USER MOD reduce.3.24.130724 H: found=0, std=0, add=800, rem=0, adj=17 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 Set 1.1: A 49 THR OG1 : rot -74:sc= 1.23 USER MOD Set 1.2: A 52 HIS : no HD1:sc= -5.34! C(o=-4.1!,f=-7.7!) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 TYR OH : rot -134:sc=0.000831 USER MOD Single : A 10 GLN : amide:sc= -1.51 K(o=-1.5,f=-0.046) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.181) USER MOD Single : A 24 MET CE :methyl -168:sc= -0.907 (180deg=-0.962) USER MOD Single : A 25 GLN : amide:sc= -0.0178 X(o=-0.018,f=-0.46) USER MOD Single : A 26 ASN : amide:sc= -0.211 X(o=-0.21,f=-0.29) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 GLN : amide:sc= -0.244 K(o=-0.24,f=-3!) USER MOD Single : A 47 LYS NZ :NH3+ -145:sc= -0.33 (180deg=-2.24!) USER MOD Single : A 48 MET CE :methyl 152:sc= -2.48 (180deg=-6.65!) 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 180:sc= -1.99 USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 76 THR OG1 : rot 106:sc= -0.328 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 THR OG1 : rot -84:sc= 0.52 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ -121:sc= -0.0756 (180deg=-0.51) USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 GLN : amide:sc= 0 X(o=0,f=-0.081) USER MOD Single : A 92 SER OG : rot -58:sc= 0.152 USER MOD Single : A 96 HIS : no HD1:sc= -0.367 X(o=-0.37,f=-0.22) USER MOD Single : A 100 LYS NZ :NH3+ -108:sc= 1.48 (180deg=0.697) USER MOD ----------------------------------------------------------------- ATOM 34 N VAL A 3 -25.103 -11.822 6.075 1.00 0.00 N ATOM 35 CA VAL A 3 -24.902 -12.607 4.822 1.00 0.00 C ATOM 36 C VAL A 3 -23.410 -12.718 4.499 1.00 0.00 C ATOM 37 O VAL A 3 -22.900 -13.789 4.239 1.00 0.00 O ATOM 38 CB VAL A 3 -25.626 -11.811 3.736 1.00 0.00 C ATOM 39 CG1 VAL A 3 -25.783 -12.677 2.487 1.00 0.00 C ATOM 40 CG2 VAL A 3 -27.008 -11.396 4.245 1.00 0.00 C ATOM 0 HA VAL A 3 -25.285 -13.624 4.907 1.00 0.00 H new ATOM 0 HB VAL A 3 -25.046 -10.922 3.490 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -26.299 -12.109 1.713 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -24.799 -12.974 2.124 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -26.363 -13.567 2.732 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -27.525 -10.828 3.472 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -27.588 -12.286 4.491 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -26.897 -10.778 5.136 1.00 0.00 H new ATOM 50 N LYS A 4 -22.707 -11.619 4.511 1.00 0.00 N ATOM 51 CA LYS A 4 -21.249 -11.663 4.202 1.00 0.00 C ATOM 52 C LYS A 4 -21.018 -12.344 2.850 1.00 0.00 C ATOM 53 O LYS A 4 -21.892 -12.386 2.007 1.00 0.00 O ATOM 54 CB LYS A 4 -20.629 -12.486 5.331 1.00 0.00 C ATOM 55 CG LYS A 4 -19.476 -11.701 5.961 1.00 0.00 C ATOM 56 CD LYS A 4 -19.490 -11.898 7.478 1.00 0.00 C ATOM 57 CE LYS A 4 -19.544 -10.534 8.171 1.00 0.00 C ATOM 58 NZ LYS A 4 -19.408 -10.834 9.623 1.00 0.00 N ATOM 0 H LYS A 4 -23.079 -10.693 4.721 1.00 0.00 H new ATOM 0 HA LYS A 4 -20.809 -10.668 4.136 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -21.382 -12.714 6.085 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -20.266 -13.438 4.944 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -18.525 -12.039 5.549 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -19.570 -10.642 5.721 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -20.351 -12.500 7.769 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -18.600 -12.442 7.793 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -18.740 -9.884 7.825 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -20.482 -10.021 7.960 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -19.436 -9.947 10.165 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -20.190 -11.449 9.925 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -18.503 -11.316 9.795 1.00 0.00 H new ATOM 72 N CYS A 5 -19.847 -12.877 2.637 1.00 0.00 N ATOM 73 CA CYS A 5 -19.560 -13.556 1.338 1.00 0.00 C ATOM 74 C CYS A 5 -18.169 -14.202 1.376 1.00 0.00 C ATOM 75 O CYS A 5 -17.359 -13.866 2.216 1.00 0.00 O ATOM 76 CB CYS A 5 -19.610 -12.444 0.287 1.00 0.00 C ATOM 77 SG CYS A 5 -18.664 -11.012 0.865 1.00 0.00 S ATOM 0 H CYS A 5 -19.076 -12.873 3.304 1.00 0.00 H new ATOM 0 HA CYS A 5 -20.273 -14.351 1.120 1.00 0.00 H new ATOM 0 HB2 CYS A 5 -19.201 -12.804 -0.657 1.00 0.00 H new ATOM 0 HB3 CYS A 5 -20.644 -12.156 0.098 1.00 0.00 H new ATOM 82 N PRO A 6 -17.932 -15.114 0.463 1.00 0.00 N ATOM 83 CA PRO A 6 -18.956 -15.494 -0.546 1.00 0.00 C ATOM 84 C PRO A 6 -20.046 -16.361 0.092 1.00 0.00 C ATOM 85 O PRO A 6 -19.819 -17.041 1.073 1.00 0.00 O ATOM 86 CB PRO A 6 -18.164 -16.296 -1.575 1.00 0.00 C ATOM 87 CG PRO A 6 -16.985 -16.833 -0.827 1.00 0.00 C ATOM 88 CD PRO A 6 -16.685 -15.869 0.292 1.00 0.00 C ATOM 0 HA PRO A 6 -19.467 -14.634 -0.979 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -18.766 -17.103 -1.994 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -17.849 -15.667 -2.408 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -17.201 -17.825 -0.431 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -16.124 -16.934 -1.488 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -16.409 -16.394 1.206 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -15.853 -15.212 0.039 1.00 0.00 H new ATOM 96 N GLY A 7 -21.229 -16.341 -0.459 1.00 0.00 N ATOM 97 CA GLY A 7 -22.334 -17.162 0.110 1.00 0.00 C ATOM 98 C GLY A 7 -23.506 -17.187 -0.871 1.00 0.00 C ATOM 99 O GLY A 7 -23.552 -16.424 -1.815 1.00 0.00 O ATOM 0 H GLY A 7 -21.478 -15.790 -1.281 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -21.986 -18.177 0.303 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -22.654 -16.748 1.066 1.00 0.00 H new ATOM 103 N GLU A 8 -24.455 -18.057 -0.659 1.00 0.00 N ATOM 104 CA GLU A 8 -25.621 -18.126 -1.585 1.00 0.00 C ATOM 105 C GLU A 8 -26.921 -17.867 -0.819 1.00 0.00 C ATOM 106 O GLU A 8 -27.044 -18.191 0.345 1.00 0.00 O ATOM 107 CB GLU A 8 -25.602 -19.550 -2.141 1.00 0.00 C ATOM 108 CG GLU A 8 -24.871 -19.564 -3.486 1.00 0.00 C ATOM 109 CD GLU A 8 -25.367 -20.743 -4.325 1.00 0.00 C ATOM 110 OE1 GLU A 8 -26.344 -21.357 -3.929 1.00 0.00 O ATOM 111 OE2 GLU A 8 -24.761 -21.011 -5.349 1.00 0.00 O ATOM 0 H GLU A 8 -24.474 -18.722 0.114 1.00 0.00 H new ATOM 0 HA GLU A 8 -25.564 -17.378 -2.376 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -25.106 -20.219 -1.438 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -26.621 -19.917 -2.265 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -25.045 -18.628 -4.016 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -23.796 -19.644 -3.327 1.00 0.00 H new ATOM 118 N TYR A 9 -27.893 -17.284 -1.466 1.00 0.00 N ATOM 119 CA TYR A 9 -29.186 -17.005 -0.778 1.00 0.00 C ATOM 120 C TYR A 9 -30.315 -16.884 -1.804 1.00 0.00 C ATOM 121 O TYR A 9 -30.127 -16.374 -2.891 1.00 0.00 O ATOM 122 CB TYR A 9 -28.971 -15.674 -0.056 1.00 0.00 C ATOM 123 CG TYR A 9 -27.940 -15.852 1.033 1.00 0.00 C ATOM 124 CD1 TYR A 9 -28.327 -16.323 2.294 1.00 0.00 C ATOM 125 CD2 TYR A 9 -26.596 -15.545 0.782 1.00 0.00 C ATOM 126 CE1 TYR A 9 -27.370 -16.487 3.305 1.00 0.00 C ATOM 127 CE2 TYR A 9 -25.639 -15.709 1.792 1.00 0.00 C ATOM 128 CZ TYR A 9 -26.026 -16.180 3.053 1.00 0.00 C ATOM 129 OH TYR A 9 -25.083 -16.341 4.049 1.00 0.00 O ATOM 0 H TYR A 9 -27.848 -16.989 -2.441 1.00 0.00 H new ATOM 0 HA TYR A 9 -29.468 -17.801 -0.089 1.00 0.00 H new ATOM 0 HB2 TYR A 9 -28.640 -14.914 -0.764 1.00 0.00 H new ATOM 0 HB3 TYR A 9 -29.911 -15.324 0.372 1.00 0.00 H new ATOM 0 HD1 TYR A 9 -29.363 -16.560 2.487 1.00 0.00 H new ATOM 0 HD2 TYR A 9 -26.298 -15.182 -0.190 1.00 0.00 H new ATOM 0 HE1 TYR A 9 -27.668 -16.850 4.278 1.00 0.00 H new ATOM 0 HE2 TYR A 9 -24.603 -15.472 1.598 1.00 0.00 H new ATOM 0 HH TYR A 9 -24.508 -15.549 4.086 1.00 0.00 H new ATOM 139 N GLN A 10 -31.487 -17.348 -1.469 1.00 0.00 N ATOM 140 CA GLN A 10 -32.627 -17.259 -2.427 1.00 0.00 C ATOM 141 C GLN A 10 -33.697 -16.306 -1.891 1.00 0.00 C ATOM 142 O GLN A 10 -33.983 -16.280 -0.710 1.00 0.00 O ATOM 143 CB GLN A 10 -33.176 -18.683 -2.523 1.00 0.00 C ATOM 144 CG GLN A 10 -32.628 -19.358 -3.782 1.00 0.00 C ATOM 145 CD GLN A 10 -32.788 -20.875 -3.661 1.00 0.00 C ATOM 146 OE1 GLN A 10 -33.841 -21.358 -3.294 1.00 0.00 O ATOM 147 NE2 GLN A 10 -31.781 -21.650 -3.955 1.00 0.00 N ATOM 0 H GLN A 10 -31.706 -17.785 -0.574 1.00 0.00 H new ATOM 0 HA GLN A 10 -32.319 -16.874 -3.399 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -32.892 -19.254 -1.639 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -34.265 -18.663 -2.553 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -33.159 -18.995 -4.662 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -31.577 -19.102 -3.916 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -30.898 -21.244 -4.263 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -31.877 -22.662 -3.877 1.00 0.00 H new ATOM 156 N VAL A 11 -34.290 -15.521 -2.747 1.00 0.00 N ATOM 157 CA VAL A 11 -35.340 -14.569 -2.283 1.00 0.00 C ATOM 158 C VAL A 11 -36.718 -15.020 -2.776 1.00 0.00 C ATOM 159 O VAL A 11 -37.089 -14.789 -3.911 1.00 0.00 O ATOM 160 CB VAL A 11 -34.961 -13.225 -2.906 1.00 0.00 C ATOM 161 CG1 VAL A 11 -35.834 -12.122 -2.307 1.00 0.00 C ATOM 162 CG2 VAL A 11 -33.489 -12.926 -2.613 1.00 0.00 C ATOM 0 H VAL A 11 -34.094 -15.497 -3.748 1.00 0.00 H new ATOM 0 HA VAL A 11 -35.394 -14.513 -1.196 1.00 0.00 H new ATOM 0 HB VAL A 11 -35.117 -13.266 -3.984 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -35.564 -11.163 -2.751 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -36.883 -12.335 -2.514 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -35.678 -12.080 -1.229 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -33.217 -11.968 -3.056 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -33.334 -12.884 -1.535 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -32.866 -13.713 -3.039 1.00 0.00 H new ATOM 172 N ASP A 12 -37.481 -15.660 -1.933 1.00 0.00 N ATOM 173 CA ASP A 12 -38.835 -16.124 -2.353 1.00 0.00 C ATOM 174 C ASP A 12 -38.730 -16.998 -3.605 1.00 0.00 C ATOM 175 O ASP A 12 -38.588 -18.202 -3.523 1.00 0.00 O ATOM 176 CB ASP A 12 -39.615 -14.844 -2.655 1.00 0.00 C ATOM 177 CG ASP A 12 -40.977 -15.205 -3.251 1.00 0.00 C ATOM 178 OD1 ASP A 12 -41.901 -15.412 -2.484 1.00 0.00 O ATOM 179 OD2 ASP A 12 -41.071 -15.267 -4.466 1.00 0.00 O ATOM 0 H ASP A 12 -37.226 -15.882 -0.971 1.00 0.00 H new ATOM 0 HA ASP A 12 -39.322 -16.727 -1.586 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -39.748 -14.263 -1.743 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -39.055 -14.220 -3.352 1.00 0.00 H new ATOM 184 N GLY A 13 -38.802 -16.403 -4.765 1.00 0.00 N ATOM 185 CA GLY A 13 -38.710 -17.203 -6.020 1.00 0.00 C ATOM 186 C GLY A 13 -37.552 -16.686 -6.874 1.00 0.00 C ATOM 187 O GLY A 13 -37.665 -16.556 -8.077 1.00 0.00 O ATOM 0 H GLY A 13 -38.920 -15.399 -4.898 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -38.558 -18.256 -5.782 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -39.645 -17.134 -6.577 1.00 0.00 H new ATOM 191 N LYS A 14 -36.436 -16.392 -6.264 1.00 0.00 N ATOM 192 CA LYS A 14 -35.270 -15.886 -7.045 1.00 0.00 C ATOM 193 C LYS A 14 -33.973 -16.510 -6.523 1.00 0.00 C ATOM 194 O LYS A 14 -33.951 -17.140 -5.484 1.00 0.00 O ATOM 195 CB LYS A 14 -35.268 -14.374 -6.819 1.00 0.00 C ATOM 196 CG LYS A 14 -34.710 -13.672 -8.059 1.00 0.00 C ATOM 197 CD LYS A 14 -35.822 -12.870 -8.737 1.00 0.00 C ATOM 198 CE LYS A 14 -36.691 -13.808 -9.577 1.00 0.00 C ATOM 199 NZ LYS A 14 -36.312 -13.522 -10.989 1.00 0.00 N ATOM 0 H LYS A 14 -36.281 -16.480 -5.260 1.00 0.00 H new ATOM 0 HA LYS A 14 -35.340 -16.139 -8.103 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -36.280 -14.025 -6.615 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -34.664 -14.127 -5.946 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -33.891 -13.011 -7.777 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -34.302 -14.407 -8.753 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -36.432 -12.368 -7.986 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -35.391 -12.094 -9.369 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -36.506 -14.852 -9.322 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -37.751 -13.622 -9.407 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -36.867 -14.128 -11.627 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -36.505 -12.523 -11.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -35.299 -13.715 -11.122 1.00 0.00 H new ATOM 213 N LYS A 15 -32.893 -16.342 -7.235 1.00 0.00 N ATOM 214 CA LYS A 15 -31.601 -16.928 -6.779 1.00 0.00 C ATOM 215 C LYS A 15 -30.513 -15.851 -6.743 1.00 0.00 C ATOM 216 O LYS A 15 -30.409 -15.029 -7.631 1.00 0.00 O ATOM 217 CB LYS A 15 -31.263 -17.998 -7.818 1.00 0.00 C ATOM 218 CG LYS A 15 -30.049 -18.802 -7.349 1.00 0.00 C ATOM 219 CD LYS A 15 -30.479 -20.234 -7.024 1.00 0.00 C ATOM 220 CE LYS A 15 -29.466 -20.871 -6.072 1.00 0.00 C ATOM 221 NZ LYS A 15 -28.239 -21.069 -6.894 1.00 0.00 N ATOM 0 H LYS A 15 -32.849 -15.824 -8.113 1.00 0.00 H new ATOM 0 HA LYS A 15 -31.668 -17.343 -5.773 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -32.116 -18.660 -7.964 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -31.053 -17.531 -8.781 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -29.282 -18.808 -8.124 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -29.608 -18.335 -6.468 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -31.470 -20.232 -6.569 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -30.550 -20.820 -7.940 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -29.268 -20.226 -5.216 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -29.835 -21.818 -5.679 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -27.579 -21.694 -6.388 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -28.497 -21.502 -7.804 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -27.783 -20.150 -7.065 1.00 0.00 H new ATOM 235 N VAL A 16 -29.700 -15.853 -5.721 1.00 0.00 N ATOM 236 CA VAL A 16 -28.618 -14.833 -5.626 1.00 0.00 C ATOM 237 C VAL A 16 -27.282 -15.512 -5.310 1.00 0.00 C ATOM 238 O VAL A 16 -27.177 -16.293 -4.385 1.00 0.00 O ATOM 239 CB VAL A 16 -29.041 -13.916 -4.478 1.00 0.00 C ATOM 240 CG1 VAL A 16 -28.014 -12.793 -4.315 1.00 0.00 C ATOM 241 CG2 VAL A 16 -30.411 -13.310 -4.791 1.00 0.00 C ATOM 0 H VAL A 16 -29.739 -16.517 -4.948 1.00 0.00 H new ATOM 0 HA VAL A 16 -28.482 -14.283 -6.557 1.00 0.00 H new ATOM 0 HB VAL A 16 -29.098 -14.492 -3.555 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -28.316 -12.140 -3.497 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -27.037 -13.223 -4.095 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -27.957 -12.216 -5.238 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -30.715 -12.656 -3.974 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -30.352 -12.734 -5.714 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -31.144 -14.108 -4.908 1.00 0.00 H new ATOM 251 N ILE A 17 -26.264 -15.227 -6.073 1.00 0.00 N ATOM 252 CA ILE A 17 -24.939 -15.862 -5.815 1.00 0.00 C ATOM 253 C ILE A 17 -23.904 -14.801 -5.430 1.00 0.00 C ATOM 254 O ILE A 17 -23.387 -14.091 -6.269 1.00 0.00 O ATOM 255 CB ILE A 17 -24.555 -16.528 -7.136 1.00 0.00 C ATOM 256 CG1 ILE A 17 -25.544 -17.655 -7.445 1.00 0.00 C ATOM 257 CG2 ILE A 17 -23.144 -17.109 -7.024 1.00 0.00 C ATOM 258 CD1 ILE A 17 -25.474 -18.001 -8.933 1.00 0.00 C ATOM 0 H ILE A 17 -26.291 -14.583 -6.863 1.00 0.00 H new ATOM 0 HA ILE A 17 -24.980 -16.576 -4.993 1.00 0.00 H new ATOM 0 HB ILE A 17 -24.582 -15.788 -7.936 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -25.309 -18.534 -6.845 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -26.556 -17.349 -7.179 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -22.870 -17.584 -7.966 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -22.438 -16.309 -6.802 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -23.118 -17.849 -6.224 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -26.178 -18.803 -9.153 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -25.730 -17.121 -9.524 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -24.464 -18.325 -9.184 1.00 0.00 H new ATOM 270 N LEU A 18 -23.595 -14.692 -4.166 1.00 0.00 N ATOM 271 CA LEU A 18 -22.590 -13.681 -3.729 1.00 0.00 C ATOM 272 C LEU A 18 -21.179 -14.271 -3.816 1.00 0.00 C ATOM 273 O LEU A 18 -20.926 -15.368 -3.361 1.00 0.00 O ATOM 274 CB LEU A 18 -22.948 -13.367 -2.275 1.00 0.00 C ATOM 275 CG LEU A 18 -23.516 -11.949 -2.176 1.00 0.00 C ATOM 276 CD1 LEU A 18 -23.646 -11.554 -0.704 1.00 0.00 C ATOM 277 CD2 LEU A 18 -22.575 -10.970 -2.881 1.00 0.00 C ATOM 0 H LEU A 18 -23.995 -15.259 -3.418 1.00 0.00 H new ATOM 0 HA LEU A 18 -22.604 -12.788 -4.354 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -23.678 -14.088 -1.907 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -22.063 -13.459 -1.645 1.00 0.00 H new ATOM 0 HG LEU A 18 -24.496 -11.918 -2.651 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -24.050 -10.544 -0.633 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -24.316 -12.250 -0.198 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -22.665 -11.586 -0.231 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -22.980 -9.961 -2.810 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -21.595 -11.002 -2.406 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -22.479 -11.249 -3.930 1.00 0.00 H new ATOM 289 N ASP A 19 -20.259 -13.552 -4.399 1.00 0.00 N ATOM 290 CA ASP A 19 -18.867 -14.077 -4.514 1.00 0.00 C ATOM 291 C ASP A 19 -17.896 -13.176 -3.746 1.00 0.00 C ATOM 292 O ASP A 19 -18.299 -12.294 -3.015 1.00 0.00 O ATOM 293 CB ASP A 19 -18.556 -14.045 -6.012 1.00 0.00 C ATOM 294 CG ASP A 19 -18.648 -15.463 -6.582 1.00 0.00 C ATOM 295 OD1 ASP A 19 -18.944 -16.369 -5.820 1.00 0.00 O ATOM 296 OD2 ASP A 19 -18.420 -15.617 -7.771 1.00 0.00 O ATOM 0 H ASP A 19 -20.409 -12.626 -4.800 1.00 0.00 H new ATOM 0 HA ASP A 19 -18.767 -15.079 -4.097 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -19.258 -13.388 -6.526 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -17.559 -13.638 -6.179 1.00 0.00 H new ATOM 301 N GLU A 20 -16.619 -13.394 -3.906 1.00 0.00 N ATOM 302 CA GLU A 20 -15.623 -12.551 -3.184 1.00 0.00 C ATOM 303 C GLU A 20 -16.038 -11.078 -3.238 1.00 0.00 C ATOM 304 O GLU A 20 -16.644 -10.629 -4.189 1.00 0.00 O ATOM 305 CB GLU A 20 -14.308 -12.766 -3.934 1.00 0.00 C ATOM 306 CG GLU A 20 -13.207 -13.142 -2.941 1.00 0.00 C ATOM 307 CD GLU A 20 -12.505 -14.416 -3.415 1.00 0.00 C ATOM 308 OE1 GLU A 20 -13.191 -15.304 -3.892 1.00 0.00 O ATOM 309 OE2 GLU A 20 -11.292 -14.480 -3.294 1.00 0.00 O ATOM 0 H GLU A 20 -16.222 -14.118 -4.505 1.00 0.00 H new ATOM 0 HA GLU A 20 -15.541 -12.818 -2.130 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -14.426 -13.554 -4.677 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -14.032 -11.859 -4.472 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -12.487 -12.328 -2.855 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -13.634 -13.297 -1.950 1.00 0.00 H new ATOM 316 N ASP A 21 -15.713 -10.324 -2.223 1.00 0.00 N ATOM 317 CA ASP A 21 -16.087 -8.879 -2.216 1.00 0.00 C ATOM 318 C ASP A 21 -17.609 -8.727 -2.133 1.00 0.00 C ATOM 319 O ASP A 21 -18.155 -7.685 -2.439 1.00 0.00 O ATOM 320 CB ASP A 21 -15.565 -8.328 -3.543 1.00 0.00 C ATOM 321 CG ASP A 21 -14.867 -6.988 -3.299 1.00 0.00 C ATOM 322 OD1 ASP A 21 -15.265 -6.295 -2.379 1.00 0.00 O ATOM 323 OD2 ASP A 21 -13.947 -6.679 -4.039 1.00 0.00 O ATOM 0 H ASP A 21 -15.205 -10.645 -1.399 1.00 0.00 H new ATOM 0 HA ASP A 21 -15.668 -8.348 -1.361 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -14.870 -9.036 -3.995 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -16.389 -8.199 -4.245 1.00 0.00 H new ATOM 328 N CYS A 22 -18.297 -9.756 -1.721 1.00 0.00 N ATOM 329 CA CYS A 22 -19.782 -9.666 -1.620 1.00 0.00 C ATOM 330 C CYS A 22 -20.371 -9.140 -2.932 1.00 0.00 C ATOM 331 O CYS A 22 -21.221 -8.273 -2.938 1.00 0.00 O ATOM 332 CB CYS A 22 -20.041 -8.678 -0.481 1.00 0.00 C ATOM 333 SG CYS A 22 -20.052 -9.564 1.097 1.00 0.00 S ATOM 0 H CYS A 22 -17.896 -10.654 -1.450 1.00 0.00 H new ATOM 0 HA CYS A 22 -20.243 -10.636 -1.432 1.00 0.00 H new ATOM 0 HB2 CYS A 22 -19.270 -7.907 -0.472 1.00 0.00 H new ATOM 0 HB3 CYS A 22 -20.995 -8.173 -0.633 1.00 0.00 H new ATOM 338 N PHE A 23 -19.925 -9.660 -4.043 1.00 0.00 N ATOM 339 CA PHE A 23 -20.459 -9.190 -5.354 1.00 0.00 C ATOM 340 C PHE A 23 -21.727 -9.966 -5.718 1.00 0.00 C ATOM 341 O PHE A 23 -21.739 -11.181 -5.739 1.00 0.00 O ATOM 342 CB PHE A 23 -19.345 -9.477 -6.362 1.00 0.00 C ATOM 343 CG PHE A 23 -18.617 -8.195 -6.689 1.00 0.00 C ATOM 344 CD1 PHE A 23 -18.075 -7.414 -5.658 1.00 0.00 C ATOM 345 CD2 PHE A 23 -18.484 -7.786 -8.022 1.00 0.00 C ATOM 346 CE1 PHE A 23 -17.401 -6.225 -5.962 1.00 0.00 C ATOM 347 CE2 PHE A 23 -17.809 -6.596 -8.326 1.00 0.00 C ATOM 348 CZ PHE A 23 -17.267 -5.815 -7.296 1.00 0.00 C ATOM 0 H PHE A 23 -19.214 -10.390 -4.100 1.00 0.00 H new ATOM 0 HA PHE A 23 -20.729 -8.134 -5.335 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -18.649 -10.208 -5.952 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -19.765 -9.911 -7.270 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -18.177 -7.729 -4.630 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -18.902 -8.388 -8.816 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -16.984 -5.623 -5.168 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -17.706 -6.281 -9.354 1.00 0.00 H new ATOM 0 HZ PHE A 23 -16.747 -4.898 -7.530 1.00 0.00 H new ATOM 358 N MET A 24 -22.794 -9.273 -6.008 1.00 0.00 N ATOM 359 CA MET A 24 -24.061 -9.971 -6.372 1.00 0.00 C ATOM 360 C MET A 24 -23.770 -11.136 -7.320 1.00 0.00 C ATOM 361 O MET A 24 -24.400 -12.173 -7.255 1.00 0.00 O ATOM 362 CB MET A 24 -24.909 -8.909 -7.073 1.00 0.00 C ATOM 363 CG MET A 24 -26.377 -9.084 -6.679 1.00 0.00 C ATOM 364 SD MET A 24 -27.145 -10.327 -7.748 1.00 0.00 S ATOM 365 CE MET A 24 -28.866 -9.938 -7.348 1.00 0.00 C ATOM 0 H MET A 24 -22.844 -8.254 -6.009 1.00 0.00 H new ATOM 0 HA MET A 24 -24.567 -10.389 -5.502 1.00 0.00 H new ATOM 0 HB2 MET A 24 -24.564 -7.913 -6.797 1.00 0.00 H new ATOM 0 HB3 MET A 24 -24.799 -8.996 -8.154 1.00 0.00 H new ATOM 0 HG2 MET A 24 -26.450 -9.391 -5.636 1.00 0.00 H new ATOM 0 HG3 MET A 24 -26.905 -8.135 -6.770 1.00 0.00 H new ATOM 0 HE1 MET A 24 -29.516 -10.724 -7.733 1.00 0.00 H new ATOM 0 HE2 MET A 24 -28.982 -9.870 -6.266 1.00 0.00 H new ATOM 0 HE3 MET A 24 -29.139 -8.986 -7.803 1.00 0.00 H new ATOM 375 N GLN A 25 -22.819 -10.976 -8.198 1.00 0.00 N ATOM 376 CA GLN A 25 -22.489 -12.077 -9.149 1.00 0.00 C ATOM 377 C GLN A 25 -23.750 -12.529 -9.891 1.00 0.00 C ATOM 378 O GLN A 25 -23.808 -13.615 -10.433 1.00 0.00 O ATOM 379 CB GLN A 25 -21.948 -13.208 -8.273 1.00 0.00 C ATOM 380 CG GLN A 25 -20.628 -13.718 -8.855 1.00 0.00 C ATOM 381 CD GLN A 25 -20.916 -14.687 -10.001 1.00 0.00 C ATOM 382 OE1 GLN A 25 -21.217 -14.271 -11.103 1.00 0.00 O ATOM 383 NE2 GLN A 25 -20.837 -15.972 -9.789 1.00 0.00 N ATOM 0 H GLN A 25 -22.256 -10.132 -8.299 1.00 0.00 H new ATOM 0 HA GLN A 25 -21.768 -11.768 -9.906 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -21.795 -12.852 -7.254 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -22.673 -14.020 -8.221 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -20.029 -12.881 -9.214 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -20.046 -14.217 -8.080 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -20.585 -16.322 -8.865 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -21.028 -16.627 -10.548 1.00 0.00 H new ATOM 392 N ASN A 26 -24.760 -11.703 -9.919 1.00 0.00 N ATOM 393 CA ASN A 26 -26.017 -12.085 -10.624 1.00 0.00 C ATOM 394 C ASN A 26 -26.730 -10.834 -11.147 1.00 0.00 C ATOM 395 O ASN A 26 -27.856 -10.561 -10.781 1.00 0.00 O ATOM 396 CB ASN A 26 -26.870 -12.783 -9.565 1.00 0.00 C ATOM 397 CG ASN A 26 -27.106 -14.238 -9.976 1.00 0.00 C ATOM 398 OD1 ASN A 26 -26.210 -14.896 -10.465 1.00 0.00 O ATOM 399 ND2 ASN A 26 -28.284 -14.770 -9.796 1.00 0.00 N ATOM 0 H ASN A 26 -24.769 -10.780 -9.484 1.00 0.00 H new ATOM 0 HA ASN A 26 -25.829 -12.728 -11.484 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -26.370 -12.744 -8.597 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -27.823 -12.267 -9.453 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -28.453 -15.739 -10.066 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -29.036 -14.217 -9.385 1.00 0.00 H new ATOM 406 N PRO A 27 -26.042 -10.115 -11.991 1.00 0.00 N ATOM 407 CA PRO A 27 -26.610 -8.875 -12.577 1.00 0.00 C ATOM 408 C PRO A 27 -27.697 -9.216 -13.601 1.00 0.00 C ATOM 409 O PRO A 27 -28.635 -8.468 -13.796 1.00 0.00 O ATOM 410 CB PRO A 27 -25.410 -8.220 -13.256 1.00 0.00 C ATOM 411 CG PRO A 27 -24.467 -9.344 -13.544 1.00 0.00 C ATOM 412 CD PRO A 27 -24.684 -10.385 -12.476 1.00 0.00 C ATOM 0 HA PRO A 27 -27.082 -8.228 -11.838 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -25.706 -7.708 -14.172 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -24.949 -7.474 -12.609 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -24.655 -9.761 -14.533 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -23.435 -8.993 -13.537 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -24.597 -11.394 -12.878 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -23.949 -10.296 -11.676 1.00 0.00 H new ATOM 420 N GLU A 28 -27.579 -10.338 -14.255 1.00 0.00 N ATOM 421 CA GLU A 28 -28.607 -10.723 -15.264 1.00 0.00 C ATOM 422 C GLU A 28 -29.926 -11.073 -14.570 1.00 0.00 C ATOM 423 O GLU A 28 -30.996 -10.818 -15.088 1.00 0.00 O ATOM 424 CB GLU A 28 -28.029 -11.952 -15.969 1.00 0.00 C ATOM 425 CG GLU A 28 -28.501 -11.974 -17.424 1.00 0.00 C ATOM 426 CD GLU A 28 -29.721 -12.888 -17.552 1.00 0.00 C ATOM 427 OE1 GLU A 28 -30.383 -13.103 -16.551 1.00 0.00 O ATOM 428 OE2 GLU A 28 -29.972 -13.356 -18.650 1.00 0.00 O ATOM 0 H GLU A 28 -26.816 -11.005 -14.135 1.00 0.00 H new ATOM 0 HA GLU A 28 -28.822 -9.915 -15.963 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -26.940 -11.929 -15.929 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -28.347 -12.861 -15.458 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -28.753 -10.965 -17.751 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -27.699 -12.328 -18.072 1.00 0.00 H new ATOM 435 N ASP A 29 -29.860 -11.653 -13.404 1.00 0.00 N ATOM 436 CA ASP A 29 -31.112 -12.018 -12.681 1.00 0.00 C ATOM 437 C ASP A 29 -31.479 -10.927 -11.670 1.00 0.00 C ATOM 438 O ASP A 29 -32.072 -11.192 -10.644 1.00 0.00 O ATOM 439 CB ASP A 29 -30.788 -13.327 -11.962 1.00 0.00 C ATOM 440 CG ASP A 29 -31.296 -14.506 -12.795 1.00 0.00 C ATOM 441 OD1 ASP A 29 -31.253 -14.409 -14.010 1.00 0.00 O ATOM 442 OD2 ASP A 29 -31.719 -15.486 -12.203 1.00 0.00 O ATOM 0 H ASP A 29 -28.994 -11.890 -12.920 1.00 0.00 H new ATOM 0 HA ASP A 29 -31.961 -12.123 -13.356 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -29.712 -13.413 -11.808 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -31.253 -13.337 -10.976 1.00 0.00 H new ATOM 447 N TRP A 30 -31.130 -9.702 -11.953 1.00 0.00 N ATOM 448 CA TRP A 30 -31.460 -8.595 -11.010 1.00 0.00 C ATOM 449 C TRP A 30 -32.900 -8.125 -11.230 1.00 0.00 C ATOM 450 O TRP A 30 -33.490 -8.365 -12.264 1.00 0.00 O ATOM 451 CB TRP A 30 -30.472 -7.478 -11.348 1.00 0.00 C ATOM 452 CG TRP A 30 -30.784 -6.270 -10.524 1.00 0.00 C ATOM 453 CD1 TRP A 30 -30.166 -5.939 -9.367 1.00 0.00 C ATOM 454 CD2 TRP A 30 -31.775 -5.231 -10.770 1.00 0.00 C ATOM 455 NE1 TRP A 30 -30.714 -4.763 -8.887 1.00 0.00 N ATOM 456 CE2 TRP A 30 -31.710 -4.288 -9.716 1.00 0.00 C ATOM 457 CE3 TRP A 30 -32.716 -5.017 -11.796 1.00 0.00 C ATOM 458 CZ2 TRP A 30 -32.548 -3.172 -9.683 1.00 0.00 C ATOM 459 CZ3 TRP A 30 -33.561 -3.895 -11.764 1.00 0.00 C ATOM 460 CH2 TRP A 30 -33.478 -2.975 -10.710 1.00 0.00 C ATOM 0 H TRP A 30 -30.631 -9.419 -12.796 1.00 0.00 H new ATOM 0 HA TRP A 30 -31.383 -8.904 -9.967 1.00 0.00 H new ATOM 0 HB2 TRP A 30 -29.452 -7.810 -11.155 1.00 0.00 H new ATOM 0 HB3 TRP A 30 -30.532 -7.233 -12.408 1.00 0.00 H new ATOM 0 HD1 TRP A 30 -29.374 -6.501 -8.895 1.00 0.00 H new ATOM 0 HE1 TRP A 30 -30.418 -4.303 -8.026 1.00 0.00 H new ATOM 0 HE3 TRP A 30 -32.788 -5.720 -12.613 1.00 0.00 H new ATOM 0 HZ2 TRP A 30 -32.479 -2.465 -8.870 1.00 0.00 H new ATOM 0 HZ3 TRP A 30 -34.279 -3.741 -12.556 1.00 0.00 H new ATOM 0 HH2 TRP A 30 -34.131 -2.115 -10.690 1.00 0.00 H new ATOM 471 N ASP A 31 -33.470 -7.456 -10.265 1.00 0.00 N ATOM 472 CA ASP A 31 -34.871 -6.971 -10.422 1.00 0.00 C ATOM 473 C ASP A 31 -35.210 -5.967 -9.316 1.00 0.00 C ATOM 474 O ASP A 31 -34.347 -5.513 -8.591 1.00 0.00 O ATOM 475 CB ASP A 31 -35.740 -8.223 -10.295 1.00 0.00 C ATOM 476 CG ASP A 31 -36.360 -8.554 -11.654 1.00 0.00 C ATOM 477 OD1 ASP A 31 -37.415 -8.017 -11.948 1.00 0.00 O ATOM 478 OD2 ASP A 31 -35.769 -9.339 -12.377 1.00 0.00 O ATOM 0 H ASP A 31 -33.027 -7.225 -9.376 1.00 0.00 H new ATOM 0 HA ASP A 31 -35.028 -6.461 -11.372 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -35.139 -9.062 -9.944 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -36.524 -8.061 -9.555 1.00 0.00 H new ATOM 483 N GLU A 32 -36.460 -5.615 -9.186 1.00 0.00 N ATOM 484 CA GLU A 32 -36.853 -4.638 -8.129 1.00 0.00 C ATOM 485 C GLU A 32 -36.753 -5.281 -6.742 1.00 0.00 C ATOM 486 O GLU A 32 -36.040 -4.810 -5.880 1.00 0.00 O ATOM 487 CB GLU A 32 -38.303 -4.274 -8.449 1.00 0.00 C ATOM 488 CG GLU A 32 -38.347 -3.421 -9.719 1.00 0.00 C ATOM 489 CD GLU A 32 -39.600 -2.544 -9.701 1.00 0.00 C ATOM 490 OE1 GLU A 32 -40.687 -3.099 -9.678 1.00 0.00 O ATOM 491 OE2 GLU A 32 -39.452 -1.334 -9.712 1.00 0.00 O ATOM 0 H GLU A 32 -37.226 -5.961 -9.765 1.00 0.00 H new ATOM 0 HA GLU A 32 -36.204 -3.762 -8.116 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -38.895 -5.179 -8.586 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -38.744 -3.727 -7.616 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -37.455 -2.798 -9.782 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -38.351 -4.062 -10.601 1.00 0.00 H new ATOM 498 N LYS A 33 -37.465 -6.352 -6.522 1.00 0.00 N ATOM 499 CA LYS A 33 -37.410 -7.022 -5.190 1.00 0.00 C ATOM 500 C LYS A 33 -35.982 -7.478 -4.882 1.00 0.00 C ATOM 501 O LYS A 33 -35.550 -7.477 -3.746 1.00 0.00 O ATOM 502 CB LYS A 33 -38.342 -8.227 -5.315 1.00 0.00 C ATOM 503 CG LYS A 33 -38.550 -8.859 -3.937 1.00 0.00 C ATOM 504 CD LYS A 33 -39.975 -8.578 -3.456 1.00 0.00 C ATOM 505 CE LYS A 33 -40.627 -9.886 -3.001 1.00 0.00 C ATOM 506 NZ LYS A 33 -41.835 -10.033 -3.861 1.00 0.00 N ATOM 0 H LYS A 33 -38.082 -6.792 -7.205 1.00 0.00 H new ATOM 0 HA LYS A 33 -37.710 -6.355 -4.381 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -39.300 -7.917 -5.733 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -37.917 -8.959 -6.002 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -38.378 -9.934 -3.989 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -37.829 -8.454 -3.227 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -39.958 -7.862 -2.634 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -40.559 -8.128 -4.259 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -39.948 -10.730 -3.126 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -40.896 -9.847 -1.945 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -42.336 -10.909 -3.609 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -42.466 -9.219 -3.716 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -41.547 -10.074 -4.860 1.00 0.00 H new ATOM 520 N VAL A 34 -35.245 -7.868 -5.885 1.00 0.00 N ATOM 521 CA VAL A 34 -33.845 -8.326 -5.651 1.00 0.00 C ATOM 522 C VAL A 34 -32.992 -7.175 -5.112 1.00 0.00 C ATOM 523 O VAL A 34 -32.405 -7.267 -4.052 1.00 0.00 O ATOM 524 CB VAL A 34 -33.343 -8.769 -7.024 1.00 0.00 C ATOM 525 CG1 VAL A 34 -31.900 -9.266 -6.906 1.00 0.00 C ATOM 526 CG2 VAL A 34 -34.228 -9.902 -7.549 1.00 0.00 C ATOM 0 H VAL A 34 -35.551 -7.890 -6.858 1.00 0.00 H new ATOM 0 HA VAL A 34 -33.790 -9.129 -4.916 1.00 0.00 H new ATOM 0 HB VAL A 34 -33.382 -7.925 -7.713 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -31.543 -9.582 -7.886 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -31.268 -8.461 -6.531 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -31.861 -10.109 -6.216 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -33.871 -10.219 -8.529 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -34.188 -10.744 -6.858 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -35.256 -9.551 -7.634 1.00 0.00 H new ATOM 536 N ALA A 35 -32.914 -6.092 -5.837 1.00 0.00 N ATOM 537 CA ALA A 35 -32.093 -4.937 -5.369 1.00 0.00 C ATOM 538 C ALA A 35 -32.535 -4.500 -3.969 1.00 0.00 C ATOM 539 O ALA A 35 -31.726 -4.117 -3.146 1.00 0.00 O ATOM 540 CB ALA A 35 -32.360 -3.827 -6.385 1.00 0.00 C ATOM 0 H ALA A 35 -33.383 -5.956 -6.733 1.00 0.00 H new ATOM 0 HA ALA A 35 -31.034 -5.185 -5.302 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -31.791 -2.939 -6.111 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -32.056 -4.161 -7.377 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -33.424 -3.588 -6.392 1.00 0.00 H new ATOM 546 N GLU A 36 -33.808 -4.551 -3.692 1.00 0.00 N ATOM 547 CA GLU A 36 -34.297 -4.133 -2.346 1.00 0.00 C ATOM 548 C GLU A 36 -33.690 -5.022 -1.257 1.00 0.00 C ATOM 549 O GLU A 36 -33.090 -4.544 -0.315 1.00 0.00 O ATOM 550 CB GLU A 36 -35.814 -4.313 -2.400 1.00 0.00 C ATOM 551 CG GLU A 36 -36.472 -3.436 -1.333 1.00 0.00 C ATOM 552 CD GLU A 36 -37.475 -4.270 -0.533 1.00 0.00 C ATOM 553 OE1 GLU A 36 -37.113 -5.359 -0.121 1.00 0.00 O ATOM 554 OE2 GLU A 36 -38.587 -3.804 -0.346 1.00 0.00 O ATOM 0 H GLU A 36 -34.532 -4.864 -4.339 1.00 0.00 H new ATOM 0 HA GLU A 36 -34.016 -3.107 -2.109 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -36.188 -4.044 -3.388 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -36.073 -5.359 -2.236 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -35.713 -3.024 -0.668 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -36.977 -2.592 -1.802 1.00 0.00 H new ATOM 561 N TRP A 37 -33.845 -6.312 -1.375 1.00 0.00 N ATOM 562 CA TRP A 37 -33.281 -7.230 -0.342 1.00 0.00 C ATOM 563 C TRP A 37 -31.763 -7.049 -0.237 1.00 0.00 C ATOM 564 O TRP A 37 -31.175 -7.261 0.805 1.00 0.00 O ATOM 565 CB TRP A 37 -33.618 -8.637 -0.834 1.00 0.00 C ATOM 566 CG TRP A 37 -33.185 -9.640 0.188 1.00 0.00 C ATOM 567 CD1 TRP A 37 -33.984 -10.167 1.146 1.00 0.00 C ATOM 568 CD2 TRP A 37 -31.871 -10.241 0.373 1.00 0.00 C ATOM 569 NE1 TRP A 37 -33.242 -11.055 1.906 1.00 0.00 N ATOM 570 CE2 TRP A 37 -31.936 -11.135 1.469 1.00 0.00 C ATOM 571 CE3 TRP A 37 -30.641 -10.100 -0.298 1.00 0.00 C ATOM 572 CZ2 TRP A 37 -30.819 -11.863 1.885 1.00 0.00 C ATOM 573 CZ3 TRP A 37 -29.515 -10.831 0.118 1.00 0.00 C ATOM 574 CH2 TRP A 37 -29.604 -11.711 1.207 1.00 0.00 C ATOM 0 H TRP A 37 -34.337 -6.771 -2.141 1.00 0.00 H new ATOM 0 HA TRP A 37 -33.692 -7.034 0.648 1.00 0.00 H new ATOM 0 HB2 TRP A 37 -34.690 -8.724 -1.013 1.00 0.00 H new ATOM 0 HB3 TRP A 37 -33.119 -8.831 -1.784 1.00 0.00 H new ATOM 0 HD1 TRP A 37 -35.028 -9.933 1.293 1.00 0.00 H new ATOM 0 HE1 TRP A 37 -33.615 -11.585 2.693 1.00 0.00 H new ATOM 0 HE3 TRP A 37 -30.562 -9.426 -1.138 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 -30.892 -12.539 2.724 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 -28.576 -10.715 -0.403 1.00 0.00 H new ATOM 0 HH2 TRP A 37 -28.736 -12.271 1.522 1.00 0.00 H new ATOM 585 N LEU A 38 -31.125 -6.662 -1.307 1.00 0.00 N ATOM 586 CA LEU A 38 -29.646 -6.474 -1.265 1.00 0.00 C ATOM 587 C LEU A 38 -29.287 -5.237 -0.435 1.00 0.00 C ATOM 588 O LEU A 38 -28.346 -5.247 0.334 1.00 0.00 O ATOM 589 CB LEU A 38 -29.231 -6.279 -2.723 1.00 0.00 C ATOM 590 CG LEU A 38 -28.075 -7.224 -3.056 1.00 0.00 C ATOM 591 CD1 LEU A 38 -28.218 -7.718 -4.496 1.00 0.00 C ATOM 592 CD2 LEU A 38 -26.747 -6.480 -2.902 1.00 0.00 C ATOM 0 H LEU A 38 -31.562 -6.468 -2.208 1.00 0.00 H new ATOM 0 HA LEU A 38 -29.137 -7.321 -0.804 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -30.077 -6.476 -3.382 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -28.929 -5.245 -2.891 1.00 0.00 H new ATOM 0 HG LEU A 38 -28.096 -8.076 -2.376 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -27.394 -8.391 -4.733 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -29.164 -8.249 -4.606 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -28.198 -6.867 -5.176 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -25.923 -7.153 -3.139 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -26.726 -5.628 -3.581 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -26.644 -6.128 -1.876 1.00 0.00 H new ATOM 604 N ALA A 39 -30.023 -4.172 -0.587 1.00 0.00 N ATOM 605 CA ALA A 39 -29.719 -2.935 0.189 1.00 0.00 C ATOM 606 C ALA A 39 -30.153 -3.095 1.650 1.00 0.00 C ATOM 607 O ALA A 39 -29.610 -2.469 2.539 1.00 0.00 O ATOM 608 CB ALA A 39 -30.528 -1.831 -0.493 1.00 0.00 C ATOM 0 H ALA A 39 -30.823 -4.103 -1.216 1.00 0.00 H new ATOM 0 HA ALA A 39 -28.652 -2.713 0.203 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -30.358 -0.885 0.021 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -30.215 -1.740 -1.533 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -31.588 -2.080 -0.454 1.00 0.00 H new ATOM 614 N ARG A 40 -31.131 -3.921 1.904 1.00 0.00 N ATOM 615 CA ARG A 40 -31.597 -4.111 3.309 1.00 0.00 C ATOM 616 C ARG A 40 -30.610 -4.984 4.090 1.00 0.00 C ATOM 617 O ARG A 40 -30.327 -4.735 5.245 1.00 0.00 O ATOM 618 CB ARG A 40 -32.951 -4.814 3.185 1.00 0.00 C ATOM 619 CG ARG A 40 -33.721 -4.675 4.500 1.00 0.00 C ATOM 620 CD ARG A 40 -34.692 -5.848 4.651 1.00 0.00 C ATOM 621 NE ARG A 40 -35.047 -5.871 6.097 1.00 0.00 N ATOM 622 CZ ARG A 40 -34.430 -6.686 6.908 1.00 0.00 C ATOM 623 NH1 ARG A 40 -33.152 -6.909 6.762 1.00 0.00 N ATOM 624 NH2 ARG A 40 -35.090 -7.277 7.867 1.00 0.00 N ATOM 0 H ARG A 40 -31.627 -4.471 1.203 1.00 0.00 H new ATOM 0 HA ARG A 40 -31.672 -3.166 3.846 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -33.525 -4.378 2.367 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -32.805 -5.868 2.946 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -33.026 -4.654 5.340 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -34.268 -3.732 4.515 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -35.577 -5.710 4.030 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -34.229 -6.786 4.343 1.00 0.00 H new ATOM 0 HE ARG A 40 -35.773 -5.249 6.454 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -32.636 -6.446 6.014 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -32.670 -7.546 7.396 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -36.088 -7.102 7.982 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -34.607 -7.914 8.501 1.00 0.00 H new ATOM 638 N GLU A 41 -30.090 -6.008 3.472 1.00 0.00 N ATOM 639 CA GLU A 41 -29.127 -6.897 4.184 1.00 0.00 C ATOM 640 C GLU A 41 -27.746 -6.240 4.270 1.00 0.00 C ATOM 641 O GLU A 41 -27.023 -6.420 5.230 1.00 0.00 O ATOM 642 CB GLU A 41 -29.062 -8.169 3.337 1.00 0.00 C ATOM 643 CG GLU A 41 -29.922 -9.257 3.984 1.00 0.00 C ATOM 644 CD GLU A 41 -31.402 -8.904 3.821 1.00 0.00 C ATOM 645 OE1 GLU A 41 -31.748 -8.348 2.792 1.00 0.00 O ATOM 646 OE2 GLU A 41 -32.164 -9.196 4.728 1.00 0.00 O ATOM 0 H GLU A 41 -30.289 -6.268 2.506 1.00 0.00 H new ATOM 0 HA GLU A 41 -29.440 -7.100 5.208 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -29.415 -7.964 2.326 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -28.030 -8.509 3.251 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -29.715 -10.222 3.522 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -29.674 -9.350 5.041 1.00 0.00 H new ATOM 653 N LEU A 42 -27.370 -5.483 3.275 1.00 0.00 N ATOM 654 CA LEU A 42 -26.031 -4.824 3.308 1.00 0.00 C ATOM 655 C LEU A 42 -26.076 -3.556 4.167 1.00 0.00 C ATOM 656 O LEU A 42 -25.488 -3.493 5.227 1.00 0.00 O ATOM 657 CB LEU A 42 -25.724 -4.473 1.851 1.00 0.00 C ATOM 658 CG LEU A 42 -24.754 -5.503 1.272 1.00 0.00 C ATOM 659 CD1 LEU A 42 -25.538 -6.711 0.755 1.00 0.00 C ATOM 660 CD2 LEU A 42 -23.972 -4.873 0.117 1.00 0.00 C ATOM 0 H LEU A 42 -27.929 -5.292 2.443 1.00 0.00 H new ATOM 0 HA LEU A 42 -25.269 -5.471 3.743 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -26.645 -4.457 1.268 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -25.290 -3.475 1.790 1.00 0.00 H new ATOM 0 HG LEU A 42 -24.061 -5.825 2.049 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -24.846 -7.445 0.342 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -26.097 -7.161 1.576 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -26.231 -6.389 -0.022 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -23.280 -5.607 -0.297 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -24.666 -4.551 -0.659 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -23.412 -4.012 0.483 1.00 0.00 H new ATOM 672 N GLU A 43 -26.766 -2.546 3.714 1.00 0.00 N ATOM 673 CA GLU A 43 -26.843 -1.283 4.505 1.00 0.00 C ATOM 674 C GLU A 43 -27.866 -1.422 5.634 1.00 0.00 C ATOM 675 O GLU A 43 -27.517 -1.528 6.793 1.00 0.00 O ATOM 676 CB GLU A 43 -27.289 -0.215 3.505 1.00 0.00 C ATOM 677 CG GLU A 43 -26.076 0.290 2.721 1.00 0.00 C ATOM 678 CD GLU A 43 -25.674 -0.751 1.675 1.00 0.00 C ATOM 679 OE1 GLU A 43 -26.484 -1.035 0.809 1.00 0.00 O ATOM 680 OE2 GLU A 43 -24.563 -1.248 1.759 1.00 0.00 O ATOM 0 H GLU A 43 -27.279 -2.539 2.833 1.00 0.00 H new ATOM 0 HA GLU A 43 -25.891 -1.033 4.972 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -28.030 -0.629 2.821 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -27.766 0.613 4.030 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -26.312 1.237 2.235 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -25.244 0.479 3.400 1.00 0.00 H new ATOM 687 N GLY A 44 -29.130 -1.424 5.307 1.00 0.00 N ATOM 688 CA GLY A 44 -30.172 -1.556 6.365 1.00 0.00 C ATOM 689 C GLY A 44 -31.413 -0.758 5.964 1.00 0.00 C ATOM 690 O GLY A 44 -32.044 -0.120 6.783 1.00 0.00 O ATOM 0 H GLY A 44 -29.486 -1.340 4.355 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -30.431 -2.605 6.505 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -29.786 -1.193 7.317 1.00 0.00 H new ATOM 694 N ILE A 45 -31.771 -0.788 4.708 1.00 0.00 N ATOM 695 CA ILE A 45 -32.974 -0.030 4.258 1.00 0.00 C ATOM 696 C ILE A 45 -34.149 -0.987 4.044 1.00 0.00 C ATOM 697 O ILE A 45 -34.176 -1.751 3.100 1.00 0.00 O ATOM 698 CB ILE A 45 -32.561 0.618 2.936 1.00 0.00 C ATOM 699 CG1 ILE A 45 -31.364 1.541 3.176 1.00 0.00 C ATOM 700 CG2 ILE A 45 -33.729 1.432 2.379 1.00 0.00 C ATOM 701 CD1 ILE A 45 -30.443 1.510 1.955 1.00 0.00 C ATOM 0 H ILE A 45 -31.283 -1.304 3.976 1.00 0.00 H new ATOM 0 HA ILE A 45 -33.296 0.710 4.991 1.00 0.00 H new ATOM 0 HB ILE A 45 -32.287 -0.157 2.220 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -31.707 2.559 3.360 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -30.818 1.223 4.064 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -33.434 1.894 1.437 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -34.582 0.775 2.210 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -34.005 2.208 3.093 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -29.590 2.167 2.126 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -30.089 0.492 1.792 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -30.992 1.849 1.076 1.00 0.00 H new ATOM 713 N GLN A 46 -35.120 -0.953 4.915 1.00 0.00 N ATOM 714 CA GLN A 46 -36.292 -1.862 4.763 1.00 0.00 C ATOM 715 C GLN A 46 -36.745 -1.902 3.301 1.00 0.00 C ATOM 716 O GLN A 46 -37.136 -2.934 2.791 1.00 0.00 O ATOM 717 CB GLN A 46 -37.382 -1.256 5.647 1.00 0.00 C ATOM 718 CG GLN A 46 -37.374 -1.945 7.013 1.00 0.00 C ATOM 719 CD GLN A 46 -37.901 -0.980 8.077 1.00 0.00 C ATOM 720 OE1 GLN A 46 -38.121 0.183 7.803 1.00 0.00 O ATOM 721 NE2 GLN A 46 -38.113 -1.417 9.288 1.00 0.00 N ATOM 0 H GLN A 46 -35.153 -0.335 5.726 1.00 0.00 H new ATOM 0 HA GLN A 46 -36.059 -2.887 5.050 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -37.214 -0.186 5.767 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -38.357 -1.375 5.174 1.00 0.00 H new ATOM 0 HG2 GLN A 46 -37.992 -2.842 6.983 1.00 0.00 H new ATOM 0 HG3 GLN A 46 -36.363 -2.263 7.265 1.00 0.00 H new ATOM 0 HE21 GLN A 46 -37.928 -2.394 9.517 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -38.464 -0.782 10.005 1.00 0.00 H new ATOM 730 N LYS A 47 -36.695 -0.789 2.623 1.00 0.00 N ATOM 731 CA LYS A 47 -37.123 -0.766 1.195 1.00 0.00 C ATOM 732 C LYS A 47 -36.467 0.407 0.462 1.00 0.00 C ATOM 733 O LYS A 47 -36.334 1.490 0.998 1.00 0.00 O ATOM 734 CB LYS A 47 -38.641 -0.586 1.240 1.00 0.00 C ATOM 735 CG LYS A 47 -38.986 0.629 2.104 1.00 0.00 C ATOM 736 CD LYS A 47 -40.440 0.529 2.571 1.00 0.00 C ATOM 737 CE LYS A 47 -41.200 1.787 2.145 1.00 0.00 C ATOM 738 NZ LYS A 47 -40.367 2.922 2.633 1.00 0.00 N ATOM 0 H LYS A 47 -36.376 0.106 2.995 1.00 0.00 H new ATOM 0 HA LYS A 47 -36.834 -1.673 0.664 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -39.032 -0.451 0.231 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -39.112 -1.481 1.647 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -38.319 0.677 2.965 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -38.838 1.547 1.535 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -40.911 -0.356 2.143 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -40.478 0.417 3.655 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -41.325 1.825 1.063 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -42.198 1.813 2.582 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -40.985 3.703 2.933 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -39.790 2.608 3.439 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -39.743 3.249 1.868 1.00 0.00 H new ATOM 752 N MET A 48 -36.055 0.202 -0.759 1.00 0.00 N ATOM 753 CA MET A 48 -35.409 1.306 -1.524 1.00 0.00 C ATOM 754 C MET A 48 -36.304 2.548 -1.514 1.00 0.00 C ATOM 755 O MET A 48 -37.265 2.639 -2.253 1.00 0.00 O ATOM 756 CB MET A 48 -35.256 0.766 -2.946 1.00 0.00 C ATOM 757 CG MET A 48 -34.534 -0.581 -2.905 1.00 0.00 C ATOM 758 SD MET A 48 -33.771 -0.906 -4.514 1.00 0.00 S ATOM 759 CE MET A 48 -32.610 0.481 -4.498 1.00 0.00 C ATOM 0 H MET A 48 -36.138 -0.683 -1.260 1.00 0.00 H new ATOM 0 HA MET A 48 -34.451 1.601 -1.096 1.00 0.00 H new ATOM 0 HB2 MET A 48 -36.236 0.652 -3.410 1.00 0.00 H new ATOM 0 HB3 MET A 48 -34.694 1.473 -3.557 1.00 0.00 H new ATOM 0 HG2 MET A 48 -33.773 -0.574 -2.125 1.00 0.00 H new ATOM 0 HG3 MET A 48 -35.238 -1.376 -2.657 1.00 0.00 H new ATOM 0 HE1 MET A 48 -31.734 0.229 -5.095 1.00 0.00 H new ATOM 0 HE2 MET A 48 -33.093 1.364 -4.916 1.00 0.00 H new ATOM 0 HE3 MET A 48 -32.303 0.687 -3.473 1.00 0.00 H new ATOM 769 N THR A 49 -35.999 3.504 -0.680 1.00 0.00 N ATOM 770 CA THR A 49 -36.835 4.739 -0.621 1.00 0.00 C ATOM 771 C THR A 49 -36.991 5.342 -2.021 1.00 0.00 C ATOM 772 O THR A 49 -36.242 5.037 -2.927 1.00 0.00 O ATOM 773 CB THR A 49 -36.066 5.693 0.294 1.00 0.00 C ATOM 774 OG1 THR A 49 -34.793 5.968 -0.275 1.00 0.00 O ATOM 775 CG2 THR A 49 -35.885 5.049 1.669 1.00 0.00 C ATOM 0 H THR A 49 -35.208 3.484 -0.037 1.00 0.00 H new ATOM 0 HA THR A 49 -37.840 4.540 -0.250 1.00 0.00 H new ATOM 0 HB THR A 49 -36.624 6.623 0.403 1.00 0.00 H new ATOM 0 HG1 THR A 49 -34.212 5.186 -0.169 1.00 0.00 H new ATOM 0 HG21 THR A 49 -35.337 5.730 2.320 1.00 0.00 H new ATOM 0 HG22 THR A 49 -36.862 4.839 2.104 1.00 0.00 H new ATOM 0 HG23 THR A 49 -35.327 4.119 1.564 1.00 0.00 H new ATOM 783 N GLU A 50 -37.962 6.196 -2.201 1.00 0.00 N ATOM 784 CA GLU A 50 -38.170 6.819 -3.541 1.00 0.00 C ATOM 785 C GLU A 50 -36.851 7.380 -4.077 1.00 0.00 C ATOM 786 O GLU A 50 -36.645 7.472 -5.271 1.00 0.00 O ATOM 787 CB GLU A 50 -39.174 7.947 -3.300 1.00 0.00 C ATOM 788 CG GLU A 50 -39.306 8.793 -4.567 1.00 0.00 C ATOM 789 CD GLU A 50 -40.782 9.112 -4.817 1.00 0.00 C ATOM 790 OE1 GLU A 50 -41.593 8.210 -4.681 1.00 0.00 O ATOM 791 OE2 GLU A 50 -41.075 10.251 -5.139 1.00 0.00 O ATOM 0 H GLU A 50 -38.620 6.489 -1.479 1.00 0.00 H new ATOM 0 HA GLU A 50 -38.530 6.101 -4.278 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -40.144 7.532 -3.024 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -38.845 8.569 -2.467 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -38.736 9.716 -4.461 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -38.889 8.257 -5.420 1.00 0.00 H new ATOM 798 N GLU A 51 -35.955 7.755 -3.207 1.00 0.00 N ATOM 799 CA GLU A 51 -34.650 8.309 -3.671 1.00 0.00 C ATOM 800 C GLU A 51 -33.744 7.181 -4.173 1.00 0.00 C ATOM 801 O GLU A 51 -33.047 7.323 -5.159 1.00 0.00 O ATOM 802 CB GLU A 51 -34.042 8.977 -2.437 1.00 0.00 C ATOM 803 CG GLU A 51 -33.607 10.401 -2.789 1.00 0.00 C ATOM 804 CD GLU A 51 -34.053 11.359 -1.683 1.00 0.00 C ATOM 805 OE1 GLU A 51 -33.648 11.153 -0.550 1.00 0.00 O ATOM 806 OE2 GLU A 51 -34.791 12.281 -1.986 1.00 0.00 O ATOM 0 H GLU A 51 -36.069 7.702 -2.195 1.00 0.00 H new ATOM 0 HA GLU A 51 -34.770 9.010 -4.497 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -34.770 8.998 -1.626 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -33.187 8.401 -2.083 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -32.524 10.443 -2.906 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -34.043 10.701 -3.742 1.00 0.00 H new ATOM 813 N HIS A 52 -33.749 6.061 -3.502 1.00 0.00 N ATOM 814 CA HIS A 52 -32.888 4.925 -3.939 1.00 0.00 C ATOM 815 C HIS A 52 -33.288 4.464 -5.344 1.00 0.00 C ATOM 816 O HIS A 52 -32.449 4.164 -6.171 1.00 0.00 O ATOM 817 CB HIS A 52 -33.144 3.818 -2.918 1.00 0.00 C ATOM 818 CG HIS A 52 -32.155 3.936 -1.791 1.00 0.00 C ATOM 819 ND1 HIS A 52 -32.546 4.258 -0.486 1.00 0.00 N ATOM 820 CD2 HIS A 52 -30.786 3.780 -1.749 1.00 0.00 C ATOM 821 CE1 HIS A 52 -31.434 4.285 0.278 1.00 0.00 C ATOM 822 NE2 HIS A 52 -30.366 4.002 -0.452 1.00 0.00 N ATOM 0 H HIS A 52 -34.312 5.884 -2.670 1.00 0.00 H new ATOM 0 HA HIS A 52 -31.835 5.201 -3.985 1.00 0.00 H new ATOM 0 HB2 HIS A 52 -34.161 3.892 -2.533 1.00 0.00 H new ATOM 0 HB3 HIS A 52 -33.054 2.842 -3.394 1.00 0.00 H new ATOM 0 HD2 HIS A 52 -30.151 3.528 -2.586 1.00 0.00 H new ATOM 0 HE1 HIS A 52 -31.417 4.506 1.335 1.00 0.00 H new ATOM 0 HE2 HIS A 52 -29.404 3.956 -0.116 1.00 0.00 H new ATOM 830 N TRP A 53 -34.562 4.403 -5.620 1.00 0.00 N ATOM 831 CA TRP A 53 -35.011 3.958 -6.970 1.00 0.00 C ATOM 832 C TRP A 53 -34.762 5.062 -8.002 1.00 0.00 C ATOM 833 O TRP A 53 -34.423 4.796 -9.138 1.00 0.00 O ATOM 834 CB TRP A 53 -36.509 3.688 -6.822 1.00 0.00 C ATOM 835 CG TRP A 53 -36.722 2.242 -6.515 1.00 0.00 C ATOM 836 CD1 TRP A 53 -37.575 1.763 -5.579 1.00 0.00 C ATOM 837 CD2 TRP A 53 -36.088 1.080 -7.124 1.00 0.00 C ATOM 838 NE1 TRP A 53 -37.505 0.381 -5.575 1.00 0.00 N ATOM 839 CE2 TRP A 53 -36.602 -0.087 -6.510 1.00 0.00 C ATOM 840 CE3 TRP A 53 -35.126 0.927 -8.140 1.00 0.00 C ATOM 841 CZ2 TRP A 53 -36.174 -1.361 -6.891 1.00 0.00 C ATOM 842 CZ3 TRP A 53 -34.693 -0.352 -8.526 1.00 0.00 C ATOM 843 CH2 TRP A 53 -35.217 -1.494 -7.902 1.00 0.00 C ATOM 0 H TRP A 53 -35.311 4.642 -4.970 1.00 0.00 H new ATOM 0 HA TRP A 53 -34.471 3.076 -7.314 1.00 0.00 H new ATOM 0 HB2 TRP A 53 -36.925 4.306 -6.026 1.00 0.00 H new ATOM 0 HB3 TRP A 53 -37.031 3.957 -7.740 1.00 0.00 H new ATOM 0 HD1 TRP A 53 -38.207 2.362 -4.940 1.00 0.00 H new ATOM 0 HE1 TRP A 53 -38.053 -0.218 -4.958 1.00 0.00 H new ATOM 0 HE3 TRP A 53 -34.718 1.800 -8.627 1.00 0.00 H new ATOM 0 HZ2 TRP A 53 -36.580 -2.238 -6.408 1.00 0.00 H new ATOM 0 HZ3 TRP A 53 -33.954 -0.457 -9.306 1.00 0.00 H new ATOM 0 HH2 TRP A 53 -34.881 -2.476 -8.202 1.00 0.00 H new ATOM 854 N LYS A 54 -34.927 6.297 -7.617 1.00 0.00 N ATOM 855 CA LYS A 54 -34.699 7.413 -8.577 1.00 0.00 C ATOM 856 C LYS A 54 -33.262 7.370 -9.107 1.00 0.00 C ATOM 857 O LYS A 54 -33.022 7.502 -10.291 1.00 0.00 O ATOM 858 CB LYS A 54 -34.931 8.688 -7.766 1.00 0.00 C ATOM 859 CG LYS A 54 -35.895 9.606 -8.521 1.00 0.00 C ATOM 860 CD LYS A 54 -37.334 9.286 -8.109 1.00 0.00 C ATOM 861 CE LYS A 54 -38.202 10.535 -8.276 1.00 0.00 C ATOM 862 NZ LYS A 54 -39.391 10.075 -9.046 1.00 0.00 N ATOM 0 H LYS A 54 -35.210 6.582 -6.679 1.00 0.00 H new ATOM 0 HA LYS A 54 -35.360 7.354 -9.442 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -35.341 8.439 -6.787 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -33.984 9.200 -7.595 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -35.667 10.649 -8.303 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -35.775 9.472 -9.596 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -37.726 8.473 -8.720 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -37.360 8.948 -7.073 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -38.492 10.947 -7.309 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -37.666 11.320 -8.809 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -40.035 10.876 -9.201 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -39.084 9.694 -9.964 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -39.885 9.332 -8.511 1.00 0.00 H new ATOM 876 N LEU A 55 -32.307 7.185 -8.238 1.00 0.00 N ATOM 877 CA LEU A 55 -30.887 7.134 -8.690 1.00 0.00 C ATOM 878 C LEU A 55 -30.610 5.820 -9.428 1.00 0.00 C ATOM 879 O LEU A 55 -30.206 5.814 -10.573 1.00 0.00 O ATOM 880 CB LEU A 55 -30.060 7.213 -7.407 1.00 0.00 C ATOM 881 CG LEU A 55 -29.575 8.649 -7.199 1.00 0.00 C ATOM 882 CD1 LEU A 55 -30.775 9.598 -7.197 1.00 0.00 C ATOM 883 CD2 LEU A 55 -28.845 8.749 -5.858 1.00 0.00 C ATOM 0 H LEU A 55 -32.448 7.067 -7.235 1.00 0.00 H new ATOM 0 HA LEU A 55 -30.646 7.941 -9.381 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -30.660 6.894 -6.555 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -29.208 6.536 -7.469 1.00 0.00 H new ATOM 0 HG LEU A 55 -28.896 8.924 -8.006 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -30.430 10.621 -7.049 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -31.297 9.526 -8.151 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -31.454 9.324 -6.390 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -28.498 9.771 -5.708 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -29.525 8.474 -5.052 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -27.990 8.073 -5.858 1.00 0.00 H new ATOM 895 N VAL A 56 -30.823 4.708 -8.779 1.00 0.00 N ATOM 896 CA VAL A 56 -30.570 3.397 -9.442 1.00 0.00 C ATOM 897 C VAL A 56 -31.191 3.377 -10.841 1.00 0.00 C ATOM 898 O VAL A 56 -30.702 2.723 -11.740 1.00 0.00 O ATOM 899 CB VAL A 56 -31.244 2.362 -8.542 1.00 0.00 C ATOM 900 CG1 VAL A 56 -31.175 0.986 -9.205 1.00 0.00 C ATOM 901 CG2 VAL A 56 -30.525 2.315 -7.192 1.00 0.00 C ATOM 0 H VAL A 56 -31.161 4.650 -7.818 1.00 0.00 H new ATOM 0 HA VAL A 56 -29.506 3.199 -9.567 1.00 0.00 H new ATOM 0 HB VAL A 56 -32.287 2.639 -8.389 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -31.656 0.248 -8.563 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -31.688 1.019 -10.166 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -30.132 0.708 -9.359 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -31.005 1.577 -6.550 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -29.482 2.039 -7.345 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -30.575 3.296 -6.719 1.00 0.00 H new ATOM 911 N LYS A 57 -32.270 4.088 -11.033 1.00 0.00 N ATOM 912 CA LYS A 57 -32.921 4.104 -12.374 1.00 0.00 C ATOM 913 C LYS A 57 -32.131 4.994 -13.338 1.00 0.00 C ATOM 914 O LYS A 57 -31.785 4.588 -14.429 1.00 0.00 O ATOM 915 CB LYS A 57 -34.316 4.681 -12.129 1.00 0.00 C ATOM 916 CG LYS A 57 -35.313 3.537 -11.932 1.00 0.00 C ATOM 917 CD LYS A 57 -36.722 4.021 -12.278 1.00 0.00 C ATOM 918 CE LYS A 57 -37.432 2.961 -13.122 1.00 0.00 C ATOM 919 NZ LYS A 57 -38.881 3.141 -12.828 1.00 0.00 N ATOM 0 H LYS A 57 -32.727 4.657 -10.321 1.00 0.00 H new ATOM 0 HA LYS A 57 -32.963 3.112 -12.824 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -34.306 5.324 -11.249 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -34.619 5.300 -12.973 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -35.042 2.692 -12.565 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -35.281 3.186 -10.900 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -37.287 4.213 -11.366 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -36.671 4.962 -12.825 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -37.225 3.098 -14.183 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -37.098 1.958 -12.859 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -39.434 2.448 -13.371 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -39.049 2.998 -11.812 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -39.173 4.103 -13.095 1.00 0.00 H new ATOM 933 N TYR A 58 -31.845 6.204 -12.944 1.00 0.00 N ATOM 934 CA TYR A 58 -31.079 7.118 -13.841 1.00 0.00 C ATOM 935 C TYR A 58 -29.793 6.437 -14.318 1.00 0.00 C ATOM 936 O TYR A 58 -29.477 6.439 -15.492 1.00 0.00 O ATOM 937 CB TYR A 58 -30.750 8.335 -12.978 1.00 0.00 C ATOM 938 CG TYR A 58 -30.286 9.468 -13.862 1.00 0.00 C ATOM 939 CD1 TYR A 58 -31.212 10.168 -14.646 1.00 0.00 C ATOM 940 CD2 TYR A 58 -28.930 9.820 -13.897 1.00 0.00 C ATOM 941 CE1 TYR A 58 -30.782 11.220 -15.466 1.00 0.00 C ATOM 942 CE2 TYR A 58 -28.500 10.871 -14.718 1.00 0.00 C ATOM 943 CZ TYR A 58 -29.426 11.572 -15.502 1.00 0.00 C ATOM 944 OH TYR A 58 -29.003 12.607 -16.310 1.00 0.00 O ATOM 0 H TYR A 58 -32.108 6.600 -12.041 1.00 0.00 H new ATOM 0 HA TYR A 58 -31.644 7.390 -14.732 1.00 0.00 H new ATOM 0 HB2 TYR A 58 -31.629 8.639 -12.410 1.00 0.00 H new ATOM 0 HB3 TYR A 58 -29.974 8.083 -12.255 1.00 0.00 H new ATOM 0 HD1 TYR A 58 -32.257 9.897 -14.619 1.00 0.00 H new ATOM 0 HD2 TYR A 58 -28.216 9.281 -13.291 1.00 0.00 H new ATOM 0 HE1 TYR A 58 -31.496 11.760 -16.070 1.00 0.00 H new ATOM 0 HE2 TYR A 58 -27.455 11.141 -14.747 1.00 0.00 H new ATOM 0 HH TYR A 58 -28.034 12.721 -16.216 1.00 0.00 H new ATOM 954 N LEU A 59 -29.048 5.859 -13.418 1.00 0.00 N ATOM 955 CA LEU A 59 -27.781 5.182 -13.818 1.00 0.00 C ATOM 956 C LEU A 59 -28.083 3.927 -14.642 1.00 0.00 C ATOM 957 O LEU A 59 -27.449 3.665 -15.644 1.00 0.00 O ATOM 958 CB LEU A 59 -27.103 4.808 -12.498 1.00 0.00 C ATOM 959 CG LEU A 59 -25.678 4.328 -12.773 1.00 0.00 C ATOM 960 CD1 LEU A 59 -24.716 4.992 -11.786 1.00 0.00 C ATOM 961 CD2 LEU A 59 -25.614 2.808 -12.603 1.00 0.00 C ATOM 0 H LEU A 59 -29.261 5.826 -12.421 1.00 0.00 H new ATOM 0 HA LEU A 59 -27.150 5.819 -14.437 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -27.085 5.669 -11.830 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -27.671 4.025 -11.995 1.00 0.00 H new ATOM 0 HG LEU A 59 -25.394 4.594 -13.791 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -23.700 4.650 -11.982 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -24.763 6.075 -11.904 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -24.998 4.725 -10.768 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -24.599 2.462 -12.798 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -25.897 2.544 -11.584 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -26.300 2.334 -13.305 1.00 0.00 H new ATOM 973 N ARG A 60 -29.044 3.149 -14.226 1.00 0.00 N ATOM 974 CA ARG A 60 -29.383 1.910 -14.985 1.00 0.00 C ATOM 975 C ARG A 60 -29.570 2.228 -16.471 1.00 0.00 C ATOM 976 O ARG A 60 -29.157 1.477 -17.332 1.00 0.00 O ATOM 977 CB ARG A 60 -30.693 1.416 -14.373 1.00 0.00 C ATOM 978 CG ARG A 60 -31.098 0.093 -15.025 1.00 0.00 C ATOM 979 CD ARG A 60 -32.388 -0.421 -14.382 1.00 0.00 C ATOM 980 NE ARG A 60 -33.471 0.413 -14.973 1.00 0.00 N ATOM 981 CZ ARG A 60 -34.658 -0.094 -15.158 1.00 0.00 C ATOM 982 NH1 ARG A 60 -34.796 -1.198 -15.841 1.00 0.00 N ATOM 983 NH2 ARG A 60 -35.708 0.501 -14.660 1.00 0.00 N ATOM 0 H ARG A 60 -29.610 3.317 -13.394 1.00 0.00 H new ATOM 0 HA ARG A 60 -28.594 1.160 -14.921 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -30.576 1.282 -13.298 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -31.477 2.159 -14.518 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -31.244 0.233 -16.096 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -30.302 -0.642 -14.905 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -32.542 -1.478 -14.597 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -32.357 -0.317 -13.297 1.00 0.00 H new ATOM 0 HE ARG A 60 -33.284 1.381 -15.233 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -33.976 -1.663 -16.229 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -35.724 -1.595 -15.986 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -35.600 1.363 -14.126 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -36.636 0.104 -14.805 1.00 0.00 H new ATOM 997 N GLU A 61 -30.189 3.335 -16.779 1.00 0.00 N ATOM 998 CA GLU A 61 -30.400 3.694 -18.211 1.00 0.00 C ATOM 999 C GLU A 61 -29.077 3.609 -18.978 1.00 0.00 C ATOM 1000 O GLU A 61 -28.967 2.920 -19.971 1.00 0.00 O ATOM 1001 CB GLU A 61 -30.915 5.134 -18.188 1.00 0.00 C ATOM 1002 CG GLU A 61 -31.138 5.619 -19.622 1.00 0.00 C ATOM 1003 CD GLU A 61 -32.550 6.194 -19.754 1.00 0.00 C ATOM 1004 OE1 GLU A 61 -33.488 5.492 -19.415 1.00 0.00 O ATOM 1005 OE2 GLU A 61 -32.669 7.327 -20.190 1.00 0.00 O ATOM 0 H GLU A 61 -30.557 4.005 -16.103 1.00 0.00 H new ATOM 0 HA GLU A 61 -31.098 3.020 -18.707 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -31.847 5.189 -17.625 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -30.198 5.780 -17.682 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -30.399 6.378 -19.879 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -31.003 4.794 -20.321 1.00 0.00 H new ATOM 1012 N TYR A 62 -28.071 4.305 -18.522 1.00 0.00 N ATOM 1013 CA TYR A 62 -26.756 4.263 -19.224 1.00 0.00 C ATOM 1014 C TYR A 62 -26.132 2.871 -19.090 1.00 0.00 C ATOM 1015 O TYR A 62 -25.360 2.444 -19.925 1.00 0.00 O ATOM 1016 CB TYR A 62 -25.894 5.308 -18.514 1.00 0.00 C ATOM 1017 CG TYR A 62 -25.011 6.003 -19.523 1.00 0.00 C ATOM 1018 CD1 TYR A 62 -24.159 5.254 -20.344 1.00 0.00 C ATOM 1019 CD2 TYR A 62 -25.045 7.399 -19.638 1.00 0.00 C ATOM 1020 CE1 TYR A 62 -23.340 5.901 -21.281 1.00 0.00 C ATOM 1021 CE2 TYR A 62 -24.226 8.047 -20.572 1.00 0.00 C ATOM 1022 CZ TYR A 62 -23.374 7.297 -21.394 1.00 0.00 C ATOM 1023 OH TYR A 62 -22.568 7.934 -22.315 1.00 0.00 O ATOM 0 H TYR A 62 -28.103 4.900 -17.694 1.00 0.00 H new ATOM 0 HA TYR A 62 -26.849 4.469 -20.290 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -26.529 6.036 -18.008 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -25.283 4.831 -17.748 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -24.133 4.178 -20.256 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -25.703 7.976 -19.006 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -22.684 5.323 -21.915 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -24.251 9.123 -20.658 1.00 0.00 H new ATOM 0 HH TYR A 62 -22.715 8.902 -22.264 1.00 0.00 H new ATOM 1033 N TRP A 63 -26.461 2.163 -18.045 1.00 0.00 N ATOM 1034 CA TRP A 63 -25.887 0.799 -17.858 1.00 0.00 C ATOM 1035 C TRP A 63 -26.467 -0.167 -18.893 1.00 0.00 C ATOM 1036 O TRP A 63 -25.889 -1.193 -19.192 1.00 0.00 O ATOM 1037 CB TRP A 63 -26.303 0.386 -16.446 1.00 0.00 C ATOM 1038 CG TRP A 63 -26.019 -1.068 -16.246 1.00 0.00 C ATOM 1039 CD1 TRP A 63 -24.796 -1.594 -16.000 1.00 0.00 C ATOM 1040 CD2 TRP A 63 -26.950 -2.188 -16.272 1.00 0.00 C ATOM 1041 NE1 TRP A 63 -24.917 -2.966 -15.873 1.00 0.00 N ATOM 1042 CE2 TRP A 63 -26.224 -3.381 -16.031 1.00 0.00 C ATOM 1043 CE3 TRP A 63 -28.339 -2.286 -16.478 1.00 0.00 C ATOM 1044 CZ2 TRP A 63 -26.857 -4.625 -15.997 1.00 0.00 C ATOM 1045 CZ3 TRP A 63 -28.979 -3.537 -16.443 1.00 0.00 C ATOM 1046 CH2 TRP A 63 -28.238 -4.703 -16.204 1.00 0.00 C ATOM 0 H TRP A 63 -27.102 2.469 -17.313 1.00 0.00 H new ATOM 0 HA TRP A 63 -24.805 0.786 -17.985 1.00 0.00 H new ATOM 0 HB2 TRP A 63 -25.761 0.978 -15.708 1.00 0.00 H new ATOM 0 HB3 TRP A 63 -27.364 0.584 -16.296 1.00 0.00 H new ATOM 0 HD1 TRP A 63 -23.876 -1.034 -15.917 1.00 0.00 H new ATOM 0 HE1 TRP A 63 -24.136 -3.594 -15.685 1.00 0.00 H new ATOM 0 HE3 TRP A 63 -28.917 -1.393 -16.664 1.00 0.00 H new ATOM 0 HZ2 TRP A 63 -26.284 -5.521 -15.812 1.00 0.00 H new ATOM 0 HZ3 TRP A 63 -30.046 -3.600 -16.601 1.00 0.00 H new ATOM 0 HH2 TRP A 63 -28.734 -5.662 -16.180 1.00 0.00 H new ATOM 1057 N GLU A 64 -27.605 0.153 -19.446 1.00 0.00 N ATOM 1058 CA GLU A 64 -28.220 -0.746 -20.463 1.00 0.00 C ATOM 1059 C GLU A 64 -27.497 -0.598 -21.806 1.00 0.00 C ATOM 1060 O GLU A 64 -27.606 -1.438 -22.676 1.00 0.00 O ATOM 1061 CB GLU A 64 -29.671 -0.281 -20.582 1.00 0.00 C ATOM 1062 CG GLU A 64 -30.608 -1.465 -20.338 1.00 0.00 C ATOM 1063 CD GLU A 64 -31.967 -1.184 -20.984 1.00 0.00 C ATOM 1064 OE1 GLU A 64 -32.041 -1.225 -22.201 1.00 0.00 O ATOM 1065 OE2 GLU A 64 -32.909 -0.932 -20.251 1.00 0.00 O ATOM 0 H GLU A 64 -28.136 0.999 -19.237 1.00 0.00 H new ATOM 0 HA GLU A 64 -28.152 -1.796 -20.179 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -29.871 0.510 -19.859 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -29.849 0.140 -21.572 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -30.177 -2.375 -20.755 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -30.730 -1.631 -19.268 1.00 0.00 H new ATOM 1072 N THR A 65 -26.759 0.464 -21.977 1.00 0.00 N ATOM 1073 CA THR A 65 -26.030 0.665 -23.263 1.00 0.00 C ATOM 1074 C THR A 65 -24.804 -0.250 -23.323 1.00 0.00 C ATOM 1075 O THR A 65 -24.763 -1.201 -24.078 1.00 0.00 O ATOM 1076 CB THR A 65 -25.605 2.135 -23.251 1.00 0.00 C ATOM 1077 OG1 THR A 65 -26.759 2.960 -23.190 1.00 0.00 O ATOM 1078 CG2 THR A 65 -24.816 2.449 -24.523 1.00 0.00 C ATOM 0 H THR A 65 -26.629 1.201 -21.284 1.00 0.00 H new ATOM 0 HA THR A 65 -26.646 0.427 -24.130 1.00 0.00 H new ATOM 0 HB THR A 65 -24.977 2.325 -22.381 1.00 0.00 H new ATOM 0 HG1 THR A 65 -26.488 3.902 -23.181 1.00 0.00 H new ATOM 0 HG21 THR A 65 -24.513 3.496 -24.514 1.00 0.00 H new ATOM 0 HG22 THR A 65 -23.930 1.816 -24.567 1.00 0.00 H new ATOM 0 HG23 THR A 65 -25.442 2.259 -25.395 1.00 0.00 H new ATOM 1086 N PHE A 66 -23.803 0.031 -22.534 1.00 0.00 N ATOM 1087 CA PHE A 66 -22.582 -0.824 -22.548 1.00 0.00 C ATOM 1088 C PHE A 66 -22.271 -1.327 -21.136 1.00 0.00 C ATOM 1089 O PHE A 66 -21.129 -1.547 -20.781 1.00 0.00 O ATOM 1090 CB PHE A 66 -21.465 0.091 -23.051 1.00 0.00 C ATOM 1091 CG PHE A 66 -21.288 -0.100 -24.538 1.00 0.00 C ATOM 1092 CD1 PHE A 66 -20.556 -1.192 -25.023 1.00 0.00 C ATOM 1093 CD2 PHE A 66 -21.857 0.815 -25.434 1.00 0.00 C ATOM 1094 CE1 PHE A 66 -20.393 -1.369 -26.403 1.00 0.00 C ATOM 1095 CE2 PHE A 66 -21.694 0.639 -26.814 1.00 0.00 C ATOM 1096 CZ PHE A 66 -20.962 -0.453 -27.299 1.00 0.00 C ATOM 0 H PHE A 66 -23.778 0.814 -21.881 1.00 0.00 H new ATOM 0 HA PHE A 66 -22.702 -1.705 -23.178 1.00 0.00 H new ATOM 0 HB2 PHE A 66 -21.707 1.131 -22.834 1.00 0.00 H new ATOM 0 HB3 PHE A 66 -20.534 -0.135 -22.531 1.00 0.00 H new ATOM 0 HD1 PHE A 66 -20.117 -1.897 -24.333 1.00 0.00 H new ATOM 0 HD2 PHE A 66 -22.422 1.656 -25.060 1.00 0.00 H new ATOM 0 HE1 PHE A 66 -19.829 -2.211 -26.777 1.00 0.00 H new ATOM 0 HE2 PHE A 66 -22.132 1.345 -27.504 1.00 0.00 H new ATOM 0 HZ PHE A 66 -20.836 -0.589 -28.363 1.00 0.00 H new ATOM 1106 N GLY A 67 -23.278 -1.513 -20.327 1.00 0.00 N ATOM 1107 CA GLY A 67 -23.041 -2.001 -18.940 1.00 0.00 C ATOM 1108 C GLY A 67 -21.856 -1.251 -18.328 1.00 0.00 C ATOM 1109 O GLY A 67 -20.748 -1.748 -18.291 1.00 0.00 O ATOM 0 H GLY A 67 -24.255 -1.348 -20.567 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -23.933 -1.849 -18.333 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -22.841 -3.072 -18.950 1.00 0.00 H new ATOM 1113 N THR A 68 -22.080 -0.058 -17.850 1.00 0.00 N ATOM 1114 CA THR A 68 -20.965 0.723 -17.242 1.00 0.00 C ATOM 1115 C THR A 68 -21.453 1.450 -15.986 1.00 0.00 C ATOM 1116 O THR A 68 -22.594 1.324 -15.588 1.00 0.00 O ATOM 1117 CB THR A 68 -20.551 1.729 -18.316 1.00 0.00 C ATOM 1118 OG1 THR A 68 -21.579 1.831 -19.290 1.00 0.00 O ATOM 1119 CG2 THR A 68 -19.256 1.260 -18.984 1.00 0.00 C ATOM 0 H THR A 68 -22.986 0.410 -17.854 1.00 0.00 H new ATOM 0 HA THR A 68 -20.134 0.087 -16.939 1.00 0.00 H new ATOM 0 HB THR A 68 -20.388 2.704 -17.857 1.00 0.00 H new ATOM 0 HG1 THR A 68 -21.315 2.477 -19.978 1.00 0.00 H new ATOM 0 HG21 THR A 68 -18.961 1.977 -19.750 1.00 0.00 H new ATOM 0 HG22 THR A 68 -18.467 1.184 -18.235 1.00 0.00 H new ATOM 0 HG23 THR A 68 -19.416 0.285 -19.443 1.00 0.00 H new ATOM 1127 N CYS A 69 -20.598 2.211 -15.359 1.00 0.00 N ATOM 1128 CA CYS A 69 -21.016 2.945 -14.131 1.00 0.00 C ATOM 1129 C CYS A 69 -20.412 4.353 -14.124 1.00 0.00 C ATOM 1130 O CYS A 69 -19.303 4.551 -13.669 1.00 0.00 O ATOM 1131 CB CYS A 69 -20.464 2.119 -12.968 1.00 0.00 C ATOM 1132 SG CYS A 69 -21.289 2.609 -11.434 1.00 0.00 S ATOM 0 H CYS A 69 -19.629 2.356 -15.644 1.00 0.00 H new ATOM 0 HA CYS A 69 -22.098 3.064 -14.069 1.00 0.00 H new ATOM 0 HB2 CYS A 69 -20.622 1.057 -13.155 1.00 0.00 H new ATOM 0 HB3 CYS A 69 -19.388 2.270 -12.879 1.00 0.00 H new ATOM 1137 N PRO A 70 -21.169 5.284 -14.636 1.00 0.00 N ATOM 1138 CA PRO A 70 -20.710 6.694 -14.695 1.00 0.00 C ATOM 1139 C PRO A 70 -20.720 7.321 -13.298 1.00 0.00 C ATOM 1140 O PRO A 70 -21.418 6.863 -12.416 1.00 0.00 O ATOM 1141 CB PRO A 70 -21.737 7.366 -15.603 1.00 0.00 C ATOM 1142 CG PRO A 70 -22.966 6.524 -15.485 1.00 0.00 C ATOM 1143 CD PRO A 70 -22.511 5.116 -15.200 1.00 0.00 C ATOM 0 HA PRO A 70 -19.690 6.798 -15.064 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -21.930 8.392 -15.289 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -21.385 7.408 -16.634 1.00 0.00 H new ATOM 0 HG2 PRO A 70 -23.609 6.891 -14.685 1.00 0.00 H new ATOM 0 HG3 PRO A 70 -23.549 6.562 -16.405 1.00 0.00 H new ATOM 0 HD2 PRO A 70 -23.179 4.615 -14.499 1.00 0.00 H new ATOM 0 HD3 PRO A 70 -22.490 4.512 -16.107 1.00 0.00 H new ATOM 1151 N PRO A 71 -19.940 8.357 -13.149 1.00 0.00 N ATOM 1152 CA PRO A 71 -19.852 9.065 -11.847 1.00 0.00 C ATOM 1153 C PRO A 71 -21.127 9.873 -11.590 1.00 0.00 C ATOM 1154 O PRO A 71 -22.164 9.614 -12.166 1.00 0.00 O ATOM 1155 CB PRO A 71 -18.648 9.988 -12.025 1.00 0.00 C ATOM 1156 CG PRO A 71 -18.537 10.200 -13.500 1.00 0.00 C ATOM 1157 CD PRO A 71 -19.076 8.960 -14.168 1.00 0.00 C ATOM 0 HA PRO A 71 -19.745 8.391 -10.997 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -18.794 10.932 -11.501 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -17.742 9.536 -11.622 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -19.103 11.080 -13.806 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -17.500 10.372 -13.787 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -19.635 9.204 -15.072 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -18.273 8.284 -14.462 1.00 0.00 H new ATOM 1165 N ILE A 72 -21.058 10.850 -10.727 1.00 0.00 N ATOM 1166 CA ILE A 72 -22.269 11.671 -10.434 1.00 0.00 C ATOM 1167 C ILE A 72 -21.967 13.157 -10.653 1.00 0.00 C ATOM 1168 O ILE A 72 -22.300 13.993 -9.836 1.00 0.00 O ATOM 1169 CB ILE A 72 -22.584 11.400 -8.963 1.00 0.00 C ATOM 1170 CG1 ILE A 72 -23.913 12.066 -8.598 1.00 0.00 C ATOM 1171 CG2 ILE A 72 -21.469 11.974 -8.087 1.00 0.00 C ATOM 1172 CD1 ILE A 72 -24.581 11.286 -7.464 1.00 0.00 C ATOM 0 H ILE A 72 -20.218 11.115 -10.213 1.00 0.00 H new ATOM 0 HA ILE A 72 -23.107 11.418 -11.084 1.00 0.00 H new ATOM 0 HB ILE A 72 -22.657 10.325 -8.798 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -23.743 13.098 -8.292 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -24.568 12.095 -9.469 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -21.694 11.780 -7.038 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -20.522 11.502 -8.348 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -21.395 13.049 -8.250 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -25.527 11.760 -7.204 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -24.765 10.261 -7.787 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -23.927 11.280 -6.592 1.00 0.00 H new ATOM 1184 N LYS A 73 -21.342 13.492 -11.748 1.00 0.00 N ATOM 1185 CA LYS A 73 -21.023 14.924 -12.014 1.00 0.00 C ATOM 1186 C LYS A 73 -22.150 15.575 -12.820 1.00 0.00 C ATOM 1187 O LYS A 73 -23.023 16.221 -12.273 1.00 0.00 O ATOM 1188 CB LYS A 73 -19.728 14.897 -12.829 1.00 0.00 C ATOM 1189 CG LYS A 73 -18.535 15.125 -11.900 1.00 0.00 C ATOM 1190 CD LYS A 73 -18.191 13.819 -11.181 1.00 0.00 C ATOM 1191 CE LYS A 73 -17.120 13.065 -11.973 1.00 0.00 C ATOM 1192 NZ LYS A 73 -16.336 12.322 -10.947 1.00 0.00 N ATOM 0 H LYS A 73 -21.039 12.838 -12.469 1.00 0.00 H new ATOM 0 HA LYS A 73 -20.915 15.501 -11.095 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -19.627 13.939 -13.339 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -19.755 15.667 -13.600 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -17.676 15.474 -12.473 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -18.770 15.902 -11.173 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -17.832 14.030 -10.174 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -19.084 13.202 -11.078 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -17.569 12.384 -12.696 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -16.486 13.752 -12.533 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -15.581 11.779 -11.413 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -15.915 12.996 -10.277 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -16.964 11.671 -10.434 1.00 0.00 H new ATOM 1206 N MET A 74 -22.140 15.411 -14.114 1.00 0.00 N ATOM 1207 CA MET A 74 -23.214 16.022 -14.951 1.00 0.00 C ATOM 1208 C MET A 74 -24.579 15.461 -14.548 1.00 0.00 C ATOM 1209 O MET A 74 -25.611 16.011 -14.880 1.00 0.00 O ATOM 1210 CB MET A 74 -22.871 15.622 -16.388 1.00 0.00 C ATOM 1211 CG MET A 74 -23.140 14.129 -16.580 1.00 0.00 C ATOM 1212 SD MET A 74 -24.612 13.909 -17.610 1.00 0.00 S ATOM 1213 CE MET A 74 -23.797 13.077 -18.995 1.00 0.00 C ATOM 0 H MET A 74 -21.436 14.881 -14.629 1.00 0.00 H new ATOM 0 HA MET A 74 -23.268 17.104 -14.831 1.00 0.00 H new ATOM 0 HB2 MET A 74 -23.468 16.203 -17.091 1.00 0.00 H new ATOM 0 HB3 MET A 74 -21.825 15.844 -16.599 1.00 0.00 H new ATOM 0 HG2 MET A 74 -22.280 13.651 -17.049 1.00 0.00 H new ATOM 0 HG3 MET A 74 -23.284 13.647 -15.613 1.00 0.00 H new ATOM 0 HE1 MET A 74 -24.534 12.843 -19.764 1.00 0.00 H new ATOM 0 HE2 MET A 74 -23.032 13.731 -19.413 1.00 0.00 H new ATOM 0 HE3 MET A 74 -23.334 12.155 -18.644 1.00 0.00 H new ATOM 1223 N VAL A 75 -24.594 14.368 -13.833 1.00 0.00 N ATOM 1224 CA VAL A 75 -25.894 13.773 -13.409 1.00 0.00 C ATOM 1225 C VAL A 75 -26.560 14.659 -12.353 1.00 0.00 C ATOM 1226 O VAL A 75 -27.758 14.868 -12.372 1.00 0.00 O ATOM 1227 CB VAL A 75 -25.531 12.412 -12.816 1.00 0.00 C ATOM 1228 CG1 VAL A 75 -26.800 11.714 -12.324 1.00 0.00 C ATOM 1229 CG2 VAL A 75 -24.862 11.551 -13.891 1.00 0.00 C ATOM 0 H VAL A 75 -23.764 13.862 -13.525 1.00 0.00 H new ATOM 0 HA VAL A 75 -26.597 13.682 -14.237 1.00 0.00 H new ATOM 0 HB VAL A 75 -24.845 12.551 -11.980 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -26.541 10.743 -11.901 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -27.279 12.326 -11.560 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -27.486 11.574 -13.160 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -24.602 10.580 -13.470 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -25.549 11.413 -14.726 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -23.958 12.047 -14.244 1.00 0.00 H new ATOM 1239 N THR A 76 -25.796 15.181 -11.434 1.00 0.00 N ATOM 1240 CA THR A 76 -26.389 16.053 -10.380 1.00 0.00 C ATOM 1241 C THR A 76 -27.188 17.190 -11.024 1.00 0.00 C ATOM 1242 O THR A 76 -28.239 17.569 -10.548 1.00 0.00 O ATOM 1243 CB THR A 76 -25.193 16.608 -9.605 1.00 0.00 C ATOM 1244 OG1 THR A 76 -24.203 15.597 -9.477 1.00 0.00 O ATOM 1245 CG2 THR A 76 -25.648 17.057 -8.215 1.00 0.00 C ATOM 0 H THR A 76 -24.788 15.042 -11.367 1.00 0.00 H new ATOM 0 HA THR A 76 -27.076 15.509 -9.732 1.00 0.00 H new ATOM 0 HB THR A 76 -24.776 17.460 -10.142 1.00 0.00 H new ATOM 0 HG1 THR A 76 -23.459 15.789 -10.085 1.00 0.00 H new ATOM 0 HG21 THR A 76 -24.795 17.452 -7.663 1.00 0.00 H new ATOM 0 HG22 THR A 76 -26.408 17.832 -8.314 1.00 0.00 H new ATOM 0 HG23 THR A 76 -26.066 16.206 -7.677 1.00 0.00 H new ATOM 1253 N LYS A 77 -26.696 17.735 -12.103 1.00 0.00 N ATOM 1254 CA LYS A 77 -27.429 18.846 -12.776 1.00 0.00 C ATOM 1255 C LYS A 77 -28.719 18.319 -13.409 1.00 0.00 C ATOM 1256 O LYS A 77 -29.724 19.002 -13.456 1.00 0.00 O ATOM 1257 CB LYS A 77 -26.472 19.355 -13.855 1.00 0.00 C ATOM 1258 CG LYS A 77 -25.837 20.669 -13.394 1.00 0.00 C ATOM 1259 CD LYS A 77 -24.526 20.896 -14.152 1.00 0.00 C ATOM 1260 CE LYS A 77 -23.933 22.249 -13.753 1.00 0.00 C ATOM 1261 NZ LYS A 77 -22.743 22.420 -14.630 1.00 0.00 N ATOM 0 H LYS A 77 -25.820 17.460 -12.547 1.00 0.00 H new ATOM 0 HA LYS A 77 -27.715 19.634 -12.080 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -25.698 18.613 -14.049 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -27.010 19.507 -14.791 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -26.521 21.498 -13.573 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -25.648 20.637 -12.321 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -23.820 20.097 -13.926 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -24.706 20.868 -15.227 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -24.652 23.055 -13.902 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -23.653 22.262 -12.700 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -22.281 23.327 -14.416 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -22.073 21.642 -14.462 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -23.042 22.410 -15.626 1.00 0.00 H new ATOM 1275 N GLU A 78 -28.702 17.108 -13.894 1.00 0.00 N ATOM 1276 CA GLU A 78 -29.927 16.537 -14.523 1.00 0.00 C ATOM 1277 C GLU A 78 -30.884 16.020 -13.444 1.00 0.00 C ATOM 1278 O GLU A 78 -31.949 15.516 -13.736 1.00 0.00 O ATOM 1279 CB GLU A 78 -29.426 15.384 -15.392 1.00 0.00 C ATOM 1280 CG GLU A 78 -30.538 14.940 -16.346 1.00 0.00 C ATOM 1281 CD GLU A 78 -30.084 15.150 -17.792 1.00 0.00 C ATOM 1282 OE1 GLU A 78 -28.886 15.135 -18.024 1.00 0.00 O ATOM 1283 OE2 GLU A 78 -30.942 15.320 -18.642 1.00 0.00 O ATOM 0 H GLU A 78 -27.892 16.488 -13.882 1.00 0.00 H new ATOM 0 HA GLU A 78 -30.475 17.277 -15.105 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -28.550 15.697 -15.959 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -29.117 14.549 -14.763 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -30.778 13.890 -16.178 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -31.447 15.510 -16.153 1.00 0.00 H new ATOM 1290 N THR A 79 -30.509 16.142 -12.200 1.00 0.00 N ATOM 1291 CA THR A 79 -31.397 15.657 -11.103 1.00 0.00 C ATOM 1292 C THR A 79 -31.618 16.766 -10.073 1.00 0.00 C ATOM 1293 O THR A 79 -32.653 17.404 -10.045 1.00 0.00 O ATOM 1294 CB THR A 79 -30.644 14.482 -10.476 1.00 0.00 C ATOM 1295 OG1 THR A 79 -29.245 14.714 -10.570 1.00 0.00 O ATOM 1296 CG2 THR A 79 -31.000 13.192 -11.215 1.00 0.00 C ATOM 0 H THR A 79 -29.628 16.556 -11.895 1.00 0.00 H new ATOM 0 HA THR A 79 -32.381 15.362 -11.467 1.00 0.00 H new ATOM 0 HB THR A 79 -30.927 14.387 -9.428 1.00 0.00 H new ATOM 0 HG1 THR A 79 -28.925 14.430 -11.451 1.00 0.00 H new ATOM 0 HG21 THR A 79 -30.463 12.356 -10.767 1.00 0.00 H new ATOM 0 HG22 THR A 79 -32.073 13.015 -11.142 1.00 0.00 H new ATOM 0 HG23 THR A 79 -30.718 13.284 -12.264 1.00 0.00 H new ATOM 1304 N GLY A 80 -30.655 17.002 -9.224 1.00 0.00 N ATOM 1305 CA GLY A 80 -30.812 18.070 -8.197 1.00 0.00 C ATOM 1306 C GLY A 80 -30.703 17.456 -6.801 1.00 0.00 C ATOM 1307 O GLY A 80 -31.183 18.008 -5.830 1.00 0.00 O ATOM 0 H GLY A 80 -29.767 16.501 -9.197 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -30.046 18.833 -8.331 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -31.777 18.563 -8.315 1.00 0.00 H new ATOM 1311 N PHE A 81 -30.075 16.318 -6.691 1.00 0.00 N ATOM 1312 CA PHE A 81 -29.936 15.668 -5.356 1.00 0.00 C ATOM 1313 C PHE A 81 -28.770 16.290 -4.584 1.00 0.00 C ATOM 1314 O PHE A 81 -27.618 16.005 -4.845 1.00 0.00 O ATOM 1315 CB PHE A 81 -29.657 14.196 -5.658 1.00 0.00 C ATOM 1316 CG PHE A 81 -30.927 13.530 -6.132 1.00 0.00 C ATOM 1317 CD1 PHE A 81 -32.064 13.529 -5.314 1.00 0.00 C ATOM 1318 CD2 PHE A 81 -30.969 12.915 -7.391 1.00 0.00 C ATOM 1319 CE1 PHE A 81 -33.243 12.913 -5.754 1.00 0.00 C ATOM 1320 CE2 PHE A 81 -32.148 12.299 -7.830 1.00 0.00 C ATOM 1321 CZ PHE A 81 -33.285 12.297 -7.012 1.00 0.00 C ATOM 0 H PHE A 81 -29.652 15.810 -7.467 1.00 0.00 H new ATOM 0 HA PHE A 81 -30.827 15.794 -4.740 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -28.883 14.111 -6.420 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -29.282 13.695 -4.765 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -32.032 14.003 -4.344 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -30.093 12.916 -8.022 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -34.120 12.913 -5.123 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -32.180 11.825 -8.800 1.00 0.00 H new ATOM 0 HZ PHE A 81 -34.193 11.821 -7.351 1.00 0.00 H new ATOM 1331 N SER A 82 -29.059 17.139 -3.635 1.00 0.00 N ATOM 1332 CA SER A 82 -27.966 17.780 -2.848 1.00 0.00 C ATOM 1333 C SER A 82 -26.916 16.739 -2.452 1.00 0.00 C ATOM 1334 O SER A 82 -27.232 15.707 -1.894 1.00 0.00 O ATOM 1335 CB SER A 82 -28.654 18.345 -1.606 1.00 0.00 C ATOM 1336 OG SER A 82 -28.928 19.725 -1.808 1.00 0.00 O ATOM 0 H SER A 82 -30.004 17.416 -3.371 1.00 0.00 H new ATOM 0 HA SER A 82 -27.447 18.552 -3.416 1.00 0.00 H new ATOM 0 HB2 SER A 82 -29.580 17.803 -1.411 1.00 0.00 H new ATOM 0 HB3 SER A 82 -28.017 18.213 -0.731 1.00 0.00 H new ATOM 0 HG SER A 82 -29.371 20.090 -1.014 1.00 0.00 H new ATOM 1342 N LEU A 83 -25.670 17.002 -2.737 1.00 0.00 N ATOM 1343 CA LEU A 83 -24.602 16.026 -2.374 1.00 0.00 C ATOM 1344 C LEU A 83 -24.774 15.571 -0.922 1.00 0.00 C ATOM 1345 O LEU A 83 -24.539 14.427 -0.587 1.00 0.00 O ATOM 1346 CB LEU A 83 -23.290 16.794 -2.543 1.00 0.00 C ATOM 1347 CG LEU A 83 -22.128 15.805 -2.648 1.00 0.00 C ATOM 1348 CD1 LEU A 83 -22.218 15.051 -3.976 1.00 0.00 C ATOM 1349 CD2 LEU A 83 -20.803 16.568 -2.586 1.00 0.00 C ATOM 0 H LEU A 83 -25.345 17.848 -3.204 1.00 0.00 H new ATOM 0 HA LEU A 83 -24.633 15.130 -2.994 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -23.333 17.416 -3.437 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -23.136 17.463 -1.696 1.00 0.00 H new ATOM 0 HG LEU A 83 -22.179 15.095 -1.822 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -21.390 14.346 -4.051 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -23.162 14.508 -4.023 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -22.166 15.761 -4.802 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -19.974 15.864 -2.661 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -20.753 17.277 -3.412 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -20.737 17.107 -1.641 1.00 0.00 H new ATOM 1361 N GLU A 84 -25.185 16.459 -0.058 1.00 0.00 N ATOM 1362 CA GLU A 84 -25.374 16.078 1.371 1.00 0.00 C ATOM 1363 C GLU A 84 -26.340 14.894 1.475 1.00 0.00 C ATOM 1364 O GLU A 84 -26.063 13.911 2.133 1.00 0.00 O ATOM 1365 CB GLU A 84 -25.971 17.318 2.036 1.00 0.00 C ATOM 1366 CG GLU A 84 -24.852 18.303 2.379 1.00 0.00 C ATOM 1367 CD GLU A 84 -24.419 19.045 1.113 1.00 0.00 C ATOM 1368 OE1 GLU A 84 -23.554 18.537 0.419 1.00 0.00 O ATOM 1369 OE2 GLU A 84 -24.961 20.108 0.859 1.00 0.00 O ATOM 0 H GLU A 84 -25.398 17.432 -0.280 1.00 0.00 H new ATOM 0 HA GLU A 84 -24.442 15.772 1.846 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -26.693 17.789 1.369 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -26.510 17.035 2.940 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -25.196 19.014 3.130 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -24.004 17.771 2.809 1.00 0.00 H new ATOM 1376 N LYS A 85 -27.471 14.981 0.831 1.00 0.00 N ATOM 1377 CA LYS A 85 -28.452 13.860 0.893 1.00 0.00 C ATOM 1378 C LYS A 85 -27.826 12.578 0.335 1.00 0.00 C ATOM 1379 O LYS A 85 -27.861 11.537 0.960 1.00 0.00 O ATOM 1380 CB LYS A 85 -29.623 14.310 0.018 1.00 0.00 C ATOM 1381 CG LYS A 85 -30.811 14.684 0.907 1.00 0.00 C ATOM 1382 CD LYS A 85 -31.889 13.604 0.799 1.00 0.00 C ATOM 1383 CE LYS A 85 -31.746 12.622 1.964 1.00 0.00 C ATOM 1384 NZ LYS A 85 -32.259 13.358 3.153 1.00 0.00 N ATOM 0 H LYS A 85 -27.759 15.779 0.265 1.00 0.00 H new ATOM 0 HA LYS A 85 -28.766 13.642 1.914 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -29.328 15.164 -0.591 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -29.906 13.512 -0.668 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -30.486 14.786 1.942 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -31.216 15.649 0.603 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -32.879 14.060 0.814 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -31.796 13.075 -0.150 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -32.319 11.712 1.786 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -30.707 12.323 2.103 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -31.510 13.420 3.872 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -32.548 14.316 2.870 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -33.077 12.852 3.548 1.00 0.00 H new ATOM 1398 N ILE A 86 -27.252 12.647 -0.836 1.00 0.00 N ATOM 1399 CA ILE A 86 -26.624 11.432 -1.429 1.00 0.00 C ATOM 1400 C ILE A 86 -25.686 10.775 -0.413 1.00 0.00 C ATOM 1401 O ILE A 86 -25.623 9.567 -0.302 1.00 0.00 O ATOM 1402 CB ILE A 86 -25.836 11.941 -2.636 1.00 0.00 C ATOM 1403 CG1 ILE A 86 -26.802 12.555 -3.652 1.00 0.00 C ATOM 1404 CG2 ILE A 86 -25.088 10.775 -3.287 1.00 0.00 C ATOM 1405 CD1 ILE A 86 -27.884 11.536 -4.010 1.00 0.00 C ATOM 0 H ILE A 86 -27.191 13.490 -1.406 1.00 0.00 H new ATOM 0 HA ILE A 86 -27.362 10.682 -1.713 1.00 0.00 H new ATOM 0 HB ILE A 86 -25.120 12.696 -2.310 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -27.258 13.455 -3.238 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -26.260 12.856 -4.549 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -24.526 11.138 -4.148 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -24.401 10.335 -2.564 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -25.804 10.020 -3.613 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -28.571 11.974 -4.734 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -27.420 10.649 -4.441 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -28.433 11.257 -3.111 1.00 0.00 H new ATOM 1417 N TYR A 87 -24.957 11.563 0.329 1.00 0.00 N ATOM 1418 CA TYR A 87 -24.025 10.984 1.338 1.00 0.00 C ATOM 1419 C TYR A 87 -24.816 10.324 2.471 1.00 0.00 C ATOM 1420 O TYR A 87 -24.431 9.297 2.993 1.00 0.00 O ATOM 1421 CB TYR A 87 -23.223 12.174 1.866 1.00 0.00 C ATOM 1422 CG TYR A 87 -21.750 11.931 1.639 1.00 0.00 C ATOM 1423 CD1 TYR A 87 -21.272 11.686 0.344 1.00 0.00 C ATOM 1424 CD2 TYR A 87 -20.861 11.950 2.721 1.00 0.00 C ATOM 1425 CE1 TYR A 87 -19.905 11.460 0.133 1.00 0.00 C ATOM 1426 CE2 TYR A 87 -19.494 11.725 2.510 1.00 0.00 C ATOM 1427 CZ TYR A 87 -19.017 11.479 1.215 1.00 0.00 C ATOM 1428 OH TYR A 87 -17.671 11.257 1.007 1.00 0.00 O ATOM 0 H TYR A 87 -24.966 12.582 0.280 1.00 0.00 H new ATOM 0 HA TYR A 87 -23.380 10.216 0.912 1.00 0.00 H new ATOM 0 HB2 TYR A 87 -23.534 13.088 1.360 1.00 0.00 H new ATOM 0 HB3 TYR A 87 -23.419 12.315 2.929 1.00 0.00 H new ATOM 0 HD1 TYR A 87 -21.957 11.671 -0.491 1.00 0.00 H new ATOM 0 HD2 TYR A 87 -21.229 12.138 3.719 1.00 0.00 H new ATOM 0 HE1 TYR A 87 -19.537 11.271 -0.865 1.00 0.00 H new ATOM 0 HE2 TYR A 87 -18.809 11.741 3.344 1.00 0.00 H new ATOM 0 HH TYR A 87 -17.195 11.306 1.862 1.00 0.00 H new ATOM 1438 N GLN A 88 -25.920 10.905 2.853 1.00 0.00 N ATOM 1439 CA GLN A 88 -26.736 10.309 3.950 1.00 0.00 C ATOM 1440 C GLN A 88 -27.284 8.946 3.521 1.00 0.00 C ATOM 1441 O GLN A 88 -27.468 8.057 4.329 1.00 0.00 O ATOM 1442 CB GLN A 88 -27.880 11.298 4.177 1.00 0.00 C ATOM 1443 CG GLN A 88 -27.525 12.235 5.334 1.00 0.00 C ATOM 1444 CD GLN A 88 -28.645 12.207 6.376 1.00 0.00 C ATOM 1445 OE1 GLN A 88 -29.801 12.379 6.045 1.00 0.00 O ATOM 1446 NE2 GLN A 88 -28.349 11.995 7.628 1.00 0.00 N ATOM 0 H GLN A 88 -26.293 11.766 2.454 1.00 0.00 H new ATOM 0 HA GLN A 88 -26.152 10.146 4.856 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -28.061 11.875 3.270 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -28.801 10.760 4.401 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -26.583 11.928 5.789 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -27.384 13.250 4.963 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -27.378 11.851 7.905 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -29.088 11.973 8.330 1.00 0.00 H new ATOM 1455 N LEU A 89 -27.546 8.774 2.254 1.00 0.00 N ATOM 1456 CA LEU A 89 -28.081 7.467 1.773 1.00 0.00 C ATOM 1457 C LEU A 89 -26.958 6.428 1.703 1.00 0.00 C ATOM 1458 O LEU A 89 -26.996 5.415 2.374 1.00 0.00 O ATOM 1459 CB LEU A 89 -28.632 7.756 0.376 1.00 0.00 C ATOM 1460 CG LEU A 89 -30.071 8.258 0.488 1.00 0.00 C ATOM 1461 CD1 LEU A 89 -30.465 8.976 -0.805 1.00 0.00 C ATOM 1462 CD2 LEU A 89 -31.009 7.070 0.715 1.00 0.00 C ATOM 0 H LEU A 89 -27.413 9.481 1.531 1.00 0.00 H new ATOM 0 HA LEU A 89 -28.845 7.063 2.438 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -28.013 8.502 -0.123 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -28.597 6.853 -0.234 1.00 0.00 H new ATOM 0 HG LEU A 89 -30.149 8.950 1.326 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -31.491 9.334 -0.724 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -29.798 9.822 -0.969 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -30.387 8.284 -1.644 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -32.036 7.427 0.795 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -30.930 6.378 -0.124 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -30.730 6.557 1.636 1.00 0.00 H new ATOM 1474 N PHE A 90 -25.961 6.669 0.896 1.00 0.00 N ATOM 1475 CA PHE A 90 -24.839 5.693 0.787 1.00 0.00 C ATOM 1476 C PHE A 90 -23.703 6.084 1.737 1.00 0.00 C ATOM 1477 O PHE A 90 -23.481 7.250 1.994 1.00 0.00 O ATOM 1478 CB PHE A 90 -24.377 5.784 -0.668 1.00 0.00 C ATOM 1479 CG PHE A 90 -25.466 5.264 -1.576 1.00 0.00 C ATOM 1480 CD1 PHE A 90 -26.088 4.040 -1.293 1.00 0.00 C ATOM 1481 CD2 PHE A 90 -25.854 6.004 -2.700 1.00 0.00 C ATOM 1482 CE1 PHE A 90 -27.098 3.558 -2.134 1.00 0.00 C ATOM 1483 CE2 PHE A 90 -26.865 5.521 -3.542 1.00 0.00 C ATOM 1484 CZ PHE A 90 -27.488 4.298 -3.258 1.00 0.00 C ATOM 0 H PHE A 90 -25.875 7.498 0.308 1.00 0.00 H new ATOM 0 HA PHE A 90 -25.143 4.681 1.056 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -24.140 6.817 -0.921 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -23.465 5.204 -0.808 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -25.788 3.469 -0.427 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -25.374 6.947 -2.918 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -27.577 2.615 -1.916 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -27.164 6.091 -4.409 1.00 0.00 H new ATOM 0 HZ PHE A 90 -28.268 3.926 -3.905 1.00 0.00 H new ATOM 1494 N PRO A 91 -23.021 5.085 2.228 1.00 0.00 N ATOM 1495 CA PRO A 91 -21.894 5.317 3.164 1.00 0.00 C ATOM 1496 C PRO A 91 -20.677 5.862 2.410 1.00 0.00 C ATOM 1497 O PRO A 91 -19.789 5.125 2.032 1.00 0.00 O ATOM 1498 CB PRO A 91 -21.606 3.929 3.729 1.00 0.00 C ATOM 1499 CG PRO A 91 -22.106 2.975 2.691 1.00 0.00 C ATOM 1500 CD PRO A 91 -23.234 3.659 1.961 1.00 0.00 C ATOM 0 HA PRO A 91 -22.124 6.048 3.939 1.00 0.00 H new ATOM 0 HB2 PRO A 91 -20.540 3.791 3.911 1.00 0.00 H new ATOM 0 HB3 PRO A 91 -22.114 3.778 4.681 1.00 0.00 H new ATOM 0 HG2 PRO A 91 -21.308 2.706 1.999 1.00 0.00 H new ATOM 0 HG3 PRO A 91 -22.452 2.050 3.153 1.00 0.00 H new ATOM 0 HD2 PRO A 91 -23.205 3.445 0.893 1.00 0.00 H new ATOM 0 HD3 PRO A 91 -24.205 3.326 2.327 1.00 0.00 H new ATOM 1508 N SER A 92 -20.629 7.148 2.191 1.00 0.00 N ATOM 1509 CA SER A 92 -19.468 7.736 1.462 1.00 0.00 C ATOM 1510 C SER A 92 -19.107 6.868 0.253 1.00 0.00 C ATOM 1511 O SER A 92 -18.090 6.204 0.236 1.00 0.00 O ATOM 1512 CB SER A 92 -18.327 7.744 2.476 1.00 0.00 C ATOM 1513 OG SER A 92 -18.727 8.472 3.630 1.00 0.00 O ATOM 0 H SER A 92 -21.342 7.816 2.484 1.00 0.00 H new ATOM 0 HA SER A 92 -19.682 8.735 1.082 1.00 0.00 H new ATOM 0 HB2 SER A 92 -18.062 6.723 2.750 1.00 0.00 H new ATOM 0 HB3 SER A 92 -17.438 8.197 2.037 1.00 0.00 H new ATOM 0 HG SER A 92 -18.967 9.387 3.373 1.00 0.00 H new ATOM 1519 N GLY A 93 -19.932 6.869 -0.758 1.00 0.00 N ATOM 1520 CA GLY A 93 -19.634 6.044 -1.963 1.00 0.00 C ATOM 1521 C GLY A 93 -20.859 6.012 -2.879 1.00 0.00 C ATOM 1522 O GLY A 93 -21.427 4.965 -3.119 1.00 0.00 O ATOM 0 H GLY A 93 -20.799 7.405 -0.802 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -18.779 6.458 -2.497 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -19.364 5.031 -1.665 1.00 0.00 H new ATOM 1526 N PRO A 94 -21.223 7.167 -3.362 1.00 0.00 N ATOM 1527 CA PRO A 94 -22.394 7.282 -4.265 1.00 0.00 C ATOM 1528 C PRO A 94 -22.058 6.728 -5.653 1.00 0.00 C ATOM 1529 O PRO A 94 -22.884 6.720 -6.545 1.00 0.00 O ATOM 1530 CB PRO A 94 -22.650 8.786 -4.329 1.00 0.00 C ATOM 1531 CG PRO A 94 -21.332 9.419 -4.010 1.00 0.00 C ATOM 1532 CD PRO A 94 -20.584 8.464 -3.115 1.00 0.00 C ATOM 0 HA PRO A 94 -23.260 6.720 -3.916 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -23.002 9.084 -5.316 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -23.415 9.087 -3.613 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -20.768 9.613 -4.922 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -21.476 10.379 -3.514 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -19.522 8.438 -3.359 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -20.663 8.754 -2.067 1.00 0.00 H new ATOM 1540 N ALA A 95 -20.853 6.265 -5.842 1.00 0.00 N ATOM 1541 CA ALA A 95 -20.467 5.713 -7.173 1.00 0.00 C ATOM 1542 C ALA A 95 -20.555 4.185 -7.160 1.00 0.00 C ATOM 1543 O ALA A 95 -21.337 3.593 -7.878 1.00 0.00 O ATOM 1544 CB ALA A 95 -19.022 6.165 -7.385 1.00 0.00 C ATOM 0 H ALA A 95 -20.119 6.245 -5.134 1.00 0.00 H new ATOM 0 HA ALA A 95 -21.125 6.061 -7.970 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -18.663 5.797 -8.346 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -18.976 7.254 -7.373 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -18.395 5.766 -6.587 1.00 0.00 H new ATOM 1550 N HIS A 96 -19.758 3.541 -6.351 1.00 0.00 N ATOM 1551 CA HIS A 96 -19.795 2.051 -6.295 1.00 0.00 C ATOM 1552 C HIS A 96 -21.012 1.580 -5.493 1.00 0.00 C ATOM 1553 O HIS A 96 -21.381 0.422 -5.531 1.00 0.00 O ATOM 1554 CB HIS A 96 -18.500 1.649 -5.589 1.00 0.00 C ATOM 1555 CG HIS A 96 -17.763 0.641 -6.429 1.00 0.00 C ATOM 1556 ND1 HIS A 96 -16.923 -0.310 -5.872 1.00 0.00 N ATOM 1557 CD2 HIS A 96 -17.729 0.425 -7.784 1.00 0.00 C ATOM 1558 CE1 HIS A 96 -16.424 -1.049 -6.880 1.00 0.00 C ATOM 1559 NE2 HIS A 96 -16.883 -0.643 -8.067 1.00 0.00 N ATOM 0 H HIS A 96 -19.083 3.982 -5.726 1.00 0.00 H new ATOM 0 HA HIS A 96 -19.876 1.603 -7.285 1.00 0.00 H new ATOM 0 HB2 HIS A 96 -17.875 2.527 -5.424 1.00 0.00 H new ATOM 0 HB3 HIS A 96 -18.723 1.228 -4.609 1.00 0.00 H new ATOM 0 HD2 HIS A 96 -18.276 0.997 -8.519 1.00 0.00 H new ATOM 0 HE1 HIS A 96 -15.736 -1.871 -6.746 1.00 0.00 H new ATOM 0 HE2 HIS A 96 -16.661 -1.032 -8.983 1.00 0.00 H new ATOM 1567 N GLY A 97 -21.637 2.465 -4.766 1.00 0.00 N ATOM 1568 CA GLY A 97 -22.826 2.064 -3.963 1.00 0.00 C ATOM 1569 C GLY A 97 -24.043 1.925 -4.879 1.00 0.00 C ATOM 1570 O GLY A 97 -24.447 0.833 -5.227 1.00 0.00 O ATOM 0 H GLY A 97 -21.376 3.448 -4.693 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -22.632 1.120 -3.454 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -23.023 2.808 -3.191 1.00 0.00 H new ATOM 1574 N ALA A 98 -24.631 3.022 -5.271 1.00 0.00 N ATOM 1575 CA ALA A 98 -25.823 2.951 -6.165 1.00 0.00 C ATOM 1576 C ALA A 98 -25.606 1.904 -7.260 1.00 0.00 C ATOM 1577 O ALA A 98 -26.518 1.202 -7.652 1.00 0.00 O ATOM 1578 CB ALA A 98 -25.942 4.348 -6.775 1.00 0.00 C ATOM 0 H ALA A 98 -24.338 3.964 -5.011 1.00 0.00 H new ATOM 0 HA ALA A 98 -26.725 2.661 -5.626 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -26.799 4.379 -7.448 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -26.078 5.082 -5.980 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -25.034 4.580 -7.332 1.00 0.00 H new ATOM 1584 N CYS A 99 -24.405 1.794 -7.759 1.00 0.00 N ATOM 1585 CA CYS A 99 -24.129 0.793 -8.830 1.00 0.00 C ATOM 1586 C CYS A 99 -24.284 -0.630 -8.283 1.00 0.00 C ATOM 1587 O CYS A 99 -24.971 -1.452 -8.854 1.00 0.00 O ATOM 1588 CB CYS A 99 -22.681 1.053 -9.248 1.00 0.00 C ATOM 1589 SG CYS A 99 -22.570 1.095 -11.054 1.00 0.00 S ATOM 0 H CYS A 99 -23.602 2.354 -7.472 1.00 0.00 H new ATOM 0 HA CYS A 99 -24.820 0.885 -9.668 1.00 0.00 H new ATOM 0 HB2 CYS A 99 -22.335 1.998 -8.830 1.00 0.00 H new ATOM 0 HB3 CYS A 99 -22.031 0.273 -8.851 1.00 0.00 H new ATOM 1594 N LYS A 100 -23.649 -0.924 -7.182 1.00 0.00 N ATOM 1595 CA LYS A 100 -23.759 -2.294 -6.601 1.00 0.00 C ATOM 1596 C LYS A 100 -25.230 -2.677 -6.419 1.00 0.00 C ATOM 1597 O LYS A 100 -25.654 -3.749 -6.804 1.00 0.00 O ATOM 1598 CB LYS A 100 -23.057 -2.206 -5.247 1.00 0.00 C ATOM 1599 CG LYS A 100 -22.457 -3.567 -4.890 1.00 0.00 C ATOM 1600 CD LYS A 100 -20.938 -3.438 -4.758 1.00 0.00 C ATOM 1601 CE LYS A 100 -20.409 -4.543 -3.842 1.00 0.00 C ATOM 1602 NZ LYS A 100 -18.932 -4.532 -4.038 1.00 0.00 N ATOM 0 H LYS A 100 -23.059 -0.276 -6.659 1.00 0.00 H new ATOM 0 HA LYS A 100 -23.312 -3.052 -7.244 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -22.273 -1.449 -5.281 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -23.765 -1.897 -4.478 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -22.884 -3.930 -3.955 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -22.705 -4.298 -5.659 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -20.470 -3.510 -5.740 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -20.679 -2.460 -4.352 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -20.670 -4.352 -2.801 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -20.835 -5.511 -4.105 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -18.647 -5.373 -4.579 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -18.657 -3.675 -4.560 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -18.459 -4.539 -3.112 1.00 0.00 H new ATOM 1616 N VAL A 101 -26.010 -1.812 -5.833 1.00 0.00 N ATOM 1617 CA VAL A 101 -27.452 -2.129 -5.623 1.00 0.00 C ATOM 1618 C VAL A 101 -28.192 -2.151 -6.965 1.00 0.00 C ATOM 1619 O VAL A 101 -29.185 -2.832 -7.125 1.00 0.00 O ATOM 1620 CB VAL A 101 -27.981 -1.002 -4.738 1.00 0.00 C ATOM 1621 CG1 VAL A 101 -29.509 -1.058 -4.693 1.00 0.00 C ATOM 1622 CG2 VAL A 101 -27.425 -1.168 -3.321 1.00 0.00 C ATOM 0 H VAL A 101 -25.712 -0.899 -5.490 1.00 0.00 H new ATOM 0 HA VAL A 101 -27.596 -3.108 -5.166 1.00 0.00 H new ATOM 0 HB VAL A 101 -27.666 -0.042 -5.146 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -29.884 -0.253 -4.061 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -29.907 -0.943 -5.701 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -29.826 -2.018 -4.285 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -27.800 -0.365 -2.686 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -27.742 -2.129 -2.916 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -26.336 -1.128 -3.350 1.00 0.00 H new ATOM 1632 N ALA A 102 -27.718 -1.412 -7.929 1.00 0.00 N ATOM 1633 CA ALA A 102 -28.397 -1.395 -9.256 1.00 0.00 C ATOM 1634 C ALA A 102 -28.084 -2.680 -10.027 1.00 0.00 C ATOM 1635 O ALA A 102 -28.785 -3.050 -10.947 1.00 0.00 O ATOM 1636 CB ALA A 102 -27.818 -0.179 -9.983 1.00 0.00 C ATOM 0 H ALA A 102 -26.891 -0.820 -7.856 1.00 0.00 H new ATOM 0 HA ALA A 102 -29.481 -1.336 -9.164 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -28.269 -0.097 -10.972 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -28.032 0.723 -9.410 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -26.739 -0.296 -10.085 1.00 0.00 H new ATOM 1642 N GLY A 103 -27.035 -3.363 -9.657 1.00 0.00 N ATOM 1643 CA GLY A 103 -26.679 -4.624 -10.367 1.00 0.00 C ATOM 1644 C GLY A 103 -25.858 -4.295 -11.615 1.00 0.00 C ATOM 1645 O GLY A 103 -26.269 -4.558 -12.728 1.00 0.00 O ATOM 0 H GLY A 103 -26.410 -3.102 -8.894 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -26.109 -5.277 -9.706 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -27.584 -5.164 -10.646 1.00 0.00 H new ATOM 1649 N ALA A 104 -24.697 -3.722 -11.440 1.00 0.00 N ATOM 1650 CA ALA A 104 -23.851 -3.378 -12.619 1.00 0.00 C ATOM 1651 C ALA A 104 -22.371 -3.585 -12.285 1.00 0.00 C ATOM 1652 O ALA A 104 -21.650 -2.639 -12.040 1.00 0.00 O ATOM 1653 CB ALA A 104 -24.137 -1.901 -12.895 1.00 0.00 C ATOM 0 H ALA A 104 -24.299 -3.478 -10.533 1.00 0.00 H new ATOM 0 HA ALA A 104 -24.073 -4.004 -13.483 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -23.550 -1.571 -13.752 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -25.198 -1.770 -13.109 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -23.868 -1.309 -12.021 1.00 0.00 H new