00 N ATOM 998 CA GLU A 61 -29.963 3.787 -18.155 1.00 0.00 C ATOM 999 C GLU A 61 -28.508 3.866 -18.622 1.00 0.00 C ATOM 1000 O GLU A 61 -28.168 3.427 -19.703 1.00 0.00 O ATOM 1001 CB GLU A 61 -30.594 5.180 -18.121 1.00 0.00 C ATOM 1002 CG GLU A 61 -32.092 5.055 -17.840 1.00 0.00 C ATOM 1003 CD GLU A 61 -32.817 4.628 -19.119 1.00 0.00 C ATOM 1004 OE1 GLU A 61 -32.852 3.438 -19.386 1.00 0.00 O ATOM 1005 OE2 GLU A 61 -33.325 5.498 -19.807 1.00 0.00 O ATOM 0 H GLU A 61 -30.675 3.804 -16.142 1.00 0.00 H new ATOM 0 HA GLU A 61 -30.482 3.123 -18.846 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -30.118 5.788 -17.351 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -30.433 5.687 -19.072 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -32.265 4.324 -17.050 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -32.487 6.007 -17.486 1.00 0.00 H new ATOM 1012 N TYR A 62 -27.646 4.421 -17.815 1.00 0.00 N ATOM 1013 CA TYR A 62 -26.212 4.526 -18.214 1.00 0.00 C ATOM 1014 C TYR A 62 -25.536 3.156 -18.123 1.00 0.00 C ATOM 1015 O TYR A 62 -24.639 2.843 -18.880 1.00 0.00 O ATOM 1016 CB TYR A 62 -25.592 5.498 -17.208 1.00 0.00 C ATOM 1017 CG TYR A 62 -24.596 6.386 -17.913 1.00 0.00 C ATOM 1018 CD1 TYR A 62 -23.362 5.865 -18.326 1.00 0.00 C ATOM 1019 CD2 TYR A 62 -24.903 7.732 -18.154 1.00 0.00 C ATOM 1020 CE1 TYR A 62 -22.437 6.690 -18.979 1.00 0.00 C ATOM 1021 CE2 TYR A 62 -23.977 8.557 -18.806 1.00 0.00 C ATOM 1022 CZ TYR A 62 -22.744 8.036 -19.219 1.00 0.00 C ATOM 1023 OH TYR A 62 -21.832 8.848 -19.862 1.00 0.00 O ATOM 0 H TYR A 62 -27.871 4.806 -16.898 1.00 0.00 H new ATOM 0 HA TYR A 62 -26.093 4.871 -19.241 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -26.371 6.104 -16.744 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -25.100 4.945 -16.408 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -23.124 4.828 -18.141 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -25.854 8.134 -17.837 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -21.487 6.288 -19.298 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -24.214 9.594 -18.990 1.00 0.00 H new ATOM 0 HH TYR A 62 -22.203 9.751 -19.950 1.00 0.00 H new ATOM 1033 N TRP A 63 -25.961 2.334 -17.201 1.00 0.00 N ATOM 1034 CA TRP A 63 -25.341 0.984 -17.063 1.00 0.00 C ATOM 1035 C TRP A 63 -25.946 0.019 -18.086 1.00 0.00 C ATOM 1036 O TRP A 63 -25.701 -1.171 -18.052 1.00 0.00 O ATOM 1037 CB TRP A 63 -25.677 0.538 -15.640 1.00 0.00 C ATOM 1038 CG TRP A 63 -25.202 -0.864 -15.433 1.00 0.00 C ATOM 1039 CD1 TRP A 63 -23.924 -1.218 -15.158 1.00 0.00 C ATOM 1040 CD2 TRP A 63 -25.969 -2.101 -15.478 1.00 0.00 C ATOM 1041 NE1 TRP A 63 -23.860 -2.594 -15.032 1.00 0.00 N ATOM 1042 CE2 TRP A 63 -25.094 -3.184 -15.221 1.00 0.00 C ATOM 1043 CE3 TRP A 63 -27.327 -2.387 -15.716 1.00 0.00 C ATOM 1044 CZ2 TRP A 63 -25.551 -4.502 -15.200 1.00 0.00 C ATOM 1045 CZ3 TRP A 63 -27.791 -3.714 -15.695 1.00 0.00 C ATOM 1046 CH2 TRP A 63 -26.903 -4.769 -15.437 1.00 0.00 C ATOM 0 H TRP A 63 -26.709 2.538 -16.539 1.00 0.00 H new ATOM 0 HA TRP A 63 -24.266 1.002 -17.241 1.00 0.00 H new ATOM 0 HB2 TRP A 63 -25.205 1.204 -14.918 1.00 0.00 H new ATOM 0 HB3 TRP A 63 -26.752 0.598 -15.473 1.00 0.00 H new ATOM 0 HD1 TRP A 63 -23.092 -0.538 -15.054 1.00 0.00 H new ATOM 0 HE1 TRP A 63 -23.005 -3.110 -14.825 1.00 0.00 H new ATOM 0 HE3 TRP A 63 -28.017 -1.581 -15.916 1.00 0.00 H new ATOM 0 HZ2 TRP A 63 -24.864 -5.312 -15.002 1.00 0.00 H new ATOM 0 HZ3 TRP A 63 -28.835 -3.922 -15.878 1.00 0.00 H new ATOM 0 HH2 TRP A 63 -27.263 -5.787 -15.421 1.00 0.00 H new ATOM 1057 N GLU A 64 -26.732 0.522 -18.998 1.00 0.00 N ATOM 1058 CA GLU A 64 -27.349 -0.368 -20.024 1.00 0.00 C ATOM 1059 C GLU A 64 -26.789 -0.043 -21.412 1.00 0.00 C ATOM 1060 O GLU A 64 -26.897 -0.825 -22.335 1.00 0.00 O ATOM 1061 CB GLU A 64 -28.846 -0.061 -19.964 1.00 0.00 C ATOM 1062 CG GLU A 64 -29.633 -1.252 -20.516 1.00 0.00 C ATOM 1063 CD GLU A 64 -31.081 -0.832 -20.775 1.00 0.00 C ATOM 1064 OE1 GLU A 64 -31.287 0.017 -21.626 1.00 0.00 O ATOM 1065 OE2 GLU A 64 -31.959 -1.366 -20.117 1.00 0.00 O ATOM 0 H GLU A 64 -26.974 1.510 -19.078 1.00 0.00 H new ATOM 0 HA GLU A 64 -27.141 -1.421 -19.837 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -29.146 0.142 -18.936 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -29.068 0.835 -20.543 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -29.176 -1.607 -21.440 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -29.605 -2.080 -19.808 1.00 0.00 H new ATOM 1072 N THR A 65 -26.190 1.107 -21.564 1.00 0.00 N ATOM 1073 CA THR A 65 -25.624 1.482 -22.893 1.00 0.00 C ATOM 1074 C THR A 65 -24.094 1.467 -22.836 1.00 0.00 C ATOM 1075 O THR A 65 -23.436 0.937 -23.710 1.00 0.00 O ATOM 1076 CB THR A 65 -26.136 2.898 -23.156 1.00 0.00 C ATOM 1077 OG1 THR A 65 -27.264 3.153 -22.330 1.00 0.00 O ATOM 1078 CG2 THR A 65 -26.536 3.033 -24.626 1.00 0.00 C ATOM 0 H THR A 65 -26.068 1.802 -20.828 1.00 0.00 H new ATOM 0 HA THR A 65 -25.921 0.789 -23.680 1.00 0.00 H new ATOM 0 HB THR A 65 -25.349 3.617 -22.929 1.00 0.00 H new ATOM 0 HG1 THR A 65 -27.592 4.061 -22.496 1.00 0.00 H new ATOM 0 HG21 THR A 65 -26.901 4.043 -24.812 1.00 0.00 H new ATOM 0 HG22 THR A 65 -25.670 2.838 -25.258 1.00 0.00 H new ATOM 0 HG23 THR A 65 -27.323 2.315 -24.856 1.00 0.00 H new ATOM 1086 N PHE A 66 -23.523 2.044 -21.816 1.00 0.00 N ATOM 1087 CA PHE A 66 -22.036 2.064 -21.705 1.00 0.00 C ATOM 1088 C PHE A 66 -21.528 0.720 -21.173 1.00 0.00 C ATOM 1089 O PHE A 66 -20.644 0.111 -21.742 1.00 0.00 O ATOM 1090 CB PHE A 66 -21.728 3.183 -20.710 1.00 0.00 C ATOM 1091 CG PHE A 66 -20.592 4.027 -21.236 1.00 0.00 C ATOM 1092 CD1 PHE A 66 -19.266 3.630 -21.020 1.00 0.00 C ATOM 1093 CD2 PHE A 66 -20.864 5.209 -21.938 1.00 0.00 C ATOM 1094 CE1 PHE A 66 -18.211 4.414 -21.507 1.00 0.00 C ATOM 1095 CE2 PHE A 66 -19.809 5.993 -22.425 1.00 0.00 C ATOM 1096 CZ PHE A 66 -18.483 5.595 -22.210 1.00 0.00 C ATOM 0 H PHE A 66 -24.021 2.503 -21.053 1.00 0.00 H new ATOM 0 HA PHE A 66 -21.552 2.229 -22.668 1.00 0.00 H new ATOM 0 HB2 PHE A 66 -22.613 3.801 -20.556 1.00 0.00 H new ATOM 0 HB3 PHE A 66 -21.462 2.760 -19.741 1.00 0.00 H new ATOM 0 HD1 PHE A 66 -19.057 2.720 -20.478 1.00 0.00 H new ATOM 0 HD2 PHE A 66 -21.886 5.516 -22.104 1.00 0.00 H new ATOM 0 HE1 PHE A 66 -17.189 4.108 -21.340 1.00 0.00 H new ATOM 0 HE2 PHE A 66 -20.018 6.904 -22.966 1.00 0.00 H new ATOM 0 HZ PHE A 66 -17.670 6.199 -22.586 1.00 0.00 H new ATOM 1106 N GLY A 67 -22.082 0.254 -20.087 1.00 0.00 N ATOM 1107 CA GLY A 67 -21.631 -1.049 -19.521 1.00 0.00 C ATOM 1108 C GLY A 67 -20.968 -0.814 -18.163 1.00 0.00 C ATOM 1109 O GLY A 67 -20.148 -1.592 -17.718 1.00 0.00 O ATOM 0 H GLY A 67 -22.827 0.719 -19.568 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -22.480 -1.723 -19.411 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -20.929 -1.530 -20.202 1.00 0.00 H new ATOM 1113 N THR A 68 -21.318 0.254 -17.499 1.00 0.00 N ATOM 1114 CA THR A 68 -20.707 0.538 -16.168 1.00 0.00 C ATOM 1115 C THR A 68 -21.492 1.641 -15.453 1.00 0.00 C ATOM 1116 O THR A 68 -22.322 2.306 -16.040 1.00 0.00 O ATOM 1117 CB THR A 68 -19.285 1.008 -16.479 1.00 0.00 C ATOM 1118 OG1 THR A 68 -18.681 1.497 -15.290 1.00 0.00 O ATOM 1119 CG2 THR A 68 -19.329 2.120 -17.527 1.00 0.00 C ATOM 0 H THR A 68 -22.000 0.942 -17.820 1.00 0.00 H new ATOM 0 HA THR A 68 -20.715 -0.334 -15.514 1.00 0.00 H new ATOM 0 HB THR A 68 -18.702 0.172 -16.867 1.00 0.00 H new ATOM 0 HG1 THR A 68 -17.769 1.797 -15.486 1.00 0.00 H new ATOM 0 HG21 THR A 68 -18.315 2.453 -17.747 1.00 0.00 H new ATOM 0 HG22 THR A 68 -19.793 1.743 -18.439 1.00 0.00 H new ATOM 0 HG23 THR A 68 -19.911 2.958 -17.144 1.00 0.00 H new ATOM 1127 N CYS A 69 -21.235 1.840 -14.189 1.00 0.00 N ATOM 1128 CA CYS A 69 -21.966 2.901 -13.438 1.00 0.00 C ATOM 1129 C CYS A 69 -20.999 4.009 -13.014 1.00 0.00 C ATOM 1130 O CYS A 69 -20.225 3.840 -12.092 1.00 0.00 O ATOM 1131 CB CYS A 69 -22.543 2.193 -12.213 1.00 0.00 C ATOM 1132 SG CYS A 69 -21.206 1.394 -11.291 1.00 0.00 S ATOM 0 H CYS A 69 -20.551 1.315 -13.644 1.00 0.00 H new ATOM 0 HA CYS A 69 -22.744 3.372 -14.039 1.00 0.00 H new ATOM 0 HB2 CYS A 69 -23.060 2.910 -11.576 1.00 0.00 H new ATOM 0 HB3 CYS A 69 -23.280 1.451 -12.522 1.00 0.00 H new ATOM 1137 N PRO A 70 -21.078 5.111 -13.708 1.00 0.00 N ATOM 1138 CA PRO A 70 -20.198 6.267 -13.406 1.00 0.00 C ATOM 1139 C PRO A 70 -20.643 6.954 -12.111 1.00 0.00 C ATOM 1140 O PRO A 70 -21.677 6.631 -11.560 1.00 0.00 O ATOM 1141 CB PRO A 70 -20.396 7.190 -14.606 1.00 0.00 C ATOM 1142 CG PRO A 70 -21.744 6.836 -15.148 1.00 0.00 C ATOM 1143 CD PRO A 70 -21.985 5.383 -14.828 1.00 0.00 C ATOM 0 HA PRO A 70 -19.156 5.985 -13.258 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -20.353 8.238 -14.309 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -19.618 7.038 -15.354 1.00 0.00 H new ATOM 0 HG2 PRO A 70 -22.516 7.462 -14.700 1.00 0.00 H new ATOM 0 HG3 PRO A 70 -21.782 7.005 -16.224 1.00 0.00 H new ATOM 0 HD2 PRO A 70 -23.024 5.202 -14.553 1.00 0.00 H new ATOM 0 HD3 PRO A 70 -21.766 4.744 -15.683 1.00 0.00 H new ATOM 1151 N PRO A 71 -19.839 7.882 -11.669 1.00 0.00 N ATOM 1152 CA PRO A 71 -20.146 8.629 -10.425 1.00 0.00 C ATOM 1153 C PRO A 71 -21.294 9.614 -10.663 1.00 0.00 C ATOM 1154 O PRO A 71 -21.947 9.584 -11.688 1.00 0.00 O ATOM 1155 CB PRO A 71 -18.846 9.370 -10.125 1.00 0.00 C ATOM 1156 CG PRO A 71 -18.159 9.501 -11.446 1.00 0.00 C ATOM 1157 CD PRO A 71 -18.580 8.319 -12.282 1.00 0.00 C ATOM 0 HA PRO A 71 -20.464 7.986 -9.604 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -19.042 10.347 -9.684 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -18.232 8.817 -9.414 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -18.436 10.436 -11.933 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -17.077 9.517 -11.318 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -18.720 8.598 -13.326 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -17.830 7.528 -12.261 1.00 0.00 H new ATOM 1165 N ILE A 72 -21.546 10.486 -9.725 1.00 0.00 N ATOM 1166 CA ILE A 72 -22.651 11.470 -9.902 1.00 0.00 C ATOM 1167 C ILE A 72 -22.095 12.806 -10.400 1.00 0.00 C ATOM 1168 O ILE A 72 -22.184 13.816 -9.730 1.00 0.00 O ATOM 1169 CB ILE A 72 -23.266 11.631 -8.512 1.00 0.00 C ATOM 1170 CG1 ILE A 72 -23.838 10.289 -8.050 1.00 0.00 C ATOM 1171 CG2 ILE A 72 -24.389 12.669 -8.567 1.00 0.00 C ATOM 1172 CD1 ILE A 72 -24.895 9.812 -9.046 1.00 0.00 C ATOM 0 H ILE A 72 -21.035 10.559 -8.845 1.00 0.00 H new ATOM 0 HA ILE A 72 -23.385 11.138 -10.636 1.00 0.00 H new ATOM 0 HB ILE A 72 -22.499 11.962 -7.812 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -23.040 9.551 -7.969 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -24.278 10.392 -7.058 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -24.827 12.784 -7.576 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -23.984 13.626 -8.898 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -25.156 12.338 -9.267 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -25.301 8.856 -8.715 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -25.698 10.547 -9.104 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -24.441 9.692 -10.029 1.00 0.00 H new ATOM 1184 N LYS A 73 -21.523 12.821 -11.573 1.00 0.00 N ATOM 1185 CA LYS A 73 -20.961 14.091 -12.113 1.00 0.00 C ATOM 1186 C LYS A 73 -21.847 14.622 -13.243 1.00 0.00 C ATOM 1187 O LYS A 73 -22.420 15.688 -13.148 1.00 0.00 O ATOM 1188 CB LYS A 73 -19.578 13.718 -12.647 1.00 0.00 C ATOM 1189 CG LYS A 73 -18.758 14.990 -12.878 1.00 0.00 C ATOM 1190 CD LYS A 73 -18.691 15.288 -14.376 1.00 0.00 C ATOM 1191 CE LYS A 73 -17.785 16.499 -14.616 1.00 0.00 C ATOM 1192 NZ LYS A 73 -16.401 15.995 -14.386 1.00 0.00 N ATOM 0 H LYS A 73 -21.421 12.008 -12.181 1.00 0.00 H new ATOM 0 HA LYS A 73 -20.908 14.873 -11.356 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -19.067 13.067 -11.938 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -19.675 13.161 -13.579 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -19.211 15.829 -12.349 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -17.753 14.865 -12.476 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -18.307 14.421 -14.913 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -19.690 15.486 -14.763 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -17.902 16.885 -15.629 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -18.027 17.314 -13.934 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -15.799 16.252 -15.195 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -16.016 16.421 -13.519 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -16.421 14.960 -14.284 1.00 0.00 H new ATOM 1206 N MET A 74 -21.963 13.884 -14.313 1.00 0.00 N ATOM 1207 CA MET A 74 -22.813 14.345 -15.448 1.00 0.00 C ATOM 1208 C MET A 74 -24.295 14.182 -15.098 1.00 0.00 C ATOM 1209 O MET A 74 -25.156 14.795 -15.698 1.00 0.00 O ATOM 1210 CB MET A 74 -22.436 13.436 -16.619 1.00 0.00 C ATOM 1211 CG MET A 74 -21.095 13.885 -17.203 1.00 0.00 C ATOM 1212 SD MET A 74 -20.388 12.542 -18.190 1.00 0.00 S ATOM 1213 CE MET A 74 -19.237 11.922 -16.938 1.00 0.00 C ATOM 0 H MET A 74 -21.506 12.982 -14.451 1.00 0.00 H new ATOM 0 HA MET A 74 -22.655 15.398 -15.682 1.00 0.00 H new ATOM 0 HB2 MET A 74 -22.370 12.401 -16.283 1.00 0.00 H new ATOM 0 HB3 MET A 74 -23.210 13.474 -17.386 1.00 0.00 H new ATOM 0 HG2 MET A 74 -21.234 14.771 -17.822 1.00 0.00 H new ATOM 0 HG3 MET A 74 -20.411 14.161 -16.401 1.00 0.00 H new ATOM 0 HE1 MET A 74 -18.684 11.074 -17.341 1.00 0.00 H new ATOM 0 HE2 MET A 74 -18.539 12.712 -16.662 1.00 0.00 H new ATOM 0 HE3 MET A 74 -19.794 11.606 -16.056 1.00 0.00 H new ATOM 1223 N VAL A 75 -24.599 13.361 -14.130 1.00 0.00 N ATOM 1224 CA VAL A 75 -26.024 13.160 -13.742 1.00 0.00 C ATOM 1225 C VAL A 75 -26.543 14.383 -12.980 1.00 0.00 C ATOM 1226 O VAL A 75 -27.714 14.706 -13.031 1.00 0.00 O ATOM 1227 CB VAL A 75 -26.017 11.930 -12.834 1.00 0.00 C ATOM 1228 CG1 VAL A 75 -27.447 11.417 -12.657 1.00 0.00 C ATOM 1229 CG2 VAL A 75 -25.159 10.834 -13.471 1.00 0.00 C ATOM 0 H VAL A 75 -23.922 12.821 -13.591 1.00 0.00 H new ATOM 0 HA VAL A 75 -26.672 13.026 -14.608 1.00 0.00 H new ATOM 0 HB VAL A 75 -25.605 12.199 -11.861 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -27.441 10.540 -12.010 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -28.060 12.197 -12.206 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -27.860 11.148 -13.629 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -25.152 9.956 -12.825 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -25.573 10.567 -14.443 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -24.140 11.198 -13.599 1.00 0.00 H new ATOM 1239 N THR A 76 -25.682 15.064 -12.276 1.00 0.00 N ATOM 1240 CA THR A 76 -26.127 16.265 -11.511 1.00 0.00 C ATOM 1241 C THR A 76 -26.732 17.303 -12.459 1.00 0.00 C ATOM 1242 O THR A 76 -27.683 17.982 -12.126 1.00 0.00 O ATOM 1243 CB THR A 76 -24.856 16.811 -10.857 1.00 0.00 C ATOM 1244 OG1 THR A 76 -24.335 15.842 -9.958 1.00 0.00 O ATOM 1245 CG2 THR A 76 -25.183 18.095 -10.095 1.00 0.00 C ATOM 0 H THR A 76 -24.690 14.842 -12.197 1.00 0.00 H new ATOM 0 HA THR A 76 -26.894 16.025 -10.774 1.00 0.00 H new ATOM 0 HB THR A 76 -24.115 17.028 -11.626 1.00 0.00 H new ATOM 0 HG1 THR A 76 -23.566 15.394 -10.369 1.00 0.00 H new ATOM 0 HG21 THR A 76 -24.277 18.483 -9.630 1.00 0.00 H new ATOM 0 HG22 THR A 76 -25.582 18.837 -10.787 1.00 0.00 H new ATOM 0 HG23 THR A 76 -25.924 17.882 -9.324 1.00 0.00 H new ATOM 1253 N LYS A 77 -26.186 17.434 -13.638 1.00 0.00 N ATOM 1254 CA LYS A 77 -26.730 18.431 -14.605 1.00 0.00 C ATOM 1255 C LYS A 77 -28.018 17.904 -15.246 1.00 0.00 C ATOM 1256 O LYS A 77 -28.880 18.662 -15.642 1.00 0.00 O ATOM 1257 CB LYS A 77 -25.635 18.595 -15.661 1.00 0.00 C ATOM 1258 CG LYS A 77 -25.673 20.019 -16.218 1.00 0.00 C ATOM 1259 CD LYS A 77 -25.132 20.022 -17.649 1.00 0.00 C ATOM 1260 CE LYS A 77 -26.272 19.731 -18.628 1.00 0.00 C ATOM 1261 NZ LYS A 77 -26.499 21.015 -19.347 1.00 0.00 N ATOM 0 H LYS A 77 -25.388 16.895 -13.973 1.00 0.00 H new ATOM 0 HA LYS A 77 -26.980 19.377 -14.124 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -24.658 18.391 -15.222 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -25.780 17.874 -16.466 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -26.694 20.399 -16.203 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -25.077 20.682 -15.591 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -24.681 20.988 -17.876 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -24.348 19.272 -17.754 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -26.004 18.933 -19.320 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -27.171 19.408 -18.103 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -27.268 20.895 -20.037 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -26.759 21.754 -18.663 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -25.629 21.294 -19.843 1.00 0.00 H new ATOM 1275 N GLU A 78 -28.153 16.610 -15.352 1.00 0.00 N ATOM 1276 CA GLU A 78 -29.385 16.037 -15.969 1.00 0.00 C ATOM 1277 C GLU A 78 -30.526 16.008 -14.949 1.00 0.00 C ATOM 1278 O GLU A 78 -31.430 16.819 -14.991 1.00 0.00 O ATOM 1279 CB GLU A 78 -28.997 14.617 -16.382 1.00 0.00 C ATOM 1280 CG GLU A 78 -29.307 14.415 -17.867 1.00 0.00 C ATOM 1281 CD GLU A 78 -28.003 14.412 -18.666 1.00 0.00 C ATOM 1282 OE1 GLU A 78 -27.416 15.473 -18.807 1.00 0.00 O ATOM 1283 OE2 GLU A 78 -27.614 13.351 -19.123 1.00 0.00 O ATOM 0 H GLU A 78 -27.465 15.925 -15.039 1.00 0.00 H new ATOM 0 HA GLU A 78 -29.734 16.627 -16.816 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -27.936 14.449 -16.195 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -29.545 13.890 -15.783 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -29.838 13.474 -18.014 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -29.962 15.210 -18.224 1.00 0.00 H new ATOM 1290 N THR A 79 -30.493 15.080 -14.031 1.00 0.00 N ATOM 1291 CA THR A 79 -31.577 15.002 -13.011 1.00 0.00 C ATOM 1292 C THR A 79 -31.524 16.221 -12.086 1.00 0.00 C ATOM 1293 O THR A 79 -32.512 16.894 -11.873 1.00 0.00 O ATOM 1294 CB THR A 79 -31.292 13.720 -12.226 1.00 0.00 C ATOM 1295 OG1 THR A 79 -29.984 13.786 -11.676 1.00 0.00 O ATOM 1296 CG2 THR A 79 -31.395 12.513 -13.159 1.00 0.00 C ATOM 0 H THR A 79 -29.763 14.373 -13.944 1.00 0.00 H new ATOM 0 HA THR A 79 -32.569 14.991 -13.464 1.00 0.00 H new ATOM 0 HB THR A 79 -32.021 13.616 -11.422 1.00 0.00 H new ATOM 0 HG1 THR A 79 -29.800 12.966 -11.171 1.00 0.00 H new ATOM 0 HG21 THR A 79 -31.192 11.601 -12.598 1.00 0.00 H new ATOM 0 HG22 THR A 79 -32.399 12.464 -13.580 1.00 0.00 H new ATOM 0 HG23 THR A 79 -30.668 12.613 -13.965 1.00 0.00 H new ATOM 1304 N GLY A 80 -30.376 16.509 -11.535 1.00 0.00 N ATOM 1305 CA GLY A 80 -30.262 17.682 -10.624 1.00 0.00 C ATOM 1306 C GLY A 80 -30.134 17.198 -9.179 1.00 0.00 C ATOM 1307 O GLY A 80 -30.192 17.975 -8.246 1.00 0.00 O ATOM 0 H GLY A 80 -29.514 15.983 -11.676 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -29.394 18.283 -10.895 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -31.138 18.322 -10.728 1.00 0.00 H new ATOM 1311 N PHE A 81 -29.961 15.920 -8.985 1.00 0.00 N ATOM 1312 CA PHE A 81 -29.829 15.386 -7.598 1.00 0.00 C ATOM 1313 C PHE A 81 -28.529 15.886 -6.962 1.00 0.00 C ATOM 1314 O PHE A 81 -27.448 15.464 -7.322 1.00 0.00 O ATOM 1315 CB PHE A 81 -29.797 13.866 -7.760 1.00 0.00 C ATOM 1316 CG PHE A 81 -31.183 13.306 -7.540 1.00 0.00 C ATOM 1317 CD1 PHE A 81 -32.255 13.765 -8.316 1.00 0.00 C ATOM 1318 CD2 PHE A 81 -31.394 12.327 -6.560 1.00 0.00 C ATOM 1319 CE1 PHE A 81 -33.540 13.244 -8.112 1.00 0.00 C ATOM 1320 CE2 PHE A 81 -32.679 11.806 -6.357 1.00 0.00 C ATOM 1321 CZ PHE A 81 -33.753 12.265 -7.132 1.00 0.00 C ATOM 0 H PHE A 81 -29.905 15.221 -9.726 1.00 0.00 H new ATOM 0 HA PHE A 81 -30.644 15.709 -6.951 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -29.441 13.603 -8.756 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -29.099 13.428 -7.046 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -32.091 14.520 -9.071 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -30.567 11.974 -5.962 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -34.367 13.597 -8.710 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -32.842 11.050 -5.603 1.00 0.00 H new ATOM 0 HZ PHE A 81 -34.744 11.865 -6.974 1.00 0.00 H new ATOM 1331 N SER A 82 -28.627 16.783 -6.019 1.00 0.00 N ATOM 1332 CA SER A 82 -27.396 17.309 -5.360 1.00 0.00 C ATOM 1333 C SER A 82 -26.575 16.157 -4.774 1.00 0.00 C ATOM 1334 O SER A 82 -27.112 15.227 -4.207 1.00 0.00 O ATOM 1335 CB SER A 82 -27.904 18.225 -4.249 1.00 0.00 C ATOM 1336 OG SER A 82 -27.281 19.498 -4.367 1.00 0.00 O ATOM 0 H SER A 82 -29.504 17.174 -5.676 1.00 0.00 H new ATOM 0 HA SER A 82 -26.747 17.837 -6.059 1.00 0.00 H new ATOM 0 HB2 SER A 82 -28.987 18.330 -4.315 1.00 0.00 H new ATOM 0 HB3 SER A 82 -27.685 17.789 -3.274 1.00 0.00 H new ATOM 0 HG SER A 82 -27.607 20.089 -3.656 1.00 0.00 H new ATOM 1342 N LEU A 83 -25.278 16.214 -4.904 1.00 0.00 N ATOM 1343 CA LEU A 83 -24.425 15.122 -4.352 1.00 0.00 C ATOM 1344 C LEU A 83 -24.627 15.010 -2.839 1.00 0.00 C ATOM 1345 O LEU A 83 -24.466 13.955 -2.258 1.00 0.00 O ATOM 1346 CB LEU A 83 -22.990 15.540 -4.674 1.00 0.00 C ATOM 1347 CG LEU A 83 -22.038 14.389 -4.347 1.00 0.00 C ATOM 1348 CD1 LEU A 83 -21.619 13.689 -5.641 1.00 0.00 C ATOM 1349 CD2 LEU A 83 -20.796 14.942 -3.642 1.00 0.00 C ATOM 0 H LEU A 83 -24.772 16.968 -5.368 1.00 0.00 H new ATOM 0 HA LEU A 83 -24.670 14.149 -4.778 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -22.906 15.808 -5.727 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -22.720 16.425 -4.098 1.00 0.00 H new ATOM 0 HG LEU A 83 -22.541 13.675 -3.695 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -20.940 12.869 -5.408 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -22.502 13.297 -6.145 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -21.115 14.402 -6.294 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -20.116 14.123 -3.408 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -20.294 15.655 -4.296 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -21.093 15.442 -2.720 1.00 0.00 H new ATOM 1361 N GLU A 84 -24.978 16.090 -2.196 1.00 0.00 N ATOM 1362 CA GLU A 84 -25.190 16.045 -0.721 1.00 0.00 C ATOM 1363 C GLU A 84 -26.367 15.125 -0.385 1.00 0.00 C ATOM 1364 O GLU A 84 -26.270 14.261 0.463 1.00 0.00 O ATOM 1365 CB GLU A 84 -25.503 17.487 -0.321 1.00 0.00 C ATOM 1366 CG GLU A 84 -24.462 17.975 0.688 1.00 0.00 C ATOM 1367 CD GLU A 84 -23.118 18.169 -0.019 1.00 0.00 C ATOM 1368 OE1 GLU A 84 -22.590 17.192 -0.521 1.00 0.00 O ATOM 1369 OE2 GLU A 84 -22.643 19.292 -0.045 1.00 0.00 O ATOM 0 H GLU A 84 -25.127 17.002 -2.628 1.00 0.00 H new ATOM 0 HA GLU A 84 -24.321 15.656 -0.190 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -25.500 18.129 -1.202 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -26.501 17.547 0.113 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -24.787 18.913 1.137 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -24.358 17.253 1.498 1.00 0.00 H new ATOM 1376 N LYS A 85 -27.479 15.303 -1.046 1.00 0.00 N ATOM 1377 CA LYS A 85 -28.660 14.437 -0.763 1.00 0.00 C ATOM 1378 C LYS A 85 -28.258 12.962 -0.825 1.00 0.00 C ATOM 1379 O LYS A 85 -28.461 12.213 0.111 1.00 0.00 O ATOM 1380 CB LYS A 85 -29.665 14.767 -1.867 1.00 0.00 C ATOM 1381 CG LYS A 85 -30.760 13.700 -1.896 1.00 0.00 C ATOM 1382 CD LYS A 85 -32.127 14.373 -2.034 1.00 0.00 C ATOM 1383 CE LYS A 85 -32.188 15.138 -3.358 1.00 0.00 C ATOM 1384 NZ LYS A 85 -33.098 16.287 -3.096 1.00 0.00 N ATOM 0 H LYS A 85 -27.621 16.009 -1.768 1.00 0.00 H new ATOM 0 HA LYS A 85 -29.074 14.612 0.230 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -30.104 15.749 -1.692 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -29.160 14.811 -2.832 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -30.594 13.016 -2.729 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -30.727 13.105 -0.983 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -32.918 13.624 -1.998 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -32.295 15.054 -1.200 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -31.199 15.479 -3.663 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -32.569 14.507 -4.161 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -33.191 16.860 -3.959 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -34.034 15.931 -2.814 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -32.706 16.873 -2.332 1.00 0.00 H new ATOM 1398 N ILE A 86 -27.689 12.538 -1.920 1.00 0.00 N ATOM 1399 CA ILE A 86 -27.274 11.111 -2.039 1.00 0.00 C ATOM 1400 C ILE A 86 -26.357 10.729 -0.874 1.00 0.00 C ATOM 1401 O ILE A 86 -26.441 9.644 -0.334 1.00 0.00 O ATOM 1402 CB ILE A 86 -26.518 11.026 -3.365 1.00 0.00 C ATOM 1403 CG1 ILE A 86 -27.514 11.108 -4.525 1.00 0.00 C ATOM 1404 CG2 ILE A 86 -25.761 9.700 -3.438 1.00 0.00 C ATOM 1405 CD1 ILE A 86 -27.005 12.104 -5.567 1.00 0.00 C ATOM 0 H ILE A 86 -27.494 13.117 -2.737 1.00 0.00 H new ATOM 0 HA ILE A 86 -28.125 10.430 -2.011 1.00 0.00 H new ATOM 0 HB ILE A 86 -25.810 11.852 -3.433 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -27.642 10.125 -4.978 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -28.492 11.419 -4.157 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -25.222 9.640 -4.384 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -25.052 9.640 -2.612 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -26.468 8.873 -3.370 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -27.715 12.162 -6.392 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -26.900 13.088 -5.109 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -26.037 11.774 -5.943 1.00 0.00 H new ATOM 1417 N TYR A 87 -25.482 11.613 -0.481 1.00 0.00 N ATOM 1418 CA TYR A 87 -24.561 11.302 0.649 1.00 0.00 C ATOM 1419 C TYR A 87 -25.363 11.012 1.921 1.00 0.00 C ATOM 1420 O TYR A 87 -25.005 10.163 2.713 1.00 0.00 O ATOM 1421 CB TYR A 87 -23.712 12.560 0.826 1.00 0.00 C ATOM 1422 CG TYR A 87 -22.400 12.389 0.101 1.00 0.00 C ATOM 1423 CD1 TYR A 87 -22.386 12.205 -1.289 1.00 0.00 C ATOM 1424 CD2 TYR A 87 -21.195 12.412 0.816 1.00 0.00 C ATOM 1425 CE1 TYR A 87 -21.168 12.046 -1.962 1.00 0.00 C ATOM 1426 CE2 TYR A 87 -19.977 12.253 0.143 1.00 0.00 C ATOM 1427 CZ TYR A 87 -19.963 12.069 -1.247 1.00 0.00 C ATOM 1428 OH TYR A 87 -18.764 11.913 -1.911 1.00 0.00 O ATOM 0 H TYR A 87 -25.365 12.538 -0.894 1.00 0.00 H new ATOM 0 HA TYR A 87 -23.949 10.422 0.452 1.00 0.00 H new ATOM 0 HB2 TYR A 87 -24.244 13.428 0.437 1.00 0.00 H new ATOM 0 HB3 TYR A 87 -23.533 12.744 1.885 1.00 0.00 H new ATOM 0 HD1 TYR A 87 -23.314 12.186 -1.841 1.00 0.00 H new ATOM 0 HD2 TYR A 87 -21.206 12.552 1.887 1.00 0.00 H new ATOM 0 HE1 TYR A 87 -21.157 11.906 -3.033 1.00 0.00 H new ATOM 0 HE2 TYR A 87 -19.049 12.272 0.695 1.00 0.00 H new ATOM 0 HH TYR A 87 -18.026 11.955 -1.268 1.00 0.00 H new ATOM 1438 N GLN A 88 -26.445 11.713 2.123 1.00 0.00 N ATOM 1439 CA GLN A 88 -27.269 11.479 3.343 1.00 0.00 C ATOM 1440 C GLN A 88 -28.074 10.184 3.197 1.00 0.00 C ATOM 1441 O GLN A 88 -28.411 9.539 4.169 1.00 0.00 O ATOM 1442 CB GLN A 88 -28.204 12.685 3.426 1.00 0.00 C ATOM 1443 CG GLN A 88 -28.415 13.067 4.893 1.00 0.00 C ATOM 1444 CD GLN A 88 -28.693 14.568 4.995 1.00 0.00 C ATOM 1445 OE1 GLN A 88 -27.970 15.287 5.656 1.00 0.00 O ATOM 1446 NE2 GLN A 88 -29.717 15.073 4.364 1.00 0.00 N ATOM 0 H GLN A 88 -26.794 12.438 1.496 1.00 0.00 H new ATOM 0 HA GLN A 88 -26.659 11.374 4.240 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -27.780 13.526 2.878 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -29.160 12.450 2.959 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -29.249 12.503 5.310 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -27.532 12.809 5.477 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -30.323 14.468 3.809 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -29.911 16.072 4.425 1.00 0.00 H new ATOM 1455 N LEU A 89 -28.385 9.800 1.989 1.00 0.00 N ATOM 1456 CA LEU A 89 -29.168 8.547 1.784 1.00 0.00 C ATOM 1457 C LEU A 89 -28.225 7.360 1.574 1.00 0.00 C ATOM 1458 O LEU A 89 -28.651 6.225 1.485 1.00 0.00 O ATOM 1459 CB LEU A 89 -29.998 8.804 0.526 1.00 0.00 C ATOM 1460 CG LEU A 89 -31.305 9.499 0.911 1.00 0.00 C ATOM 1461 CD1 LEU A 89 -31.986 10.040 -0.348 1.00 0.00 C ATOM 1462 CD2 LEU A 89 -32.232 8.495 1.599 1.00 0.00 C ATOM 0 H LEU A 89 -28.131 10.298 1.136 1.00 0.00 H new ATOM 0 HA LEU A 89 -29.793 8.304 2.643 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -29.436 9.424 -0.173 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -30.210 7.863 0.018 1.00 0.00 H new ATOM 0 HG LEU A 89 -31.091 10.323 1.591 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -32.917 10.535 -0.074 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -31.326 10.755 -0.840 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -32.200 9.216 -1.029 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -33.164 8.989 1.874 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -32.445 7.671 0.918 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -31.748 8.108 2.496 1.00 0.00 H new ATOM 1474 N PHE A 90 -26.947 7.611 1.495 1.00 0.00 N ATOM 1475 CA PHE A 90 -25.979 6.496 1.291 1.00 0.00 C ATOM 1476 C PHE A 90 -24.592 6.900 1.800 1.00 0.00 C ATOM 1477 O PHE A 90 -23.859 7.592 1.123 1.00 0.00 O ATOM 1478 CB PHE A 90 -25.948 6.271 -0.221 1.00 0.00 C ATOM 1479 CG PHE A 90 -26.129 4.802 -0.517 1.00 0.00 C ATOM 1480 CD1 PHE A 90 -27.418 4.261 -0.619 1.00 0.00 C ATOM 1481 CD2 PHE A 90 -25.008 3.978 -0.687 1.00 0.00 C ATOM 1482 CE1 PHE A 90 -27.585 2.897 -0.892 1.00 0.00 C ATOM 1483 CE2 PHE A 90 -25.176 2.614 -0.960 1.00 0.00 C ATOM 1484 CZ PHE A 90 -26.464 2.074 -1.063 1.00 0.00 C ATOM 0 H PHE A 90 -26.531 8.540 1.563 1.00 0.00 H new ATOM 0 HA PHE A 90 -26.267 5.595 1.833 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -26.737 6.849 -0.701 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -25.001 6.621 -0.632 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -28.282 4.895 -0.487 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -24.015 4.394 -0.608 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -28.578 2.480 -0.971 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -24.312 1.979 -1.091 1.00 0.00 H new ATOM 0 HZ PHE A 90 -26.593 1.023 -1.274 1.00 0.00 H new ATOM 1494 N PRO A 91 -24.281 6.449 2.985 1.00 0.00 N ATOM 1495 CA PRO A 91 -22.968 6.765 3.599 1.00 0.00 C ATOM 1496 C PRO A 91 -21.852 5.970 2.915 1.00 0.00 C ATOM 1497 O PRO A 91 -20.687 6.293 3.029 1.00 0.00 O ATOM 1498 CB PRO A 91 -23.138 6.323 5.050 1.00 0.00 C ATOM 1499 CG PRO A 91 -24.211 5.282 5.017 1.00 0.00 C ATOM 1500 CD PRO A 91 -25.113 5.610 3.855 1.00 0.00 C ATOM 0 HA PRO A 91 -22.693 7.816 3.506 1.00 0.00 H new ATOM 0 HB2 PRO A 91 -22.208 5.918 5.450 1.00 0.00 H new ATOM 0 HB3 PRO A 91 -23.421 7.161 5.687 1.00 0.00 H new ATOM 0 HG2 PRO A 91 -23.779 4.288 4.901 1.00 0.00 H new ATOM 0 HG3 PRO A 91 -24.773 5.278 5.951 1.00 0.00 H new ATOM 0 HD2 PRO A 91 -25.445 4.708 3.341 1.00 0.00 H new ATOM 0 HD3 PRO A 91 -26.008 6.139 4.182 1.00 0.00 H new ATOM 1508 N SER A 92 -22.201 4.933 2.203 1.00 0.00 N ATOM 1509 CA SER A 92 -21.160 4.118 1.513 1.00 0.00 C ATOM 1510 C SER A 92 -20.505 4.933 0.394 1.00 0.00 C ATOM 1511 O SER A 92 -19.351 4.739 0.065 1.00 0.00 O ATOM 1512 CB SER A 92 -21.914 2.923 0.933 1.00 0.00 C ATOM 1513 OG SER A 92 -22.406 2.117 1.996 1.00 0.00 O ATOM 0 H SER A 92 -23.161 4.615 2.069 1.00 0.00 H new ATOM 0 HA SER A 92 -20.363 3.809 2.189 1.00 0.00 H new ATOM 0 HB2 SER A 92 -22.740 3.267 0.310 1.00 0.00 H new ATOM 0 HB3 SER A 92 -21.254 2.338 0.293 1.00 0.00 H new ATOM 0 HG SER A 92 -22.892 1.350 1.627 1.00 0.00 H new ATOM 1519 N GLY A 93 -21.232 5.843 -0.194 1.00 0.00 N ATOM 1520 CA GLY A 93 -20.651 6.668 -1.291 1.00 0.00 C ATOM 1521 C GLY A 93 -21.426 6.415 -2.585 1.00 0.00 C ATOM 1522 O GLY A 93 -21.915 5.326 -2.813 1.00 0.00 O ATOM 0 H GLY A 93 -22.203 6.051 0.038 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -20.696 7.725 -1.028 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -19.599 6.419 -1.430 1.00 0.00 H new ATOM 1526 N PRO A 94 -21.511 7.437 -3.391 1.00 0.00 N ATOM 1527 CA PRO A 94 -22.234 7.331 -4.682 1.00 0.00 C ATOM 1528 C PRO A 94 -21.424 6.504 -5.683 1.00 0.00 C ATOM 1529 O PRO A 94 -21.849 6.269 -6.797 1.00 0.00 O ATOM 1530 CB PRO A 94 -22.354 8.781 -5.145 1.00 0.00 C ATOM 1531 CG PRO A 94 -21.224 9.496 -4.474 1.00 0.00 C ATOM 1532 CD PRO A 94 -20.947 8.774 -3.180 1.00 0.00 C ATOM 0 HA PRO A 94 -23.201 6.836 -4.592 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -22.280 8.856 -6.230 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -23.316 9.208 -4.861 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -20.339 9.499 -5.110 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -21.485 10.537 -4.286 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -19.878 8.728 -2.970 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -21.417 9.276 -2.334 1.00 0.00 H new ATOM 1540 N ALA A 95 -20.258 6.063 -5.297 1.00 0.00 N ATOM 1541 CA ALA A 95 -19.421 5.253 -6.227 1.00 0.00 C ATOM 1542 C ALA A 95 -19.913 3.803 -6.256 1.00 0.00 C ATOM 1543 O ALA A 95 -20.712 3.425 -7.090 1.00 0.00 O ATOM 1544 CB ALA A 95 -18.006 5.328 -5.655 1.00 0.00 C ATOM 0 H ALA A 95 -19.849 6.229 -4.378 1.00 0.00 H new ATOM 0 HA ALA A 95 -19.466 5.623 -7.251 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -17.328 4.754 -6.286 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -17.681 6.368 -5.624 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -17.999 4.916 -4.646 1.00 0.00 H new ATOM 1550 N HIS A 96 -19.440 2.987 -5.354 1.00 0.00 N ATOM 1551 CA HIS A 96 -19.880 1.562 -5.332 1.00 0.00 C ATOM 1552 C HIS A 96 -21.310 1.454 -4.794 1.00 0.00 C ATOM 1553 O HIS A 96 -21.900 0.393 -4.782 1.00 0.00 O ATOM 1554 CB HIS A 96 -18.899 0.860 -4.392 1.00 0.00 C ATOM 1555 CG HIS A 96 -17.625 0.557 -5.131 1.00 0.00 C ATOM 1556 ND1 HIS A 96 -16.385 0.594 -4.513 1.00 0.00 N ATOM 1557 CD2 HIS A 96 -17.381 0.212 -6.437 1.00 0.00 C ATOM 1558 CE1 HIS A 96 -15.460 0.280 -5.439 1.00 0.00 C ATOM 1559 NE2 HIS A 96 -16.015 0.037 -6.629 1.00 0.00 N ATOM 0 H HIS A 96 -18.768 3.245 -4.631 1.00 0.00 H new ATOM 0 HA HIS A 96 -19.883 1.117 -6.327 1.00 0.00 H new ATOM 0 HB2 HIS A 96 -18.690 1.493 -3.529 1.00 0.00 H new ATOM 0 HB3 HIS A 96 -19.339 -0.062 -4.012 1.00 0.00 H new ATOM 0 HD2 HIS A 96 -18.136 0.094 -7.200 1.00 0.00 H new ATOM 0 HE1 HIS A 96 -14.399 0.231 -5.244 1.00 0.00 H new ATOM 0 HE2 HIS A 96 -15.539 -0.222 -7.493 1.00 0.00 H new ATOM 1567 N GLY A 97 -21.869 2.546 -4.349 1.00 0.00 N ATOM 1568 CA GLY A 97 -23.260 2.504 -3.812 1.00 0.00 C ATOM 1569 C GLY A 97 -24.232 2.144 -4.937 1.00 0.00 C ATOM 1570 O GLY A 97 -24.457 0.986 -5.229 1.00 0.00 O ATOM 0 H GLY A 97 -21.424 3.464 -4.334 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -23.329 1.770 -3.009 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -23.525 3.471 -3.384 1.00 0.00 H new ATOM 1574 N ALA A 98 -24.812 3.127 -5.570 1.00 0.00 N ATOM 1575 CA ALA A 98 -25.772 2.841 -6.675 1.00 0.00 C ATOM 1576 C ALA A 98 -25.232 1.722 -7.571 1.00 0.00 C ATOM 1577 O ALA A 98 -25.981 1.000 -8.198 1.00 0.00 O ATOM 1578 CB ALA A 98 -25.877 4.150 -7.457 1.00 0.00 C ATOM 0 H ALA A 98 -24.663 4.116 -5.370 1.00 0.00 H new ATOM 0 HA ALA A 98 -26.741 2.509 -6.303 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -26.568 4.022 -8.290 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -26.244 4.938 -6.800 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -24.894 4.425 -7.840 1.00 0.00 H new ATOM 1584 N CYS A 99 -23.937 1.575 -7.637 1.00 0.00 N ATOM 1585 CA CYS A 99 -23.351 0.504 -8.494 1.00 0.00 C ATOM 1586 C CYS A 99 -23.731 -0.877 -7.950 1.00 0.00 C ATOM 1587 O CYS A 99 -24.633 -1.522 -8.445 1.00 0.00 O ATOM 1588 CB CYS A 99 -21.840 0.715 -8.413 1.00 0.00 C ATOM 1589 SG CYS A 99 -21.374 2.143 -9.423 1.00 0.00 S ATOM 0 H CYS A 99 -23.260 2.149 -7.135 1.00 0.00 H new ATOM 0 HA CYS A 99 -23.715 0.551 -9.520 1.00 0.00 H new ATOM 0 HB2 CYS A 99 -21.540 0.875 -7.378 1.00 0.00 H new ATOM 0 HB3 CYS A 99 -21.319 -0.176 -8.762 1.00 0.00 H new ATOM 1594 N LYS A 100 -23.048 -1.332 -6.936 1.00 0.00 N ATOM 1595 CA LYS A 100 -23.368 -2.671 -6.362 1.00 0.00 C ATOM 1596 C LYS A 100 -24.884 -2.852 -6.250 1.00 0.00 C ATOM 1597 O LYS A 100 -25.414 -3.912 -6.516 1.00 0.00 O ATOM 1598 CB LYS A 100 -22.726 -2.669 -4.974 1.00 0.00 C ATOM 1599 CG LYS A 100 -22.425 -4.108 -4.548 1.00 0.00 C ATOM 1600 CD LYS A 100 -21.309 -4.108 -3.501 1.00 0.00 C ATOM 1601 CE LYS A 100 -19.984 -4.486 -4.166 1.00 0.00 C ATOM 1602 NZ LYS A 100 -18.995 -3.508 -3.635 1.00 0.00 N ATOM 0 H LYS A 100 -22.283 -0.836 -6.480 1.00 0.00 H new ATOM 0 HA LYS A 100 -22.997 -3.486 -6.984 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -21.807 -2.083 -4.988 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -23.394 -2.197 -4.253 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -23.322 -4.572 -4.139 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -22.126 -4.700 -5.413 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -21.229 -3.124 -3.040 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -21.543 -4.815 -2.705 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -19.698 -5.509 -3.922 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -20.056 -4.425 -5.252 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -18.035 -3.892 -3.744 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -19.073 -2.615 -4.162 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -19.186 -3.333 -2.628 1.00 0.00 H new ATOM 1616 N VAL A 101 -25.587 -1.826 -5.856 1.00 0.00 N ATOM 1617 CA VAL A 101 -27.068 -1.941 -5.727 1.00 0.00 C ATOM 1618 C VAL A 101 -27.681 -2.401 -7.052 1.00 0.00 C ATOM 1619 O VAL A 101 -28.481 -3.316 -7.092 1.00 0.00 O ATOM 1620 CB VAL A 101 -27.547 -0.532 -5.375 1.00 0.00 C ATOM 1621 CG1 VAL A 101 -29.071 -0.526 -5.248 1.00 0.00 C ATOM 1622 CG2 VAL A 101 -26.923 -0.102 -4.045 1.00 0.00 C ATOM 0 H VAL A 101 -25.200 -0.913 -5.618 1.00 0.00 H new ATOM 0 HA VAL A 101 -27.360 -2.671 -4.972 1.00 0.00 H new ATOM 0 HB VAL A 101 -27.247 0.161 -6.161 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -29.411 0.479 -4.997 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -29.516 -0.834 -6.194 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -29.373 -1.218 -4.462 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -27.263 0.902 -3.792 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -27.225 -0.796 -3.260 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -25.837 -0.106 -4.135 1.00 0.00 H new ATOM 1632 N ALA A 102 -27.314 -1.776 -8.137 1.00 0.00 N ATOM 1633 CA ALA A 102 -27.877 -2.178 -9.458 1.00 0.00 C ATOM 1634 C ALA A 102 -27.423 -3.595 -9.817 1.00 0.00 C ATOM 1635 O ALA A 102 -28.218 -4.440 -10.182 1.00 0.00 O ATOM 1636 CB ALA A 102 -27.313 -1.166 -10.454 1.00 0.00 C ATOM 0 H ALA A 102 -26.648 -1.004 -8.166 1.00 0.00 H new ATOM 0 HA ALA A 102 -28.967 -2.184 -9.457 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -27.682 -1.395 -11.454 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -27.629 -0.162 -10.171 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -26.224 -1.218 -10.449 1.00 0.00 H new ATOM 1642 N GLY A 103 -26.149 -3.863 -9.719 1.00 0.00 N ATOM 1643 CA GLY A 103 -25.645 -5.225 -10.055 1.00 0.00 C ATOM 1644 C GLY A 103 -24.407 -5.107 -10.946 1.00 0.00 C ATOM 1645 O GLY A 103 -24.347 -5.673 -12.019 1.00 0.00 O ATOM 0 H GLY A 103 -25.436 -3.198 -9.421 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -25.399 -5.768 -9.143 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -26.421 -5.795 -10.566 1.00 0.00 H new ATOM 1649 N ALA A 104 -23.419 -4.374 -10.511 1.00 0.00 N ATOM 1650 CA ALA A 104 -22.184 -4.221 -11.334 1.00 0.00 C ATOM 1651 C ALA A 104 -21.256 -5.422 -11.125 1.00 0.00 C ATOM 1652 O ALA A 104 -20.701 -5.597 -10.059 1.00 0.00 O ATOM 1653 CB ALA A 104 -21.526 -2.939 -10.824 1.00 0.00 C ATOM 0 H ALA A 104 -23.413 -3.874 -9.622 1.00 0.00 H new ATOM 0 HA ALA A 104 -22.402 -4.171 -12.401 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -20.607 -2.755 -11.381 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -22.208 -2.100 -10.962 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -21.293 -3.046 -9.765 1.00 0.00 H new