USER MOD reduce.3.24.130724 H: found=0, std=0, add=758, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 759 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 21 LYS NZ :NH3+ 160:sc= 0.00246 (180deg=0) USER MOD Set 1.2: A 131 TYR OH : rot 180:sc= 0.00296 USER MOD Set 2.1: A 31 GLN : amide:sc= 0 K(o=-4.2,f=-4.9) USER MOD Set 2.2: A 37 ASN : amide:sc= -4.21! C(o=-4.2!,f=-5.2!) USER MOD Set 3.1: A 6 SER OG : rot 121:sc= 0.846 USER MOD Set 3.2: A 13 CYS SG : rot 180:sc= 0.734 USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 SER OG : rot 22:sc= 0.724 USER MOD Single : A 12 HIS :FLIP no HD1:sc= -2.07! C(o=-3.9!,f=-2.1!) USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot 180:sc= -0.467 USER MOD Single : A 22 SER OG : rot -89:sc= 0.941 USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ 170:sc= -5.65! (180deg=-7.06!) USER MOD Single : A 35 SER OG : rot 180:sc= -0.175 USER MOD Single : A 40 SER OG : rot 180:sc= -0.516 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 48 SER OG : rot -52:sc= 0.516 USER MOD Single : A 51 SER OG : rot 137:sc= 0.831 USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 SER OG : rot -20:sc= 0.79 USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 HIS :FLIP no HE2:sc= -0.145 F(o=-1.4,f=-0.15) USER MOD Single : A 85 SER OG : rot -167:sc= 0.94 USER MOD Single : A 90 MET CE :methyl 171:sc= 0 (180deg=-0.0306) USER MOD Single : A 91 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 HIS : no HD1:sc= -0.0866 X(o=-0.087,f=0) USER MOD Single : A 110 SER OG : rot -102:sc= 0.36 USER MOD Single : A 112 SER OG : rot -47:sc= 0.562 USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 115 THR OG1 : rot -120:sc= -0.0445 USER MOD Single : A 121 LYS NZ :NH3+ 168:sc= -2.25! (180deg=-3.75!) USER MOD Single : A 123 TYR OH : rot 180:sc= 0 USER MOD Single : A 124 ASN : amide:sc= -0.0208 X(o=-0.021,f=-0.37) USER MOD Single : A 126 ASN : amide:sc= -0.0111 K(o=-0.011,f=-1.2) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 80 N SER A 6 -6.411 15.600 0.878 1.00 0.00 N ATOM 81 CA SER A 6 -5.526 14.876 1.838 1.00 0.00 C ATOM 82 C SER A 6 -6.326 14.527 3.095 1.00 0.00 C ATOM 83 O SER A 6 -7.089 15.331 3.594 1.00 0.00 O ATOM 84 CB SER A 6 -4.342 15.768 2.218 1.00 0.00 C ATOM 85 OG SER A 6 -4.755 16.698 3.210 1.00 0.00 O ATOM 0 HA SER A 6 -5.154 13.963 1.374 1.00 0.00 H new ATOM 0 HB2 SER A 6 -3.519 15.160 2.593 1.00 0.00 H new ATOM 0 HB3 SER A 6 -3.973 16.296 1.339 1.00 0.00 H new ATOM 0 HG SER A 6 -4.207 16.584 4.014 1.00 0.00 H new ATOM 91 N LYS A 7 -6.170 13.330 3.606 1.00 0.00 N ATOM 92 CA LYS A 7 -6.937 12.928 4.826 1.00 0.00 C ATOM 93 C LYS A 7 -5.963 12.519 5.933 1.00 0.00 C ATOM 94 O LYS A 7 -5.051 11.753 5.712 1.00 0.00 O ATOM 95 CB LYS A 7 -7.850 11.737 4.489 1.00 0.00 C ATOM 96 CG LYS A 7 -8.196 11.738 2.989 1.00 0.00 C ATOM 97 CD LYS A 7 -9.635 11.256 2.793 1.00 0.00 C ATOM 98 CE LYS A 7 -10.608 12.383 3.162 1.00 0.00 C ATOM 99 NZ LYS A 7 -11.196 12.956 1.918 1.00 0.00 N ATOM 0 H LYS A 7 -5.546 12.615 3.232 1.00 0.00 H new ATOM 0 HA LYS A 7 -7.542 13.769 5.165 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -7.354 10.803 4.754 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -8.764 11.792 5.080 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -8.079 12.741 2.579 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -7.508 11.090 2.446 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -9.790 10.952 1.758 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -9.824 10.380 3.414 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -11.398 12.000 3.808 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -10.087 13.159 3.722 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -11.856 13.720 2.166 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -10.436 13.336 1.318 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -11.707 12.212 1.401 1.00 0.00 H new ATOM 113 N ALA A 8 -6.151 13.017 7.125 1.00 0.00 N ATOM 114 CA ALA A 8 -5.229 12.646 8.237 1.00 0.00 C ATOM 115 C ALA A 8 -5.750 11.396 8.946 1.00 0.00 C ATOM 116 O ALA A 8 -6.901 11.316 9.325 1.00 0.00 O ATOM 117 CB ALA A 8 -5.136 13.797 9.240 1.00 0.00 C ATOM 0 H ALA A 8 -6.900 13.662 7.377 1.00 0.00 H new ATOM 0 HA ALA A 8 -4.240 12.444 7.825 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -4.461 13.520 10.050 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -4.755 14.687 8.739 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -6.125 14.006 9.647 1.00 0.00 H new ATOM 123 N TYR A 9 -4.900 10.422 9.131 1.00 0.00 N ATOM 124 CA TYR A 9 -5.322 9.171 9.820 1.00 0.00 C ATOM 125 C TYR A 9 -4.188 8.704 10.732 1.00 0.00 C ATOM 126 O TYR A 9 -3.029 8.938 10.460 1.00 0.00 O ATOM 127 CB TYR A 9 -5.622 8.091 8.779 1.00 0.00 C ATOM 128 CG TYR A 9 -6.379 6.958 9.431 1.00 0.00 C ATOM 129 CD1 TYR A 9 -5.683 5.892 10.013 1.00 0.00 C ATOM 130 CD2 TYR A 9 -7.780 6.975 9.453 1.00 0.00 C ATOM 131 CE1 TYR A 9 -6.387 4.844 10.619 1.00 0.00 C ATOM 132 CE2 TYR A 9 -8.483 5.927 10.058 1.00 0.00 C ATOM 133 CZ TYR A 9 -7.786 4.861 10.641 1.00 0.00 C ATOM 134 OH TYR A 9 -8.480 3.828 11.238 1.00 0.00 O ATOM 0 H TYR A 9 -3.925 10.441 8.832 1.00 0.00 H new ATOM 0 HA TYR A 9 -6.219 9.357 10.411 1.00 0.00 H new ATOM 0 HB2 TYR A 9 -6.208 8.511 7.962 1.00 0.00 H new ATOM 0 HB3 TYR A 9 -4.693 7.720 8.346 1.00 0.00 H new ATOM 0 HD1 TYR A 9 -4.603 5.878 9.995 1.00 0.00 H new ATOM 0 HD2 TYR A 9 -8.317 7.797 9.003 1.00 0.00 H new ATOM 0 HE1 TYR A 9 -5.850 4.022 11.070 1.00 0.00 H new ATOM 0 HE2 TYR A 9 -9.563 5.940 10.075 1.00 0.00 H new ATOM 0 HH TYR A 9 -9.443 3.996 11.166 1.00 0.00 H new ATOM 144 N GLY A 10 -4.503 8.052 11.814 1.00 0.00 N ATOM 145 CA GLY A 10 -3.427 7.585 12.731 1.00 0.00 C ATOM 146 C GLY A 10 -2.676 8.797 13.287 1.00 0.00 C ATOM 147 O GLY A 10 -2.826 9.156 14.437 1.00 0.00 O ATOM 0 H GLY A 10 -5.454 7.823 12.103 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -3.856 7.003 13.547 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -2.739 6.929 12.198 1.00 0.00 H new ATOM 151 N SER A 11 -1.868 9.435 12.478 1.00 0.00 N ATOM 152 CA SER A 11 -1.115 10.625 12.968 1.00 0.00 C ATOM 153 C SER A 11 -0.301 11.241 11.821 1.00 0.00 C ATOM 154 O SER A 11 0.722 11.856 12.041 1.00 0.00 O ATOM 155 CB SER A 11 -0.165 10.198 14.092 1.00 0.00 C ATOM 156 OG SER A 11 -0.891 10.109 15.311 1.00 0.00 O ATOM 0 H SER A 11 -1.699 9.183 11.504 1.00 0.00 H new ATOM 0 HA SER A 11 -1.822 11.365 13.343 1.00 0.00 H new ATOM 0 HB2 SER A 11 0.289 9.236 13.854 1.00 0.00 H new ATOM 0 HB3 SER A 11 0.647 10.918 14.191 1.00 0.00 H new ATOM 0 HG SER A 11 -1.845 9.995 15.116 1.00 0.00 H new ATOM 162 N HIS A 12 -0.744 11.088 10.600 1.00 0.00 N ATOM 163 CA HIS A 12 0.006 11.670 9.456 1.00 0.00 C ATOM 164 C HIS A 12 -0.989 12.123 8.387 1.00 0.00 C ATOM 165 O HIS A 12 -2.094 11.624 8.305 1.00 0.00 O ATOM 166 CB HIS A 12 0.939 10.611 8.861 1.00 0.00 C ATOM 167 CG HIS A 12 1.775 9.997 9.951 1.00 0.00 C ATOM 168 ND1 HIS A 12 1.457 9.161 10.993 1.00 0.00 N flip ATOM 169 CD2 HIS A 12 3.140 10.217 10.044 1.00 0.00 C flip ATOM 170 CE1 HIS A 12 2.605 8.868 11.724 1.00 0.00 C flip ATOM 171 NE2 HIS A 12 3.590 9.528 11.110 1.00 0.00 N flip ATOM 0 H HIS A 12 -1.594 10.584 10.349 1.00 0.00 H new ATOM 0 HA HIS A 12 0.596 12.520 9.800 1.00 0.00 H new ATOM 0 HB2 HIS A 12 0.355 9.839 8.360 1.00 0.00 H new ATOM 0 HB3 HIS A 12 1.583 11.063 8.107 1.00 0.00 H new ATOM 0 HD2 HIS A 12 3.735 10.829 9.382 1.00 0.00 H new ATOM 0 HE1 HIS A 12 2.682 8.241 12.600 1.00 0.00 H new ATOM 0 HE2 HIS A 12 4.564 9.512 11.412 1.00 0.00 H new ATOM 179 N CYS A 13 -0.606 13.057 7.562 1.00 0.00 N ATOM 180 CA CYS A 13 -1.532 13.529 6.496 1.00 0.00 C ATOM 181 C CYS A 13 -1.383 12.614 5.280 1.00 0.00 C ATOM 182 O CYS A 13 -0.293 12.390 4.793 1.00 0.00 O ATOM 183 CB CYS A 13 -1.179 14.969 6.112 1.00 0.00 C ATOM 184 SG CYS A 13 -2.678 15.836 5.591 1.00 0.00 S ATOM 0 H CYS A 13 0.306 13.513 7.580 1.00 0.00 H new ATOM 0 HA CYS A 13 -2.561 13.502 6.854 1.00 0.00 H new ATOM 0 HB2 CYS A 13 -0.725 15.482 6.960 1.00 0.00 H new ATOM 0 HB3 CYS A 13 -0.445 14.973 5.306 1.00 0.00 H new ATOM 0 HG CYS A 13 -2.381 17.059 5.266 1.00 0.00 H new ATOM 189 N TYR A 14 -2.466 12.068 4.796 1.00 0.00 N ATOM 190 CA TYR A 14 -2.380 11.152 3.625 1.00 0.00 C ATOM 191 C TYR A 14 -2.769 11.899 2.353 1.00 0.00 C ATOM 192 O TYR A 14 -3.515 12.852 2.386 1.00 0.00 O ATOM 193 CB TYR A 14 -3.319 9.961 3.833 1.00 0.00 C ATOM 194 CG TYR A 14 -2.815 9.122 4.984 1.00 0.00 C ATOM 195 CD1 TYR A 14 -2.824 9.637 6.285 1.00 0.00 C ATOM 196 CD2 TYR A 14 -2.333 7.827 4.751 1.00 0.00 C ATOM 197 CE1 TYR A 14 -2.355 8.864 7.351 1.00 0.00 C ATOM 198 CE2 TYR A 14 -1.864 7.051 5.819 1.00 0.00 C ATOM 199 CZ TYR A 14 -1.875 7.570 7.119 1.00 0.00 C ATOM 200 OH TYR A 14 -1.413 6.806 8.171 1.00 0.00 O ATOM 0 H TYR A 14 -3.406 12.217 5.162 1.00 0.00 H new ATOM 0 HA TYR A 14 -1.356 10.791 3.527 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -4.330 10.312 4.039 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -3.369 9.360 2.925 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -3.195 10.635 6.466 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -2.323 7.427 3.748 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -2.363 9.265 8.354 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -1.494 6.052 5.639 1.00 0.00 H new ATOM 0 HH TYR A 14 -1.117 5.934 7.837 1.00 0.00 H new ATOM 210 N ALA A 15 -2.263 11.470 1.228 1.00 0.00 N ATOM 211 CA ALA A 15 -2.601 12.154 -0.052 1.00 0.00 C ATOM 212 C ALA A 15 -2.549 11.143 -1.199 1.00 0.00 C ATOM 213 O ALA A 15 -1.537 10.518 -1.445 1.00 0.00 O ATOM 214 CB ALA A 15 -1.594 13.275 -0.313 1.00 0.00 C ATOM 0 H ALA A 15 -1.630 10.675 1.141 1.00 0.00 H new ATOM 0 HA ALA A 15 -3.604 12.576 0.015 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -1.841 13.775 -1.249 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -1.631 13.995 0.504 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -0.591 12.854 -0.380 1.00 0.00 H new ATOM 220 N LEU A 16 -3.635 10.981 -1.901 1.00 0.00 N ATOM 221 CA LEU A 16 -3.659 10.013 -3.033 1.00 0.00 C ATOM 222 C LEU A 16 -3.044 10.668 -4.273 1.00 0.00 C ATOM 223 O LEU A 16 -3.339 11.800 -4.599 1.00 0.00 O ATOM 224 CB LEU A 16 -5.117 9.618 -3.315 1.00 0.00 C ATOM 225 CG LEU A 16 -5.226 8.893 -4.663 1.00 0.00 C ATOM 226 CD1 LEU A 16 -4.346 7.641 -4.656 1.00 0.00 C ATOM 227 CD2 LEU A 16 -6.684 8.487 -4.896 1.00 0.00 C ATOM 0 H LEU A 16 -4.510 11.479 -1.739 1.00 0.00 H new ATOM 0 HA LEU A 16 -3.083 9.123 -2.780 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -5.486 8.973 -2.518 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -5.746 10.508 -3.322 1.00 0.00 H new ATOM 0 HG LEU A 16 -4.893 9.558 -5.459 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -4.429 7.132 -5.616 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -3.308 7.927 -4.485 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -4.673 6.971 -3.861 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -6.770 7.971 -5.852 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -7.009 7.823 -4.095 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -7.312 9.378 -4.907 1.00 0.00 H new ATOM 239 N PHE A 17 -2.199 9.957 -4.973 1.00 0.00 N ATOM 240 CA PHE A 17 -1.569 10.511 -6.197 1.00 0.00 C ATOM 241 C PHE A 17 -1.874 9.563 -7.352 1.00 0.00 C ATOM 242 O PHE A 17 -1.436 8.428 -7.371 1.00 0.00 O ATOM 243 CB PHE A 17 -0.055 10.607 -5.996 1.00 0.00 C ATOM 244 CG PHE A 17 0.257 11.743 -5.050 1.00 0.00 C ATOM 245 CD1 PHE A 17 0.233 13.065 -5.512 1.00 0.00 C ATOM 246 CD2 PHE A 17 0.570 11.474 -3.713 1.00 0.00 C ATOM 247 CE1 PHE A 17 0.523 14.117 -4.634 1.00 0.00 C ATOM 248 CE2 PHE A 17 0.860 12.526 -2.837 1.00 0.00 C ATOM 249 CZ PHE A 17 0.836 13.848 -3.296 1.00 0.00 C ATOM 0 H PHE A 17 -1.918 9.004 -4.741 1.00 0.00 H new ATOM 0 HA PHE A 17 -1.959 11.507 -6.409 1.00 0.00 H new ATOM 0 HB2 PHE A 17 0.329 9.669 -5.594 1.00 0.00 H new ATOM 0 HB3 PHE A 17 0.440 10.771 -6.953 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -0.009 13.273 -6.544 1.00 0.00 H new ATOM 0 HD2 PHE A 17 0.588 10.454 -3.357 1.00 0.00 H new ATOM 0 HE1 PHE A 17 0.505 15.137 -4.989 1.00 0.00 H new ATOM 0 HE2 PHE A 17 1.103 12.318 -1.805 1.00 0.00 H new ATOM 0 HZ PHE A 17 1.059 14.660 -2.619 1.00 0.00 H new ATOM 259 N LEU A 18 -2.621 10.015 -8.314 1.00 0.00 N ATOM 260 CA LEU A 18 -2.951 9.141 -9.466 1.00 0.00 C ATOM 261 C LEU A 18 -1.692 8.968 -10.292 1.00 0.00 C ATOM 262 O LEU A 18 -1.722 8.494 -11.409 1.00 0.00 O ATOM 263 CB LEU A 18 -4.050 9.793 -10.310 1.00 0.00 C ATOM 264 CG LEU A 18 -5.098 10.421 -9.389 1.00 0.00 C ATOM 265 CD1 LEU A 18 -6.291 10.894 -10.221 1.00 0.00 C ATOM 266 CD2 LEU A 18 -5.573 9.382 -8.368 1.00 0.00 C ATOM 0 H LEU A 18 -3.018 10.954 -8.352 1.00 0.00 H new ATOM 0 HA LEU A 18 -3.312 8.172 -9.122 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -3.620 10.554 -10.961 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -4.517 9.049 -10.955 1.00 0.00 H new ATOM 0 HG LEU A 18 -4.657 11.270 -8.867 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -7.038 11.341 -9.565 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -5.957 11.634 -10.948 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -6.730 10.044 -10.744 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -6.319 9.831 -7.713 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -6.013 8.533 -8.891 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -4.725 9.042 -7.773 1.00 0.00 H new ATOM 278 N SER A 19 -0.577 9.359 -9.741 1.00 0.00 N ATOM 279 CA SER A 19 0.699 9.222 -10.499 1.00 0.00 C ATOM 280 C SER A 19 1.326 7.848 -10.212 1.00 0.00 C ATOM 281 O SER A 19 1.600 7.518 -9.075 1.00 0.00 O ATOM 282 CB SER A 19 1.682 10.319 -10.086 1.00 0.00 C ATOM 283 OG SER A 19 1.051 11.196 -9.163 1.00 0.00 O ATOM 0 H SER A 19 -0.493 9.764 -8.808 1.00 0.00 H new ATOM 0 HA SER A 19 0.485 9.315 -11.564 1.00 0.00 H new ATOM 0 HB2 SER A 19 2.570 9.876 -9.635 1.00 0.00 H new ATOM 0 HB3 SER A 19 2.014 10.874 -10.963 1.00 0.00 H new ATOM 0 HG SER A 19 1.680 11.898 -8.896 1.00 0.00 H new ATOM 289 N PRO A 20 1.559 7.055 -11.228 1.00 0.00 N ATOM 290 CA PRO A 20 2.171 5.711 -11.034 1.00 0.00 C ATOM 291 C PRO A 20 3.596 5.802 -10.468 1.00 0.00 C ATOM 292 O PRO A 20 4.326 6.728 -10.759 1.00 0.00 O ATOM 293 CB PRO A 20 2.194 5.145 -12.457 1.00 0.00 C ATOM 294 CG PRO A 20 1.619 6.194 -13.421 1.00 0.00 C ATOM 295 CD PRO A 20 1.225 7.435 -12.626 1.00 0.00 C ATOM 0 HA PRO A 20 1.621 5.099 -10.319 1.00 0.00 H new ATOM 0 HB2 PRO A 20 3.214 4.889 -12.744 1.00 0.00 H new ATOM 0 HB3 PRO A 20 1.609 4.227 -12.507 1.00 0.00 H new ATOM 0 HG2 PRO A 20 2.357 6.452 -14.181 1.00 0.00 H new ATOM 0 HG3 PRO A 20 0.752 5.790 -13.943 1.00 0.00 H new ATOM 0 HD2 PRO A 20 1.781 8.315 -12.949 1.00 0.00 H new ATOM 0 HD3 PRO A 20 0.166 7.668 -12.739 1.00 0.00 H new ATOM 303 N LYS A 21 4.004 4.842 -9.676 1.00 0.00 N ATOM 304 CA LYS A 21 5.390 4.886 -9.114 1.00 0.00 C ATOM 305 C LYS A 21 5.789 3.490 -8.618 1.00 0.00 C ATOM 306 O LYS A 21 5.088 2.881 -7.841 1.00 0.00 O ATOM 307 CB LYS A 21 5.433 5.874 -7.941 1.00 0.00 C ATOM 308 CG LYS A 21 5.505 7.316 -8.461 1.00 0.00 C ATOM 309 CD LYS A 21 6.123 8.217 -7.389 1.00 0.00 C ATOM 310 CE LYS A 21 5.861 9.683 -7.741 1.00 0.00 C ATOM 311 NZ LYS A 21 6.592 10.561 -6.783 1.00 0.00 N ATOM 0 H LYS A 21 3.444 4.037 -9.396 1.00 0.00 H new ATOM 0 HA LYS A 21 6.085 5.208 -9.890 1.00 0.00 H new ATOM 0 HB2 LYS A 21 4.547 5.749 -7.319 1.00 0.00 H new ATOM 0 HB3 LYS A 21 6.297 5.664 -7.311 1.00 0.00 H new ATOM 0 HG2 LYS A 21 6.102 7.356 -9.372 1.00 0.00 H new ATOM 0 HG3 LYS A 21 4.507 7.671 -8.718 1.00 0.00 H new ATOM 0 HD2 LYS A 21 5.696 7.984 -6.413 1.00 0.00 H new ATOM 0 HD3 LYS A 21 7.195 8.035 -7.320 1.00 0.00 H new ATOM 0 HE2 LYS A 21 6.188 9.888 -8.761 1.00 0.00 H new ATOM 0 HE3 LYS A 21 4.792 9.893 -7.701 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 6.703 11.509 -7.196 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 6.054 10.631 -5.896 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 7.530 10.157 -6.588 1.00 0.00 H new ATOM 325 N SER A 22 6.916 2.985 -9.048 1.00 0.00 N ATOM 326 CA SER A 22 7.352 1.634 -8.584 1.00 0.00 C ATOM 327 C SER A 22 7.206 1.556 -7.063 1.00 0.00 C ATOM 328 O SER A 22 7.344 2.543 -6.372 1.00 0.00 O ATOM 329 CB SER A 22 8.813 1.411 -8.970 1.00 0.00 C ATOM 330 OG SER A 22 8.913 1.307 -10.384 1.00 0.00 O ATOM 0 H SER A 22 7.551 3.448 -9.698 1.00 0.00 H new ATOM 0 HA SER A 22 6.735 0.867 -9.051 1.00 0.00 H new ATOM 0 HB2 SER A 22 9.427 2.237 -8.610 1.00 0.00 H new ATOM 0 HB3 SER A 22 9.191 0.504 -8.499 1.00 0.00 H new ATOM 0 HG SER A 22 8.794 0.372 -10.652 1.00 0.00 H new ATOM 336 N TRP A 23 6.930 0.397 -6.530 1.00 0.00 N ATOM 337 CA TRP A 23 6.786 0.290 -5.052 1.00 0.00 C ATOM 338 C TRP A 23 8.070 0.790 -4.406 1.00 0.00 C ATOM 339 O TRP A 23 8.094 1.194 -3.262 1.00 0.00 O ATOM 340 CB TRP A 23 6.553 -1.170 -4.653 1.00 0.00 C ATOM 341 CG TRP A 23 6.550 -1.281 -3.162 1.00 0.00 C ATOM 342 CD1 TRP A 23 5.441 -1.374 -2.392 1.00 0.00 C ATOM 343 CD2 TRP A 23 7.686 -1.307 -2.249 1.00 0.00 C ATOM 344 NE1 TRP A 23 5.826 -1.457 -1.065 1.00 0.00 N ATOM 345 CE2 TRP A 23 7.198 -1.419 -0.926 1.00 0.00 C ATOM 346 CE3 TRP A 23 9.080 -1.246 -2.440 1.00 0.00 C ATOM 347 CZ2 TRP A 23 8.061 -1.467 0.169 1.00 0.00 C ATOM 348 CZ3 TRP A 23 9.950 -1.295 -1.339 1.00 0.00 C ATOM 349 CH2 TRP A 23 9.442 -1.406 -0.037 1.00 0.00 C ATOM 0 H TRP A 23 6.799 -0.472 -7.048 1.00 0.00 H new ATOM 0 HA TRP A 23 5.936 0.886 -4.720 1.00 0.00 H new ATOM 0 HB2 TRP A 23 5.604 -1.522 -5.057 1.00 0.00 H new ATOM 0 HB3 TRP A 23 7.334 -1.803 -5.075 1.00 0.00 H new ATOM 0 HD1 TRP A 23 4.423 -1.382 -2.753 1.00 0.00 H new ATOM 0 HE1 TRP A 23 5.174 -1.537 -0.284 1.00 0.00 H new ATOM 0 HE3 TRP A 23 9.482 -1.161 -3.439 1.00 0.00 H new ATOM 0 HZ2 TRP A 23 7.664 -1.551 1.170 1.00 0.00 H new ATOM 0 HZ3 TRP A 23 11.017 -1.247 -1.496 1.00 0.00 H new ATOM 0 HH2 TRP A 23 10.117 -1.444 0.805 1.00 0.00 H new ATOM 360 N THR A 24 9.141 0.765 -5.145 1.00 0.00 N ATOM 361 CA THR A 24 10.446 1.233 -4.602 1.00 0.00 C ATOM 362 C THR A 24 10.605 2.721 -4.913 1.00 0.00 C ATOM 363 O THR A 24 11.398 3.418 -4.312 1.00 0.00 O ATOM 364 CB THR A 24 11.575 0.437 -5.263 1.00 0.00 C ATOM 365 OG1 THR A 24 12.778 0.633 -4.535 1.00 0.00 O ATOM 366 CG2 THR A 24 11.765 0.906 -6.709 1.00 0.00 C ATOM 0 H THR A 24 9.169 0.438 -6.111 1.00 0.00 H new ATOM 0 HA THR A 24 10.484 1.083 -3.523 1.00 0.00 H new ATOM 0 HB THR A 24 11.318 -0.622 -5.264 1.00 0.00 H new ATOM 0 HG1 THR A 24 13.502 0.123 -4.956 1.00 0.00 H new ATOM 0 HG21 THR A 24 12.570 0.336 -7.174 1.00 0.00 H new ATOM 0 HG22 THR A 24 10.841 0.750 -7.266 1.00 0.00 H new ATOM 0 HG23 THR A 24 12.020 1.966 -6.717 1.00 0.00 H new ATOM 374 N ASP A 25 9.847 3.200 -5.855 1.00 0.00 N ATOM 375 CA ASP A 25 9.925 4.637 -6.239 1.00 0.00 C ATOM 376 C ASP A 25 8.988 5.445 -5.349 1.00 0.00 C ATOM 377 O ASP A 25 9.335 6.508 -4.871 1.00 0.00 O ATOM 378 CB ASP A 25 9.503 4.798 -7.700 1.00 0.00 C ATOM 379 CG ASP A 25 9.371 6.285 -8.037 1.00 0.00 C ATOM 380 OD1 ASP A 25 10.038 7.079 -7.393 1.00 0.00 O ATOM 381 OD2 ASP A 25 8.607 6.603 -8.933 1.00 0.00 O ATOM 0 H ASP A 25 9.168 2.652 -6.383 1.00 0.00 H new ATOM 0 HA ASP A 25 10.947 4.994 -6.116 1.00 0.00 H new ATOM 0 HB2 ASP A 25 10.238 4.331 -8.355 1.00 0.00 H new ATOM 0 HB3 ASP A 25 8.554 4.290 -7.873 1.00 0.00 H new ATOM 386 N ALA A 26 7.813 4.942 -5.097 1.00 0.00 N ATOM 387 CA ALA A 26 6.880 5.671 -4.221 1.00 0.00 C ATOM 388 C ALA A 26 7.402 5.522 -2.803 1.00 0.00 C ATOM 389 O ALA A 26 7.248 6.388 -1.969 1.00 0.00 O ATOM 390 CB ALA A 26 5.490 5.059 -4.344 1.00 0.00 C ATOM 0 H ALA A 26 7.465 4.056 -5.464 1.00 0.00 H new ATOM 0 HA ALA A 26 6.811 6.724 -4.495 1.00 0.00 H new ATOM 0 HB1 ALA A 26 4.797 5.597 -3.697 1.00 0.00 H new ATOM 0 HB2 ALA A 26 5.151 5.131 -5.377 1.00 0.00 H new ATOM 0 HB3 ALA A 26 5.526 4.011 -4.046 1.00 0.00 H new ATOM 396 N ASP A 27 8.041 4.418 -2.537 1.00 0.00 N ATOM 397 CA ASP A 27 8.606 4.188 -1.188 1.00 0.00 C ATOM 398 C ASP A 27 9.689 5.235 -0.913 1.00 0.00 C ATOM 399 O ASP A 27 9.774 5.783 0.167 1.00 0.00 O ATOM 400 CB ASP A 27 9.219 2.791 -1.154 1.00 0.00 C ATOM 401 CG ASP A 27 9.988 2.596 0.155 1.00 0.00 C ATOM 402 OD1 ASP A 27 11.007 3.247 0.323 1.00 0.00 O ATOM 403 OD2 ASP A 27 9.547 1.800 0.965 1.00 0.00 O ATOM 0 H ASP A 27 8.195 3.662 -3.204 1.00 0.00 H new ATOM 0 HA ASP A 27 7.828 4.270 -0.429 1.00 0.00 H new ATOM 0 HB2 ASP A 27 8.436 2.038 -1.243 1.00 0.00 H new ATOM 0 HB3 ASP A 27 9.888 2.656 -2.004 1.00 0.00 H new ATOM 408 N LEU A 28 10.518 5.510 -1.882 1.00 0.00 N ATOM 409 CA LEU A 28 11.600 6.517 -1.681 1.00 0.00 C ATOM 410 C LEU A 28 11.002 7.929 -1.662 1.00 0.00 C ATOM 411 O LEU A 28 11.351 8.750 -0.837 1.00 0.00 O ATOM 412 CB LEU A 28 12.618 6.401 -2.825 1.00 0.00 C ATOM 413 CG LEU A 28 14.018 6.756 -2.315 1.00 0.00 C ATOM 414 CD1 LEU A 28 15.008 6.722 -3.481 1.00 0.00 C ATOM 415 CD2 LEU A 28 14.000 8.161 -1.702 1.00 0.00 C ATOM 0 H LEU A 28 10.493 5.080 -2.807 1.00 0.00 H new ATOM 0 HA LEU A 28 12.097 6.330 -0.729 1.00 0.00 H new ATOM 0 HB2 LEU A 28 12.614 5.387 -3.226 1.00 0.00 H new ATOM 0 HB3 LEU A 28 12.339 7.068 -3.641 1.00 0.00 H new ATOM 0 HG LEU A 28 14.322 6.034 -1.557 1.00 0.00 H new ATOM 0 HD11 LEU A 28 16.005 6.974 -3.119 1.00 0.00 H new ATOM 0 HD12 LEU A 28 15.022 5.723 -3.917 1.00 0.00 H new ATOM 0 HD13 LEU A 28 14.703 7.444 -4.238 1.00 0.00 H new ATOM 0 HD21 LEU A 28 14.997 8.413 -1.339 1.00 0.00 H new ATOM 0 HD22 LEU A 28 13.696 8.884 -2.459 1.00 0.00 H new ATOM 0 HD23 LEU A 28 13.295 8.187 -0.871 1.00 0.00 H new ATOM 427 N ALA A 29 10.110 8.222 -2.569 1.00 0.00 N ATOM 428 CA ALA A 29 9.503 9.584 -2.601 1.00 0.00 C ATOM 429 C ALA A 29 8.644 9.804 -1.356 1.00 0.00 C ATOM 430 O ALA A 29 8.811 10.774 -0.645 1.00 0.00 O ATOM 431 CB ALA A 29 8.632 9.726 -3.848 1.00 0.00 C ATOM 0 H ALA A 29 9.776 7.580 -3.287 1.00 0.00 H new ATOM 0 HA ALA A 29 10.300 10.327 -2.623 1.00 0.00 H new ATOM 0 HB1 ALA A 29 8.189 10.722 -3.871 1.00 0.00 H new ATOM 0 HB2 ALA A 29 9.244 9.581 -4.738 1.00 0.00 H new ATOM 0 HB3 ALA A 29 7.841 8.977 -3.826 1.00 0.00 H new ATOM 437 N CYS A 30 7.729 8.916 -1.075 1.00 0.00 N ATOM 438 CA CYS A 30 6.888 9.102 0.133 1.00 0.00 C ATOM 439 C CYS A 30 7.800 9.078 1.357 1.00 0.00 C ATOM 440 O CYS A 30 7.452 9.556 2.417 1.00 0.00 O ATOM 441 CB CYS A 30 5.850 7.984 0.221 1.00 0.00 C ATOM 442 SG CYS A 30 4.728 8.312 1.602 1.00 0.00 S ATOM 0 H CYS A 30 7.532 8.080 -1.625 1.00 0.00 H new ATOM 0 HA CYS A 30 6.359 10.054 0.084 1.00 0.00 H new ATOM 0 HB2 CYS A 30 5.288 7.920 -0.711 1.00 0.00 H new ATOM 0 HB3 CYS A 30 6.345 7.023 0.361 1.00 0.00 H new ATOM 447 N GLN A 31 8.984 8.547 1.207 1.00 0.00 N ATOM 448 CA GLN A 31 9.936 8.522 2.348 1.00 0.00 C ATOM 449 C GLN A 31 10.604 9.891 2.425 1.00 0.00 C ATOM 450 O GLN A 31 10.932 10.382 3.487 1.00 0.00 O ATOM 451 CB GLN A 31 10.997 7.441 2.124 1.00 0.00 C ATOM 452 CG GLN A 31 12.111 7.588 3.163 1.00 0.00 C ATOM 453 CD GLN A 31 12.953 6.312 3.192 1.00 0.00 C ATOM 454 OE1 GLN A 31 12.495 5.278 3.636 1.00 0.00 O ATOM 455 NE2 GLN A 31 14.176 6.340 2.735 1.00 0.00 N ATOM 0 H GLN A 31 9.330 8.130 0.343 1.00 0.00 H new ATOM 0 HA GLN A 31 9.409 8.298 3.276 1.00 0.00 H new ATOM 0 HB2 GLN A 31 10.544 6.452 2.200 1.00 0.00 H new ATOM 0 HB3 GLN A 31 11.410 7.526 1.119 1.00 0.00 H new ATOM 0 HG2 GLN A 31 12.739 8.445 2.920 1.00 0.00 H new ATOM 0 HG3 GLN A 31 11.682 7.776 4.147 1.00 0.00 H new ATOM 0 HE21 GLN A 31 14.561 7.208 2.362 1.00 0.00 H new ATOM 0 HE22 GLN A 31 14.746 5.494 2.751 1.00 0.00 H new ATOM 464 N LYS A 32 10.792 10.512 1.296 1.00 0.00 N ATOM 465 CA LYS A 32 11.421 11.852 1.269 1.00 0.00 C ATOM 466 C LYS A 32 10.511 12.836 2.008 1.00 0.00 C ATOM 467 O LYS A 32 10.833 13.996 2.174 1.00 0.00 O ATOM 468 CB LYS A 32 11.599 12.292 -0.187 1.00 0.00 C ATOM 469 CG LYS A 32 11.997 13.768 -0.242 1.00 0.00 C ATOM 470 CD LYS A 32 12.656 14.073 -1.589 1.00 0.00 C ATOM 471 CE LYS A 32 11.657 13.817 -2.721 1.00 0.00 C ATOM 472 NZ LYS A 32 10.366 14.490 -2.404 1.00 0.00 N ATOM 0 H LYS A 32 10.532 10.141 0.382 1.00 0.00 H new ATOM 0 HA LYS A 32 12.396 11.825 1.755 1.00 0.00 H new ATOM 0 HB2 LYS A 32 12.363 11.682 -0.669 1.00 0.00 H new ATOM 0 HB3 LYS A 32 10.672 12.136 -0.739 1.00 0.00 H new ATOM 0 HG2 LYS A 32 11.118 14.397 -0.105 1.00 0.00 H new ATOM 0 HG3 LYS A 32 12.685 14.000 0.571 1.00 0.00 H new ATOM 0 HD2 LYS A 32 12.991 15.110 -1.614 1.00 0.00 H new ATOM 0 HD3 LYS A 32 13.540 13.449 -1.722 1.00 0.00 H new ATOM 0 HE2 LYS A 32 12.054 14.194 -3.663 1.00 0.00 H new ATOM 0 HE3 LYS A 32 11.500 12.746 -2.847 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 9.746 14.463 -3.239 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 9.903 13.998 -1.613 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 10.546 15.479 -2.139 1.00 0.00 H new ATOM 486 N ARG A 33 9.372 12.372 2.454 1.00 0.00 N ATOM 487 CA ARG A 33 8.425 13.263 3.185 1.00 0.00 C ATOM 488 C ARG A 33 8.725 13.200 4.684 1.00 0.00 C ATOM 489 O ARG A 33 9.350 12.270 5.151 1.00 0.00 O ATOM 490 CB ARG A 33 6.989 12.787 2.916 1.00 0.00 C ATOM 491 CG ARG A 33 6.382 13.585 1.756 1.00 0.00 C ATOM 492 CD ARG A 33 7.156 13.290 0.470 1.00 0.00 C ATOM 493 NE ARG A 33 6.498 13.977 -0.676 1.00 0.00 N ATOM 494 CZ ARG A 33 6.719 13.572 -1.896 1.00 0.00 C ATOM 495 NH1 ARG A 33 7.907 13.703 -2.421 1.00 0.00 N ATOM 496 NH2 ARG A 33 5.755 13.034 -2.591 1.00 0.00 N ATOM 0 H ARG A 33 9.057 11.408 2.342 1.00 0.00 H new ATOM 0 HA ARG A 33 8.537 14.292 2.844 1.00 0.00 H new ATOM 0 HB2 ARG A 33 6.988 11.724 2.677 1.00 0.00 H new ATOM 0 HB3 ARG A 33 6.381 12.913 3.812 1.00 0.00 H new ATOM 0 HG2 ARG A 33 5.332 13.320 1.629 1.00 0.00 H new ATOM 0 HG3 ARG A 33 6.417 14.652 1.977 1.00 0.00 H new ATOM 0 HD2 ARG A 33 8.187 13.630 0.568 1.00 0.00 H new ATOM 0 HD3 ARG A 33 7.190 12.215 0.292 1.00 0.00 H new ATOM 0 HE ARG A 33 5.874 14.765 -0.507 1.00 0.00 H new ATOM 0 HH11 ARG A 33 8.662 14.122 -1.877 1.00 0.00 H new ATOM 0 HH12 ARG A 33 8.081 13.387 -3.375 1.00 0.00 H new ATOM 0 HH21 ARG A 33 4.827 12.930 -2.180 1.00 0.00 H new ATOM 0 HH22 ARG A 33 5.929 12.718 -3.545 1.00 0.00 H new ATOM 510 N PRO A 34 8.282 14.180 5.439 1.00 0.00 N ATOM 511 CA PRO A 34 8.524 14.190 6.904 1.00 0.00 C ATOM 512 C PRO A 34 8.183 12.839 7.535 1.00 0.00 C ATOM 513 O PRO A 34 7.113 12.637 8.072 1.00 0.00 O ATOM 514 CB PRO A 34 7.587 15.307 7.388 1.00 0.00 C ATOM 515 CG PRO A 34 6.865 15.903 6.168 1.00 0.00 C ATOM 516 CD PRO A 34 7.509 15.330 4.900 1.00 0.00 C ATOM 0 HA PRO A 34 9.566 14.360 7.175 1.00 0.00 H new ATOM 0 HB2 PRO A 34 6.863 14.912 8.100 1.00 0.00 H new ATOM 0 HB3 PRO A 34 8.155 16.079 7.906 1.00 0.00 H new ATOM 0 HG2 PRO A 34 5.803 15.658 6.198 1.00 0.00 H new ATOM 0 HG3 PRO A 34 6.942 16.990 6.175 1.00 0.00 H new ATOM 0 HD2 PRO A 34 6.763 15.014 4.170 1.00 0.00 H new ATOM 0 HD3 PRO A 34 8.152 16.057 4.404 1.00 0.00 H new ATOM 524 N SER A 35 9.092 11.908 7.451 1.00 0.00 N ATOM 525 CA SER A 35 8.838 10.562 8.019 1.00 0.00 C ATOM 526 C SER A 35 7.717 9.891 7.228 1.00 0.00 C ATOM 527 O SER A 35 7.129 8.922 7.663 1.00 0.00 O ATOM 528 CB SER A 35 8.437 10.684 9.491 1.00 0.00 C ATOM 529 OG SER A 35 9.145 11.768 10.079 1.00 0.00 O ATOM 0 H SER A 35 10.004 12.026 7.010 1.00 0.00 H new ATOM 0 HA SER A 35 9.744 9.960 7.952 1.00 0.00 H new ATOM 0 HB2 SER A 35 7.363 10.847 9.576 1.00 0.00 H new ATOM 0 HB3 SER A 35 8.661 9.758 10.020 1.00 0.00 H new ATOM 0 HG SER A 35 8.891 11.852 11.022 1.00 0.00 H new ATOM 535 N GLY A 36 7.415 10.402 6.065 1.00 0.00 N ATOM 536 CA GLY A 36 6.329 9.791 5.252 1.00 0.00 C ATOM 537 C GLY A 36 6.789 8.443 4.689 1.00 0.00 C ATOM 538 O GLY A 36 7.881 7.985 4.955 1.00 0.00 O ATOM 0 H GLY A 36 7.872 11.212 5.646 1.00 0.00 H new ATOM 0 HA2 GLY A 36 5.438 9.653 5.865 1.00 0.00 H new ATOM 0 HA3 GLY A 36 6.054 10.460 4.437 1.00 0.00 H new ATOM 542 N ASN A 37 5.952 7.807 3.914 1.00 0.00 N ATOM 543 CA ASN A 37 6.301 6.484 3.314 1.00 0.00 C ATOM 544 C ASN A 37 5.006 5.827 2.823 1.00 0.00 C ATOM 545 O ASN A 37 3.964 5.988 3.430 1.00 0.00 O ATOM 546 CB ASN A 37 6.972 5.586 4.369 1.00 0.00 C ATOM 547 CG ASN A 37 8.490 5.579 4.160 1.00 0.00 C ATOM 548 OD1 ASN A 37 8.970 5.108 3.150 1.00 0.00 O ATOM 549 ND2 ASN A 37 9.269 6.075 5.084 1.00 0.00 N ATOM 0 H ASN A 37 5.025 8.154 3.667 1.00 0.00 H new ATOM 0 HA ASN A 37 6.996 6.621 2.485 1.00 0.00 H new ATOM 0 HB2 ASN A 37 6.736 5.947 5.370 1.00 0.00 H new ATOM 0 HB3 ASN A 37 6.582 4.571 4.296 1.00 0.00 H new ATOM 0 HD21 ASN A 37 10.281 6.066 4.956 1.00 0.00 H new ATOM 0 HD22 ASN A 37 8.865 6.471 5.933 1.00 0.00 H new ATOM 556 N LEU A 38 5.055 5.113 1.720 1.00 0.00 N ATOM 557 CA LEU A 38 3.818 4.458 1.186 1.00 0.00 C ATOM 558 C LEU A 38 2.793 4.242 2.309 1.00 0.00 C ATOM 559 O LEU A 38 3.128 3.838 3.403 1.00 0.00 O ATOM 560 CB LEU A 38 4.196 3.113 0.566 1.00 0.00 C ATOM 561 CG LEU A 38 4.891 3.351 -0.774 1.00 0.00 C ATOM 562 CD1 LEU A 38 5.599 2.069 -1.225 1.00 0.00 C ATOM 563 CD2 LEU A 38 3.855 3.765 -1.822 1.00 0.00 C ATOM 0 H LEU A 38 5.898 4.957 1.168 1.00 0.00 H new ATOM 0 HA LEU A 38 3.369 5.104 0.431 1.00 0.00 H new ATOM 0 HB2 LEU A 38 4.855 2.563 1.238 1.00 0.00 H new ATOM 0 HB3 LEU A 38 3.305 2.502 0.423 1.00 0.00 H new ATOM 0 HG LEU A 38 5.628 4.146 -0.662 1.00 0.00 H new ATOM 0 HD11 LEU A 38 6.093 2.243 -2.181 1.00 0.00 H new ATOM 0 HD12 LEU A 38 6.341 1.782 -0.480 1.00 0.00 H new ATOM 0 HD13 LEU A 38 4.867 1.269 -1.335 1.00 0.00 H new ATOM 0 HD21 LEU A 38 4.352 3.935 -2.777 1.00 0.00 H new ATOM 0 HD22 LEU A 38 3.114 2.973 -1.934 1.00 0.00 H new ATOM 0 HD23 LEU A 38 3.361 4.682 -1.502 1.00 0.00 H new ATOM 575 N VAL A 39 1.550 4.534 2.041 1.00 0.00 N ATOM 576 CA VAL A 39 0.482 4.382 3.075 1.00 0.00 C ATOM 577 C VAL A 39 0.704 3.131 3.932 1.00 0.00 C ATOM 578 O VAL A 39 1.245 2.137 3.487 1.00 0.00 O ATOM 579 CB VAL A 39 -0.877 4.283 2.380 1.00 0.00 C ATOM 580 CG1 VAL A 39 -0.780 3.314 1.201 1.00 0.00 C ATOM 581 CG2 VAL A 39 -1.934 3.775 3.365 1.00 0.00 C ATOM 0 H VAL A 39 1.223 4.876 1.138 1.00 0.00 H new ATOM 0 HA VAL A 39 0.514 5.252 3.731 1.00 0.00 H new ATOM 0 HB VAL A 39 -1.164 5.272 2.022 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -1.749 3.244 0.707 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -0.036 3.677 0.492 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -0.486 2.329 1.563 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -2.898 3.708 2.861 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -1.646 2.789 3.731 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -2.011 4.466 4.205 1.00 0.00 H new ATOM 591 N SER A 40 0.270 3.188 5.165 1.00 0.00 N ATOM 592 CA SER A 40 0.421 2.024 6.092 1.00 0.00 C ATOM 593 C SER A 40 -0.958 1.387 6.330 1.00 0.00 C ATOM 594 O SER A 40 -1.964 1.884 5.866 1.00 0.00 O ATOM 595 CB SER A 40 0.995 2.517 7.423 1.00 0.00 C ATOM 596 OG SER A 40 0.230 1.984 8.497 1.00 0.00 O ATOM 0 H SER A 40 -0.189 4.002 5.575 1.00 0.00 H new ATOM 0 HA SER A 40 1.093 1.284 5.656 1.00 0.00 H new ATOM 0 HB2 SER A 40 2.037 2.211 7.518 1.00 0.00 H new ATOM 0 HB3 SER A 40 0.979 3.606 7.457 1.00 0.00 H new ATOM 0 HG SER A 40 0.599 2.299 9.349 1.00 0.00 H new ATOM 602 N VAL A 41 -1.016 0.294 7.054 1.00 0.00 N ATOM 603 CA VAL A 41 -2.337 -0.356 7.315 1.00 0.00 C ATOM 604 C VAL A 41 -2.195 -1.361 8.473 1.00 0.00 C ATOM 605 O VAL A 41 -1.957 -2.533 8.261 1.00 0.00 O ATOM 606 CB VAL A 41 -2.837 -1.091 6.045 1.00 0.00 C ATOM 607 CG1 VAL A 41 -4.164 -0.490 5.586 1.00 0.00 C ATOM 608 CG2 VAL A 41 -1.821 -0.963 4.902 1.00 0.00 C ATOM 0 H VAL A 41 -0.211 -0.172 7.472 1.00 0.00 H new ATOM 0 HA VAL A 41 -3.062 0.412 7.583 1.00 0.00 H new ATOM 0 HB VAL A 41 -2.965 -2.144 6.295 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -4.510 -1.011 4.693 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -4.905 -0.596 6.378 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -4.025 0.567 5.359 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -2.195 -1.487 4.022 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -1.674 0.090 4.662 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -0.871 -1.401 5.209 1.00 0.00 H new ATOM 618 N LEU A 42 -2.339 -0.913 9.695 1.00 0.00 N ATOM 619 CA LEU A 42 -2.210 -1.844 10.865 1.00 0.00 C ATOM 620 C LEU A 42 -3.549 -1.967 11.595 1.00 0.00 C ATOM 621 O LEU A 42 -3.611 -2.471 12.699 1.00 0.00 O ATOM 622 CB LEU A 42 -1.165 -1.306 11.839 1.00 0.00 C ATOM 623 CG LEU A 42 0.226 -1.426 11.221 1.00 0.00 C ATOM 624 CD1 LEU A 42 1.203 -0.558 12.015 1.00 0.00 C ATOM 625 CD2 LEU A 42 0.688 -2.886 11.264 1.00 0.00 C ATOM 0 H LEU A 42 -2.540 0.057 9.936 1.00 0.00 H new ATOM 0 HA LEU A 42 -1.906 -2.824 10.497 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -1.379 -0.264 12.077 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -1.206 -1.862 12.775 1.00 0.00 H new ATOM 0 HG LEU A 42 0.194 -1.092 10.184 1.00 0.00 H new ATOM 0 HD11 LEU A 42 2.199 -0.639 11.579 1.00 0.00 H new ATOM 0 HD12 LEU A 42 0.876 0.481 11.982 1.00 0.00 H new ATOM 0 HD13 LEU A 42 1.232 -0.897 13.051 1.00 0.00 H new ATOM 0 HD21 LEU A 42 1.681 -2.967 10.822 1.00 0.00 H new ATOM 0 HD22 LEU A 42 0.723 -3.226 12.299 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -0.011 -3.505 10.702 1.00 0.00 H new ATOM 637 N SER A 43 -4.621 -1.514 11.003 1.00 0.00 N ATOM 638 CA SER A 43 -5.943 -1.616 11.692 1.00 0.00 C ATOM 639 C SER A 43 -7.026 -1.998 10.683 1.00 0.00 C ATOM 640 O SER A 43 -6.974 -1.631 9.527 1.00 0.00 O ATOM 641 CB SER A 43 -6.290 -0.266 12.322 1.00 0.00 C ATOM 642 OG SER A 43 -5.357 0.025 13.354 1.00 0.00 O ATOM 0 H SER A 43 -4.641 -1.081 10.080 1.00 0.00 H new ATOM 0 HA SER A 43 -5.888 -2.381 12.466 1.00 0.00 H new ATOM 0 HB2 SER A 43 -6.268 0.518 11.565 1.00 0.00 H new ATOM 0 HB3 SER A 43 -7.302 -0.290 12.727 1.00 0.00 H new ATOM 0 HG SER A 43 -5.576 0.890 13.758 1.00 0.00 H new ATOM 648 N GLY A 44 -8.019 -2.727 11.120 1.00 0.00 N ATOM 649 CA GLY A 44 -9.114 -3.127 10.193 1.00 0.00 C ATOM 650 C GLY A 44 -9.859 -1.876 9.732 1.00 0.00 C ATOM 651 O GLY A 44 -10.538 -1.880 8.726 1.00 0.00 O ATOM 0 H GLY A 44 -8.118 -3.062 12.078 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -8.704 -3.659 9.334 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -9.800 -3.810 10.694 1.00 0.00 H new ATOM 655 N ALA A 45 -9.732 -0.804 10.463 1.00 0.00 N ATOM 656 CA ALA A 45 -10.424 0.455 10.072 1.00 0.00 C ATOM 657 C ALA A 45 -9.555 1.214 9.070 1.00 0.00 C ATOM 658 O ALA A 45 -10.048 1.903 8.202 1.00 0.00 O ATOM 659 CB ALA A 45 -10.644 1.322 11.311 1.00 0.00 C ATOM 0 H ALA A 45 -9.177 -0.746 11.317 1.00 0.00 H new ATOM 0 HA ALA A 45 -11.387 0.218 9.620 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -11.151 2.244 11.025 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -11.257 0.779 12.031 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -9.681 1.562 11.763 1.00 0.00 H new ATOM 665 N GLU A 46 -8.261 1.090 9.184 1.00 0.00 N ATOM 666 CA GLU A 46 -7.355 1.802 8.240 1.00 0.00 C ATOM 667 C GLU A 46 -7.417 1.120 6.872 1.00 0.00 C ATOM 668 O GLU A 46 -7.429 1.769 5.846 1.00 0.00 O ATOM 669 CB GLU A 46 -5.922 1.755 8.771 1.00 0.00 C ATOM 670 CG GLU A 46 -5.050 2.726 7.974 1.00 0.00 C ATOM 671 CD GLU A 46 -3.652 2.784 8.595 1.00 0.00 C ATOM 672 OE1 GLU A 46 -3.483 2.246 9.677 1.00 0.00 O ATOM 673 OE2 GLU A 46 -2.775 3.367 7.979 1.00 0.00 O ATOM 0 H GLU A 46 -7.792 0.525 9.892 1.00 0.00 H new ATOM 0 HA GLU A 46 -7.669 2.841 8.145 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -5.906 2.019 9.828 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -5.526 0.743 8.689 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -4.985 2.404 6.935 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -5.500 3.719 7.972 1.00 0.00 H new ATOM 680 N GLY A 47 -7.463 -0.184 6.849 1.00 0.00 N ATOM 681 CA GLY A 47 -7.529 -0.900 5.542 1.00 0.00 C ATOM 682 C GLY A 47 -8.824 -0.517 4.829 1.00 0.00 C ATOM 683 O GLY A 47 -8.881 -0.440 3.618 1.00 0.00 O ATOM 0 H GLY A 47 -7.458 -0.783 7.675 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -6.669 -0.639 4.926 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -7.491 -1.978 5.701 1.00 0.00 H new ATOM 687 N SER A 48 -9.863 -0.261 5.574 1.00 0.00 N ATOM 688 CA SER A 48 -11.155 0.132 4.946 1.00 0.00 C ATOM 689 C SER A 48 -11.128 1.636 4.675 1.00 0.00 C ATOM 690 O SER A 48 -11.738 2.122 3.743 1.00 0.00 O ATOM 691 CB SER A 48 -12.306 -0.197 5.896 1.00 0.00 C ATOM 692 OG SER A 48 -12.454 0.858 6.837 1.00 0.00 O ATOM 0 H SER A 48 -9.873 -0.307 6.593 1.00 0.00 H new ATOM 0 HA SER A 48 -11.297 -0.412 4.012 1.00 0.00 H new ATOM 0 HB2 SER A 48 -13.230 -0.331 5.334 1.00 0.00 H new ATOM 0 HB3 SER A 48 -12.109 -1.136 6.413 1.00 0.00 H new ATOM 0 HG SER A 48 -11.590 1.040 7.263 1.00 0.00 H new ATOM 698 N PHE A 49 -10.418 2.375 5.483 1.00 0.00 N ATOM 699 CA PHE A 49 -10.341 3.846 5.276 1.00 0.00 C ATOM 700 C PHE A 49 -9.523 4.134 4.017 1.00 0.00 C ATOM 701 O PHE A 49 -9.940 4.876 3.150 1.00 0.00 O ATOM 702 CB PHE A 49 -9.667 4.497 6.485 1.00 0.00 C ATOM 703 CG PHE A 49 -9.864 5.993 6.423 1.00 0.00 C ATOM 704 CD1 PHE A 49 -11.072 6.557 6.852 1.00 0.00 C ATOM 705 CD2 PHE A 49 -8.840 6.814 5.940 1.00 0.00 C ATOM 706 CE1 PHE A 49 -11.255 7.943 6.795 1.00 0.00 C ATOM 707 CE2 PHE A 49 -9.024 8.201 5.883 1.00 0.00 C ATOM 708 CZ PHE A 49 -10.230 8.766 6.310 1.00 0.00 C ATOM 0 H PHE A 49 -9.887 2.021 6.279 1.00 0.00 H new ATOM 0 HA PHE A 49 -11.345 4.254 5.161 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -10.090 4.101 7.408 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -8.603 4.259 6.494 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -11.862 5.923 7.227 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -7.908 6.379 5.611 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -12.187 8.379 7.125 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -8.234 8.835 5.509 1.00 0.00 H new ATOM 0 HZ PHE A 49 -10.371 9.836 6.266 1.00 0.00 H new ATOM 718 N VAL A 50 -8.360 3.547 3.904 1.00 0.00 N ATOM 719 CA VAL A 50 -7.529 3.789 2.693 1.00 0.00 C ATOM 720 C VAL A 50 -8.313 3.339 1.461 1.00 0.00 C ATOM 721 O VAL A 50 -8.285 3.976 0.429 1.00 0.00 O ATOM 722 CB VAL A 50 -6.224 2.993 2.786 1.00 0.00 C ATOM 723 CG1 VAL A 50 -5.351 3.303 1.569 1.00 0.00 C ATOM 724 CG2 VAL A 50 -5.476 3.388 4.062 1.00 0.00 C ATOM 0 H VAL A 50 -7.954 2.915 4.594 1.00 0.00 H new ATOM 0 HA VAL A 50 -7.291 4.850 2.619 1.00 0.00 H new ATOM 0 HB VAL A 50 -6.449 1.927 2.811 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -4.422 2.737 1.634 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -5.883 3.024 0.659 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -5.125 4.369 1.545 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -4.547 2.822 4.129 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -5.250 4.454 4.036 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -6.097 3.170 4.930 1.00 0.00 H new ATOM 734 N SER A 51 -9.018 2.244 1.568 1.00 0.00 N ATOM 735 CA SER A 51 -9.809 1.755 0.407 1.00 0.00 C ATOM 736 C SER A 51 -10.775 2.852 -0.043 1.00 0.00 C ATOM 737 O SER A 51 -10.984 3.059 -1.219 1.00 0.00 O ATOM 738 CB SER A 51 -10.602 0.515 0.820 1.00 0.00 C ATOM 739 OG SER A 51 -11.650 0.295 -0.116 1.00 0.00 O ATOM 0 H SER A 51 -9.079 1.670 2.409 1.00 0.00 H new ATOM 0 HA SER A 51 -9.138 1.500 -0.413 1.00 0.00 H new ATOM 0 HB2 SER A 51 -9.946 -0.354 0.860 1.00 0.00 H new ATOM 0 HB3 SER A 51 -11.014 0.649 1.820 1.00 0.00 H new ATOM 0 HG SER A 51 -11.700 -0.659 -0.333 1.00 0.00 H new ATOM 745 N SER A 52 -11.362 3.555 0.886 1.00 0.00 N ATOM 746 CA SER A 52 -12.315 4.640 0.511 1.00 0.00 C ATOM 747 C SER A 52 -11.537 5.834 -0.049 1.00 0.00 C ATOM 748 O SER A 52 -12.065 6.638 -0.791 1.00 0.00 O ATOM 749 CB SER A 52 -13.098 5.080 1.749 1.00 0.00 C ATOM 750 OG SER A 52 -13.718 6.333 1.492 1.00 0.00 O ATOM 0 H SER A 52 -11.224 3.426 1.888 1.00 0.00 H new ATOM 0 HA SER A 52 -13.006 4.269 -0.246 1.00 0.00 H new ATOM 0 HB2 SER A 52 -13.851 4.334 2.001 1.00 0.00 H new ATOM 0 HB3 SER A 52 -12.430 5.161 2.606 1.00 0.00 H new ATOM 0 HG SER A 52 -14.222 6.617 2.283 1.00 0.00 H new ATOM 756 N LEU A 53 -10.285 5.950 0.298 1.00 0.00 N ATOM 757 CA LEU A 53 -9.470 7.086 -0.211 1.00 0.00 C ATOM 758 C LEU A 53 -9.054 6.793 -1.652 1.00 0.00 C ATOM 759 O LEU A 53 -8.776 7.688 -2.424 1.00 0.00 O ATOM 760 CB LEU A 53 -8.222 7.237 0.676 1.00 0.00 C ATOM 761 CG LEU A 53 -7.127 8.028 -0.050 1.00 0.00 C ATOM 762 CD1 LEU A 53 -7.602 9.465 -0.293 1.00 0.00 C ATOM 763 CD2 LEU A 53 -5.866 8.059 0.818 1.00 0.00 C ATOM 0 H LEU A 53 -9.791 5.304 0.914 1.00 0.00 H new ATOM 0 HA LEU A 53 -10.047 8.010 -0.185 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -8.489 7.745 1.603 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -7.844 6.252 0.950 1.00 0.00 H new ATOM 0 HG LEU A 53 -6.910 7.549 -1.005 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -6.821 10.024 -0.809 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -8.504 9.452 -0.905 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -7.819 9.943 0.662 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -5.085 8.621 0.305 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -6.092 8.538 1.771 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -5.522 7.040 0.997 1.00 0.00 H new ATOM 775 N VAL A 54 -8.994 5.541 -2.015 1.00 0.00 N ATOM 776 CA VAL A 54 -8.577 5.179 -3.398 1.00 0.00 C ATOM 777 C VAL A 54 -9.688 4.392 -4.097 1.00 0.00 C ATOM 778 O VAL A 54 -9.463 3.739 -5.094 1.00 0.00 O ATOM 779 CB VAL A 54 -7.297 4.344 -3.322 1.00 0.00 C ATOM 780 CG1 VAL A 54 -6.241 5.122 -2.535 1.00 0.00 C ATOM 781 CG2 VAL A 54 -7.577 3.018 -2.609 1.00 0.00 C ATOM 0 H VAL A 54 -9.217 4.751 -1.410 1.00 0.00 H new ATOM 0 HA VAL A 54 -8.389 6.084 -3.976 1.00 0.00 H new ATOM 0 HB VAL A 54 -6.940 4.140 -4.331 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -5.325 4.534 -2.476 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -6.034 6.066 -3.039 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -6.610 5.321 -1.529 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -6.660 2.431 -2.560 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -7.935 3.217 -1.599 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -8.335 2.462 -3.160 1.00 0.00 H new ATOM 791 N LYS A 55 -10.889 4.452 -3.587 1.00 0.00 N ATOM 792 CA LYS A 55 -12.011 3.710 -4.229 1.00 0.00 C ATOM 793 C LYS A 55 -12.356 4.374 -5.564 1.00 0.00 C ATOM 794 O LYS A 55 -12.828 3.736 -6.485 1.00 0.00 O ATOM 795 CB LYS A 55 -13.237 3.740 -3.314 1.00 0.00 C ATOM 796 CG LYS A 55 -14.387 2.973 -3.971 1.00 0.00 C ATOM 797 CD LYS A 55 -15.582 2.913 -3.013 1.00 0.00 C ATOM 798 CE LYS A 55 -15.214 2.098 -1.767 1.00 0.00 C ATOM 799 NZ LYS A 55 -16.438 1.447 -1.224 1.00 0.00 N ATOM 0 H LYS A 55 -11.141 4.983 -2.753 1.00 0.00 H new ATOM 0 HA LYS A 55 -11.713 2.675 -4.399 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -12.994 3.295 -2.349 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -13.536 4.771 -3.123 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -14.678 3.461 -4.901 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -14.064 1.964 -4.228 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -15.878 3.921 -2.724 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -16.438 2.461 -3.514 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -14.469 1.344 -2.019 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -14.768 2.747 -1.013 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -16.191 0.894 -0.379 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -17.135 2.176 -0.969 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -16.844 0.816 -1.944 1.00 0.00 H new ATOM 896 N SER A 62 -6.841 0.000 -11.562 1.00 0.00 N ATOM 897 CA SER A 62 -7.619 -0.881 -10.639 1.00 0.00 C ATOM 898 C SER A 62 -6.794 -1.202 -9.392 1.00 0.00 C ATOM 899 O SER A 62 -7.334 -1.395 -8.323 1.00 0.00 O ATOM 900 CB SER A 62 -7.968 -2.182 -11.371 1.00 0.00 C ATOM 901 OG SER A 62 -6.983 -2.435 -12.365 1.00 0.00 O ATOM 0 HA SER A 62 -8.530 -0.367 -10.333 1.00 0.00 H new ATOM 0 HB2 SER A 62 -8.011 -3.011 -10.665 1.00 0.00 H new ATOM 0 HB3 SER A 62 -8.954 -2.103 -11.830 1.00 0.00 H new ATOM 0 HG SER A 62 -6.507 -1.604 -12.573 1.00 0.00 H new ATOM 907 N TYR A 63 -5.498 -1.278 -9.511 1.00 0.00 N ATOM 908 CA TYR A 63 -4.671 -1.609 -8.314 1.00 0.00 C ATOM 909 C TYR A 63 -3.951 -0.361 -7.799 1.00 0.00 C ATOM 910 O TYR A 63 -3.851 0.641 -8.479 1.00 0.00 O ATOM 911 CB TYR A 63 -3.652 -2.682 -8.692 1.00 0.00 C ATOM 912 CG TYR A 63 -4.347 -4.020 -8.806 1.00 0.00 C ATOM 913 CD1 TYR A 63 -5.325 -4.220 -9.788 1.00 0.00 C ATOM 914 CD2 TYR A 63 -4.014 -5.062 -7.932 1.00 0.00 C ATOM 915 CE1 TYR A 63 -5.968 -5.458 -9.894 1.00 0.00 C ATOM 916 CE2 TYR A 63 -4.658 -6.300 -8.039 1.00 0.00 C ATOM 917 CZ TYR A 63 -5.635 -6.498 -9.021 1.00 0.00 C ATOM 918 OH TYR A 63 -6.269 -7.718 -9.126 1.00 0.00 O ATOM 0 H TYR A 63 -4.978 -1.127 -10.376 1.00 0.00 H new ATOM 0 HA TYR A 63 -5.320 -1.981 -7.521 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -3.174 -2.427 -9.638 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -2.865 -2.732 -7.940 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -5.583 -3.418 -10.464 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -3.259 -4.910 -7.174 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -6.723 -5.611 -10.651 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -4.401 -7.103 -7.364 1.00 0.00 H new ATOM 0 HH TYR A 63 -5.919 -8.329 -8.444 1.00 0.00 H new ATOM 928 N VAL A 64 -3.461 -0.416 -6.588 1.00 0.00 N ATOM 929 CA VAL A 64 -2.755 0.763 -5.999 1.00 0.00 C ATOM 930 C VAL A 64 -1.578 0.268 -5.145 1.00 0.00 C ATOM 931 O VAL A 64 -1.686 -0.704 -4.431 1.00 0.00 O ATOM 932 CB VAL A 64 -3.766 1.537 -5.135 1.00 0.00 C ATOM 933 CG1 VAL A 64 -3.097 2.719 -4.431 1.00 0.00 C ATOM 934 CG2 VAL A 64 -4.895 2.053 -6.028 1.00 0.00 C ATOM 0 H VAL A 64 -3.519 -1.231 -5.978 1.00 0.00 H new ATOM 0 HA VAL A 64 -2.364 1.417 -6.778 1.00 0.00 H new ATOM 0 HB VAL A 64 -4.161 0.863 -4.375 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -3.835 3.248 -3.828 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -2.296 2.354 -3.788 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -2.683 3.399 -5.175 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -5.616 2.603 -5.422 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -4.483 2.714 -6.790 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -5.393 1.211 -6.509 1.00 0.00 H new ATOM 944 N TRP A 65 -0.445 0.918 -5.222 1.00 0.00 N ATOM 945 CA TRP A 65 0.735 0.460 -4.423 1.00 0.00 C ATOM 946 C TRP A 65 0.585 0.887 -2.958 1.00 0.00 C ATOM 947 O TRP A 65 0.027 1.925 -2.661 1.00 0.00 O ATOM 948 CB TRP A 65 2.016 1.113 -4.972 1.00 0.00 C ATOM 949 CG TRP A 65 2.791 0.196 -5.874 1.00 0.00 C ATOM 950 CD1 TRP A 65 3.441 0.615 -6.982 1.00 0.00 C ATOM 951 CD2 TRP A 65 3.040 -1.244 -5.779 1.00 0.00 C ATOM 952 NE1 TRP A 65 4.069 -0.459 -7.574 1.00 0.00 N ATOM 953 CE2 TRP A 65 3.847 -1.628 -6.879 1.00 0.00 C ATOM 954 CE3 TRP A 65 2.653 -2.248 -4.869 1.00 0.00 C ATOM 955 CZ2 TRP A 65 4.251 -2.946 -7.068 1.00 0.00 C ATOM 956 CZ3 TRP A 65 3.060 -3.577 -5.061 1.00 0.00 C ATOM 957 CH2 TRP A 65 3.854 -3.925 -6.158 1.00 0.00 C ATOM 0 H TRP A 65 -0.285 1.743 -5.800 1.00 0.00 H new ATOM 0 HA TRP A 65 0.793 -0.626 -4.493 1.00 0.00 H new ATOM 0 HB2 TRP A 65 1.752 2.018 -5.520 1.00 0.00 H new ATOM 0 HB3 TRP A 65 2.650 1.418 -4.139 1.00 0.00 H new ATOM 0 HD1 TRP A 65 3.465 1.631 -7.346 1.00 0.00 H new ATOM 0 HE1 TRP A 65 4.630 -0.396 -8.424 1.00 0.00 H new ATOM 0 HE3 TRP A 65 2.039 -1.993 -4.018 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 4.868 -3.209 -7.914 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 2.758 -4.337 -4.356 1.00 0.00 H new ATOM 0 HH2 TRP A 65 4.159 -4.951 -6.300 1.00 0.00 H new ATOM 968 N ILE A 66 1.130 0.120 -2.044 1.00 0.00 N ATOM 969 CA ILE A 66 1.071 0.513 -0.605 1.00 0.00 C ATOM 970 C ILE A 66 2.438 0.222 0.022 1.00 0.00 C ATOM 971 O ILE A 66 3.334 -0.271 -0.633 1.00 0.00 O ATOM 972 CB ILE A 66 -0.016 -0.271 0.136 1.00 0.00 C ATOM 973 CG1 ILE A 66 0.137 -1.768 -0.131 1.00 0.00 C ATOM 974 CG2 ILE A 66 -1.396 0.183 -0.343 1.00 0.00 C ATOM 975 CD1 ILE A 66 -1.012 -2.518 0.549 1.00 0.00 C ATOM 0 H ILE A 66 1.612 -0.759 -2.234 1.00 0.00 H new ATOM 0 HA ILE A 66 0.827 1.573 -0.527 1.00 0.00 H new ATOM 0 HB ILE A 66 0.085 -0.083 1.205 1.00 0.00 H new ATOM 0 HG12 ILE A 66 0.130 -1.961 -1.204 1.00 0.00 H new ATOM 0 HG13 ILE A 66 1.095 -2.122 0.250 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -2.167 -0.377 0.186 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -1.519 1.247 -0.143 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -1.487 0.002 -1.414 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -0.909 -3.587 0.363 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -0.983 -2.332 1.623 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -1.963 -2.169 0.146 1.00 0.00 H new ATOM 987 N GLY A 67 2.619 0.544 1.273 1.00 0.00 N ATOM 988 CA GLY A 67 3.934 0.312 1.921 1.00 0.00 C ATOM 989 C GLY A 67 4.011 -1.091 2.505 1.00 0.00 C ATOM 990 O GLY A 67 4.231 -1.261 3.679 1.00 0.00 O ATOM 0 H GLY A 67 1.908 0.960 1.874 1.00 0.00 H new ATOM 0 HA2 GLY A 67 4.733 0.451 1.192 1.00 0.00 H new ATOM 0 HA3 GLY A 67 4.090 1.048 2.710 1.00 0.00 H new ATOM 994 N LEU A 68 3.856 -2.095 1.695 1.00 0.00 N ATOM 995 CA LEU A 68 3.963 -3.492 2.211 1.00 0.00 C ATOM 996 C LEU A 68 4.896 -4.281 1.292 1.00 0.00 C ATOM 997 O LEU A 68 4.761 -4.250 0.084 1.00 0.00 O ATOM 998 CB LEU A 68 2.584 -4.156 2.238 1.00 0.00 C ATOM 999 CG LEU A 68 2.531 -5.218 3.351 1.00 0.00 C ATOM 1000 CD1 LEU A 68 3.761 -6.125 3.282 1.00 0.00 C ATOM 1001 CD2 LEU A 68 2.491 -4.545 4.728 1.00 0.00 C ATOM 0 H LEU A 68 3.660 -2.014 0.697 1.00 0.00 H new ATOM 0 HA LEU A 68 4.359 -3.477 3.226 1.00 0.00 H new ATOM 0 HB2 LEU A 68 1.813 -3.404 2.405 1.00 0.00 H new ATOM 0 HB3 LEU A 68 2.375 -4.618 1.273 1.00 0.00 H new ATOM 0 HG LEU A 68 1.629 -5.813 3.207 1.00 0.00 H new ATOM 0 HD11 LEU A 68 3.708 -6.870 4.076 1.00 0.00 H new ATOM 0 HD12 LEU A 68 3.790 -6.626 2.315 1.00 0.00 H new ATOM 0 HD13 LEU A 68 4.663 -5.525 3.407 1.00 0.00 H new ATOM 0 HD21 LEU A 68 2.454 -5.308 5.505 1.00 0.00 H new ATOM 0 HD22 LEU A 68 3.385 -3.935 4.861 1.00 0.00 H new ATOM 0 HD23 LEU A 68 1.606 -3.912 4.798 1.00 0.00 H new ATOM 1013 N HIS A 69 5.842 -4.992 1.849 1.00 0.00 N ATOM 1014 CA HIS A 69 6.772 -5.782 0.996 1.00 0.00 C ATOM 1015 C HIS A 69 7.093 -7.101 1.679 1.00 0.00 C ATOM 1016 O HIS A 69 6.589 -7.410 2.736 1.00 0.00 O ATOM 1017 CB HIS A 69 8.067 -5.001 0.766 1.00 0.00 C ATOM 1018 CG HIS A 69 8.765 -4.802 2.076 1.00 0.00 C ATOM 1019 ND1 HIS A 69 8.384 -4.144 3.213 1.00 0.00 N flip ATOM 1020 CD2 HIS A 69 10.022 -5.321 2.339 1.00 0.00 C flip ATOM 1021 CE1 HIS A 69 9.384 -4.248 4.174 1.00 0.00 C flip ATOM 1022 NE2 HIS A 69 10.349 -4.969 3.596 1.00 0.00 N flip ATOM 0 H HIS A 69 6.008 -5.058 2.853 1.00 0.00 H new ATOM 0 HA HIS A 69 6.295 -5.973 0.035 1.00 0.00 H new ATOM 0 HB2 HIS A 69 8.713 -5.542 0.075 1.00 0.00 H new ATOM 0 HB3 HIS A 69 7.847 -4.037 0.308 1.00 0.00 H new ATOM 0 HD1 HIS A 69 7.500 -3.651 3.337 1.00 0.00 H new ATOM 0 HD2 HIS A 69 10.628 -5.902 1.660 1.00 0.00 H new ATOM 0 HE1 HIS A 69 9.381 -3.835 5.172 1.00 0.00 H new ATOM 1180 N TRP A 82 5.928 -10.672 5.486 1.00 0.00 N ATOM 1181 CA TRP A 82 5.407 -9.394 4.916 1.00 0.00 C ATOM 1182 C TRP A 82 5.433 -8.301 5.991 1.00 0.00 C ATOM 1183 O TRP A 82 4.781 -8.415 7.011 1.00 0.00 O ATOM 1184 CB TRP A 82 3.961 -9.595 4.421 1.00 0.00 C ATOM 1185 CG TRP A 82 3.534 -11.016 4.624 1.00 0.00 C ATOM 1186 CD1 TRP A 82 4.084 -12.091 4.015 1.00 0.00 C ATOM 1187 CD2 TRP A 82 2.471 -11.528 5.479 1.00 0.00 C ATOM 1188 NE1 TRP A 82 3.429 -13.231 4.446 1.00 0.00 N ATOM 1189 CE2 TRP A 82 2.426 -12.936 5.349 1.00 0.00 C ATOM 1190 CE3 TRP A 82 1.553 -10.912 6.349 1.00 0.00 C ATOM 1191 CZ2 TRP A 82 1.502 -13.706 6.055 1.00 0.00 C ATOM 1192 CZ3 TRP A 82 0.620 -11.685 7.061 1.00 0.00 C ATOM 1193 CH2 TRP A 82 0.595 -13.079 6.914 1.00 0.00 C ATOM 0 HA TRP A 82 6.036 -9.093 4.078 1.00 0.00 H new ATOM 0 HB2 TRP A 82 3.289 -8.926 4.959 1.00 0.00 H new ATOM 0 HB3 TRP A 82 3.892 -9.335 3.365 1.00 0.00 H new ATOM 0 HD1 TRP A 82 4.900 -12.064 3.308 1.00 0.00 H new ATOM 0 HE1 TRP A 82 3.659 -14.175 4.135 1.00 0.00 H new ATOM 0 HE3 TRP A 82 1.565 -9.839 6.470 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 1.487 -14.780 5.939 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 -0.082 -11.202 7.725 1.00 0.00 H new ATOM 0 HH2 TRP A 82 -0.124 -13.668 7.464 1.00 0.00 H new ATOM 1204 N GLU A 83 6.176 -7.236 5.778 1.00 0.00 N ATOM 1205 CA GLU A 83 6.222 -6.146 6.802 1.00 0.00 C ATOM 1206 C GLU A 83 5.896 -4.808 6.135 1.00 0.00 C ATOM 1207 O GLU A 83 6.210 -4.586 4.985 1.00 0.00 O ATOM 1208 CB GLU A 83 7.624 -6.086 7.421 1.00 0.00 C ATOM 1209 CG GLU A 83 7.529 -5.584 8.864 1.00 0.00 C ATOM 1210 CD GLU A 83 8.889 -5.040 9.312 1.00 0.00 C ATOM 1211 OE1 GLU A 83 9.288 -4.007 8.801 1.00 0.00 O ATOM 1212 OE2 GLU A 83 9.507 -5.668 10.156 1.00 0.00 O ATOM 0 H GLU A 83 6.746 -7.078 4.947 1.00 0.00 H new ATOM 0 HA GLU A 83 5.490 -6.348 7.584 1.00 0.00 H new ATOM 0 HB2 GLU A 83 8.085 -7.074 7.399 1.00 0.00 H new ATOM 0 HB3 GLU A 83 8.262 -5.423 6.836 1.00 0.00 H new ATOM 0 HG2 GLU A 83 6.772 -4.803 8.939 1.00 0.00 H new ATOM 0 HG3 GLU A 83 7.216 -6.395 9.522 1.00 0.00 H new ATOM 1219 N TRP A 84 5.269 -3.911 6.849 1.00 0.00 N ATOM 1220 CA TRP A 84 4.926 -2.597 6.255 1.00 0.00 C ATOM 1221 C TRP A 84 6.162 -1.706 6.262 1.00 0.00 C ATOM 1222 O TRP A 84 6.850 -1.586 7.256 1.00 0.00 O ATOM 1223 CB TRP A 84 3.817 -1.927 7.073 1.00 0.00 C ATOM 1224 CG TRP A 84 3.041 -2.962 7.820 1.00 0.00 C ATOM 1225 CD1 TRP A 84 3.490 -3.633 8.905 1.00 0.00 C ATOM 1226 CD2 TRP A 84 1.693 -3.450 7.566 1.00 0.00 C ATOM 1227 NE1 TRP A 84 2.507 -4.506 9.327 1.00 0.00 N ATOM 1228 CE2 TRP A 84 1.381 -4.434 8.533 1.00 0.00 C ATOM 1229 CE3 TRP A 84 0.724 -3.143 6.597 1.00 0.00 C ATOM 1230 CZ2 TRP A 84 0.151 -5.090 8.539 1.00 0.00 C ATOM 1231 CZ3 TRP A 84 -0.515 -3.801 6.597 1.00 0.00 C ATOM 1232 CH2 TRP A 84 -0.801 -4.773 7.566 1.00 0.00 C ATOM 0 H TRP A 84 4.981 -4.037 7.819 1.00 0.00 H new ATOM 0 HA TRP A 84 4.579 -2.745 5.232 1.00 0.00 H new ATOM 0 HB2 TRP A 84 4.250 -1.210 7.771 1.00 0.00 H new ATOM 0 HB3 TRP A 84 3.153 -1.368 6.413 1.00 0.00 H new ATOM 0 HD1 TRP A 84 4.459 -3.507 9.366 1.00 0.00 H new ATOM 0 HE1 TRP A 84 2.602 -5.129 10.129 1.00 0.00 H new ATOM 0 HE3 TRP A 84 0.934 -2.395 5.847 1.00 0.00 H new ATOM 0 HZ2 TRP A 84 -0.064 -5.837 9.289 1.00 0.00 H new ATOM 0 HZ3 TRP A 84 -1.252 -3.557 5.847 1.00 0.00 H new ATOM 0 HH2 TRP A 84 -1.756 -5.277 7.561 1.00 0.00 H new ATOM 1243 N SER A 85 6.441 -1.066 5.166 1.00 0.00 N ATOM 1244 CA SER A 85 7.620 -0.171 5.123 1.00 0.00 C ATOM 1245 C SER A 85 7.205 1.196 5.645 1.00 0.00 C ATOM 1246 O SER A 85 7.987 2.125 5.690 1.00 0.00 O ATOM 1247 CB SER A 85 8.129 -0.048 3.687 1.00 0.00 C ATOM 1248 OG SER A 85 8.977 1.089 3.584 1.00 0.00 O ATOM 0 H SER A 85 5.904 -1.125 4.301 1.00 0.00 H new ATOM 0 HA SER A 85 8.421 -0.579 5.740 1.00 0.00 H new ATOM 0 HB2 SER A 85 8.674 -0.949 3.404 1.00 0.00 H new ATOM 0 HB3 SER A 85 7.289 0.047 2.998 1.00 0.00 H new ATOM 0 HG SER A 85 9.142 1.289 2.639 1.00 0.00 H new ATOM 1288 N VAL A 89 5.277 -3.508 12.084 1.00 0.00 N ATOM 1289 CA VAL A 89 5.338 -4.992 11.939 1.00 0.00 C ATOM 1290 C VAL A 89 3.956 -5.523 11.557 1.00 0.00 C ATOM 1291 O VAL A 89 2.963 -4.831 11.663 1.00 0.00 O ATOM 1292 CB VAL A 89 5.773 -5.613 13.268 1.00 0.00 C ATOM 1293 CG1 VAL A 89 4.711 -5.335 14.334 1.00 0.00 C ATOM 1294 CG2 VAL A 89 5.939 -7.126 13.098 1.00 0.00 C ATOM 0 HA VAL A 89 6.055 -5.254 11.161 1.00 0.00 H new ATOM 0 HB VAL A 89 6.723 -5.176 13.577 1.00 0.00 H new ATOM 0 HG11 VAL A 89 5.021 -5.778 15.281 1.00 0.00 H new ATOM 0 HG12 VAL A 89 4.593 -4.259 14.458 1.00 0.00 H new ATOM 0 HG13 VAL A 89 3.761 -5.771 14.024 1.00 0.00 H new ATOM 0 HG21 VAL A 89 6.249 -7.567 14.046 1.00 0.00 H new ATOM 0 HG22 VAL A 89 4.990 -7.563 12.787 1.00 0.00 H new ATOM 0 HG23 VAL A 89 6.696 -7.326 12.340 1.00 0.00 H new ATOM 1304 N MET A 90 3.886 -6.744 11.110 1.00 0.00 N ATOM 1305 CA MET A 90 2.573 -7.325 10.713 1.00 0.00 C ATOM 1306 C MET A 90 1.637 -7.377 11.923 1.00 0.00 C ATOM 1307 O MET A 90 1.540 -8.384 12.594 1.00 0.00 O ATOM 1308 CB MET A 90 2.792 -8.744 10.174 1.00 0.00 C ATOM 1309 CG MET A 90 1.584 -9.174 9.336 1.00 0.00 C ATOM 1310 SD MET A 90 0.145 -9.392 10.411 1.00 0.00 S ATOM 1311 CE MET A 90 0.433 -11.129 10.832 1.00 0.00 C ATOM 0 H MET A 90 4.685 -7.369 11.002 1.00 0.00 H new ATOM 0 HA MET A 90 2.121 -6.702 9.941 1.00 0.00 H new ATOM 0 HB2 MET A 90 3.697 -8.777 9.567 1.00 0.00 H new ATOM 0 HB3 MET A 90 2.938 -9.438 11.001 1.00 0.00 H new ATOM 0 HG2 MET A 90 1.371 -8.423 8.575 1.00 0.00 H new ATOM 0 HG3 MET A 90 1.804 -10.105 8.813 1.00 0.00 H new ATOM 0 HE1 MET A 90 -0.256 -11.431 11.621 1.00 0.00 H new ATOM 0 HE2 MET A 90 0.270 -11.749 9.951 1.00 0.00 H new ATOM 0 HE3 MET A 90 1.459 -11.254 11.178 1.00 0.00 H new ATOM 1321 N ASN A 91 0.925 -6.311 12.193 1.00 0.00 N ATOM 1322 CA ASN A 91 -0.022 -6.328 13.346 1.00 0.00 C ATOM 1323 C ASN A 91 -1.431 -6.489 12.786 1.00 0.00 C ATOM 1324 O ASN A 91 -2.371 -6.778 13.500 1.00 0.00 O ATOM 1325 CB ASN A 91 0.084 -5.019 14.141 1.00 0.00 C ATOM 1326 CG ASN A 91 -0.168 -5.296 15.626 1.00 0.00 C ATOM 1327 OD1 ASN A 91 0.760 -5.495 16.384 1.00 0.00 O ATOM 1328 ND2 ASN A 91 -1.393 -5.317 16.075 1.00 0.00 N ATOM 0 H ASN A 91 0.959 -5.437 11.668 1.00 0.00 H new ATOM 0 HA ASN A 91 0.217 -7.150 14.020 1.00 0.00 H new ATOM 0 HB2 ASN A 91 1.072 -4.579 14.006 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -0.641 -4.296 13.768 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -1.571 -5.500 17.062 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -2.172 -5.150 15.439 1.00 0.00 H new ATOM 1335 N TYR A 92 -1.573 -6.317 11.496 1.00 0.00 N ATOM 1336 CA TYR A 92 -2.908 -6.469 10.854 1.00 0.00 C ATOM 1337 C TYR A 92 -2.785 -7.451 9.685 1.00 0.00 C ATOM 1338 O TYR A 92 -1.720 -7.625 9.126 1.00 0.00 O ATOM 1339 CB TYR A 92 -3.394 -5.113 10.342 1.00 0.00 C ATOM 1340 CG TYR A 92 -4.749 -5.264 9.681 1.00 0.00 C ATOM 1341 CD1 TYR A 92 -5.817 -5.842 10.383 1.00 0.00 C ATOM 1342 CD2 TYR A 92 -4.934 -4.829 8.363 1.00 0.00 C ATOM 1343 CE1 TYR A 92 -7.065 -5.983 9.765 1.00 0.00 C ATOM 1344 CE2 TYR A 92 -6.184 -4.971 7.747 1.00 0.00 C ATOM 1345 CZ TYR A 92 -7.248 -5.549 8.447 1.00 0.00 C ATOM 1346 OH TYR A 92 -8.479 -5.688 7.839 1.00 0.00 O ATOM 0 H TYR A 92 -0.814 -6.076 10.858 1.00 0.00 H new ATOM 0 HA TYR A 92 -3.626 -6.848 11.581 1.00 0.00 H new ATOM 0 HB2 TYR A 92 -3.460 -4.405 11.168 1.00 0.00 H new ATOM 0 HB3 TYR A 92 -2.676 -4.705 9.630 1.00 0.00 H new ATOM 0 HD1 TYR A 92 -5.676 -6.178 11.400 1.00 0.00 H new ATOM 0 HD2 TYR A 92 -4.113 -4.384 7.821 1.00 0.00 H new ATOM 0 HE1 TYR A 92 -7.888 -6.427 10.306 1.00 0.00 H new ATOM 0 HE2 TYR A 92 -6.326 -4.634 6.731 1.00 0.00 H new ATOM 0 HH TYR A 92 -8.434 -5.335 6.926 1.00 0.00 H new ATOM 1356 N PHE A 93 -3.857 -8.103 9.314 1.00 0.00 N ATOM 1357 CA PHE A 93 -3.784 -9.081 8.186 1.00 0.00 C ATOM 1358 C PHE A 93 -4.970 -8.881 7.240 1.00 0.00 C ATOM 1359 O PHE A 93 -6.080 -8.622 7.661 1.00 0.00 O ATOM 1360 CB PHE A 93 -3.820 -10.504 8.747 1.00 0.00 C ATOM 1361 CG PHE A 93 -5.040 -10.672 9.621 1.00 0.00 C ATOM 1362 CD1 PHE A 93 -5.002 -10.268 10.961 1.00 0.00 C ATOM 1363 CD2 PHE A 93 -6.208 -11.231 9.092 1.00 0.00 C ATOM 1364 CE1 PHE A 93 -6.133 -10.424 11.771 1.00 0.00 C ATOM 1365 CE2 PHE A 93 -7.341 -11.386 9.901 1.00 0.00 C ATOM 1366 CZ PHE A 93 -7.302 -10.983 11.242 1.00 0.00 C ATOM 0 H PHE A 93 -4.777 -8.001 9.742 1.00 0.00 H new ATOM 0 HA PHE A 93 -2.857 -8.922 7.635 1.00 0.00 H new ATOM 0 HB2 PHE A 93 -3.842 -11.227 7.932 1.00 0.00 H new ATOM 0 HB3 PHE A 93 -2.917 -10.701 9.324 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -4.100 -9.836 11.370 1.00 0.00 H new ATOM 0 HD2 PHE A 93 -6.236 -11.543 8.059 1.00 0.00 H new ATOM 0 HE1 PHE A 93 -6.103 -10.113 12.805 1.00 0.00 H new ATOM 0 HE2 PHE A 93 -8.243 -11.816 9.491 1.00 0.00 H new ATOM 0 HZ PHE A 93 -8.174 -11.104 11.868 1.00 0.00 H new ATOM 1376 N ALA A 94 -4.743 -9.006 5.958 1.00 0.00 N ATOM 1377 CA ALA A 94 -5.854 -8.831 4.979 1.00 0.00 C ATOM 1378 C ALA A 94 -5.361 -9.192 3.571 1.00 0.00 C ATOM 1379 O ALA A 94 -5.893 -8.730 2.581 1.00 0.00 O ATOM 1380 CB ALA A 94 -6.335 -7.374 5.001 1.00 0.00 C ATOM 0 H ALA A 94 -3.835 -9.222 5.548 1.00 0.00 H new ATOM 0 HA ALA A 94 -6.681 -9.487 5.250 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -7.147 -7.248 4.285 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -6.690 -7.123 6.000 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -5.510 -6.714 4.733 1.00 0.00 H new ATOM 1386 N TRP A 95 -4.351 -10.013 3.473 1.00 0.00 N ATOM 1387 CA TRP A 95 -3.832 -10.402 2.131 1.00 0.00 C ATOM 1388 C TRP A 95 -4.808 -11.378 1.470 1.00 0.00 C ATOM 1389 O TRP A 95 -5.566 -12.058 2.132 1.00 0.00 O ATOM 1390 CB TRP A 95 -2.461 -11.073 2.288 1.00 0.00 C ATOM 1391 CG TRP A 95 -2.418 -11.829 3.576 1.00 0.00 C ATOM 1392 CD1 TRP A 95 -1.797 -11.410 4.704 1.00 0.00 C ATOM 1393 CD2 TRP A 95 -3.007 -13.126 3.892 1.00 0.00 C ATOM 1394 NE1 TRP A 95 -1.968 -12.364 5.689 1.00 0.00 N ATOM 1395 CE2 TRP A 95 -2.706 -13.440 5.238 1.00 0.00 C ATOM 1396 CE3 TRP A 95 -3.766 -14.048 3.149 1.00 0.00 C ATOM 1397 CZ2 TRP A 95 -3.142 -14.628 5.827 1.00 0.00 C ATOM 1398 CZ3 TRP A 95 -4.205 -15.244 3.739 1.00 0.00 C ATOM 1399 CH2 TRP A 95 -3.895 -15.534 5.075 1.00 0.00 C ATOM 0 H TRP A 95 -3.863 -10.431 4.265 1.00 0.00 H new ATOM 0 HA TRP A 95 -3.731 -9.513 1.508 1.00 0.00 H new ATOM 0 HB2 TRP A 95 -2.277 -11.748 1.452 1.00 0.00 H new ATOM 0 HB3 TRP A 95 -1.672 -10.321 2.270 1.00 0.00 H new ATOM 0 HD1 TRP A 95 -1.256 -10.482 4.816 1.00 0.00 H new ATOM 0 HE1 TRP A 95 -1.594 -12.283 6.635 1.00 0.00 H new ATOM 0 HE3 TRP A 95 -4.012 -13.835 2.119 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 -2.899 -14.846 6.857 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 -4.786 -15.946 3.159 1.00 0.00 H new ATOM 0 HH2 TRP A 95 -4.237 -16.456 5.522 1.00 0.00 H new ATOM 1410 N GLU A 96 -4.797 -11.450 0.167 1.00 0.00 N ATOM 1411 CA GLU A 96 -5.724 -12.381 -0.537 1.00 0.00 C ATOM 1412 C GLU A 96 -5.196 -13.812 -0.423 1.00 0.00 C ATOM 1413 O GLU A 96 -5.946 -14.745 -0.214 1.00 0.00 O ATOM 1414 CB GLU A 96 -5.817 -11.986 -2.014 1.00 0.00 C ATOM 1415 CG GLU A 96 -6.990 -12.720 -2.668 1.00 0.00 C ATOM 1416 CD GLU A 96 -6.852 -12.648 -4.190 1.00 0.00 C ATOM 1417 OE1 GLU A 96 -7.096 -11.585 -4.738 1.00 0.00 O ATOM 1418 OE2 GLU A 96 -6.504 -13.656 -4.782 1.00 0.00 O ATOM 0 H GLU A 96 -4.186 -10.904 -0.441 1.00 0.00 H new ATOM 0 HA GLU A 96 -6.713 -12.323 -0.082 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -5.953 -10.908 -2.105 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -4.888 -12.235 -2.527 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -7.009 -13.760 -2.343 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -7.933 -12.271 -2.356 1.00 0.00 H new ATOM 1564 N HIS A 107 7.566 -9.060 -4.399 1.00 0.00 N ATOM 1565 CA HIS A 107 7.978 -8.738 -3.002 1.00 0.00 C ATOM 1566 C HIS A 107 7.292 -7.441 -2.561 1.00 0.00 C ATOM 1567 O HIS A 107 7.734 -6.773 -1.648 1.00 0.00 O ATOM 1568 CB HIS A 107 9.503 -8.568 -2.938 1.00 0.00 C ATOM 1569 CG HIS A 107 10.154 -9.490 -3.933 1.00 0.00 C ATOM 1570 ND1 HIS A 107 10.559 -10.769 -3.599 1.00 0.00 N ATOM 1571 CD2 HIS A 107 10.481 -9.330 -5.256 1.00 0.00 C ATOM 1572 CE1 HIS A 107 11.098 -11.320 -4.702 1.00 0.00 C ATOM 1573 NE2 HIS A 107 11.075 -10.485 -5.738 1.00 0.00 N ATOM 0 HA HIS A 107 7.683 -9.550 -2.337 1.00 0.00 H new ATOM 0 HB2 HIS A 107 9.773 -7.534 -3.153 1.00 0.00 H new ATOM 0 HB3 HIS A 107 9.862 -8.789 -1.933 1.00 0.00 H new ATOM 0 HD2 HIS A 107 10.302 -8.436 -5.835 1.00 0.00 H new ATOM 0 HE1 HIS A 107 11.501 -12.321 -4.742 1.00 0.00 H new ATOM 0 HE2 HIS A 107 11.420 -10.658 -6.682 1.00 0.00 H new ATOM 1581 N CYS A 108 6.210 -7.086 -3.203 1.00 0.00 N ATOM 1582 CA CYS A 108 5.483 -5.838 -2.825 1.00 0.00 C ATOM 1583 C CYS A 108 3.977 -6.085 -2.918 1.00 0.00 C ATOM 1584 O CYS A 108 3.512 -6.791 -3.790 1.00 0.00 O ATOM 1585 CB CYS A 108 5.879 -4.706 -3.772 1.00 0.00 C ATOM 1586 SG CYS A 108 7.557 -4.159 -3.380 1.00 0.00 S ATOM 0 H CYS A 108 5.797 -7.609 -3.976 1.00 0.00 H new ATOM 0 HA CYS A 108 5.744 -5.557 -1.805 1.00 0.00 H new ATOM 0 HB2 CYS A 108 5.827 -5.047 -4.806 1.00 0.00 H new ATOM 0 HB3 CYS A 108 5.181 -3.874 -3.675 1.00 0.00 H new ATOM 1591 N ALA A 109 3.210 -5.520 -2.021 1.00 0.00 N ATOM 1592 CA ALA A 109 1.733 -5.736 -2.052 1.00 0.00 C ATOM 1593 C ALA A 109 1.018 -4.471 -2.545 1.00 0.00 C ATOM 1594 O ALA A 109 1.457 -3.354 -2.326 1.00 0.00 O ATOM 1595 CB ALA A 109 1.236 -6.092 -0.647 1.00 0.00 C ATOM 0 H ALA A 109 3.544 -4.918 -1.268 1.00 0.00 H new ATOM 0 HA ALA A 109 1.512 -6.555 -2.737 1.00 0.00 H new ATOM 0 HB1 ALA A 109 0.158 -6.249 -0.671 1.00 0.00 H new ATOM 0 HB2 ALA A 109 1.728 -7.003 -0.307 1.00 0.00 H new ATOM 0 HB3 ALA A 109 1.468 -5.277 0.038 1.00 0.00 H new ATOM 1601 N SER A 110 -0.087 -4.657 -3.214 1.00 0.00 N ATOM 1602 CA SER A 110 -0.871 -3.510 -3.744 1.00 0.00 C ATOM 1603 C SER A 110 -2.359 -3.794 -3.514 1.00 0.00 C ATOM 1604 O SER A 110 -2.750 -4.914 -3.256 1.00 0.00 O ATOM 1605 CB SER A 110 -0.595 -3.361 -5.245 1.00 0.00 C ATOM 1606 OG SER A 110 0.553 -4.126 -5.587 1.00 0.00 O ATOM 0 H SER A 110 -0.485 -5.574 -3.418 1.00 0.00 H new ATOM 0 HA SER A 110 -0.588 -2.588 -3.237 1.00 0.00 H new ATOM 0 HB2 SER A 110 -1.457 -3.699 -5.821 1.00 0.00 H new ATOM 0 HB3 SER A 110 -0.436 -2.312 -5.495 1.00 0.00 H new ATOM 0 HG SER A 110 1.326 -3.531 -5.683 1.00 0.00 H new ATOM 1612 N LEU A 111 -3.195 -2.800 -3.613 1.00 0.00 N ATOM 1613 CA LEU A 111 -4.650 -3.033 -3.406 1.00 0.00 C ATOM 1614 C LEU A 111 -5.263 -3.479 -4.733 1.00 0.00 C ATOM 1615 O LEU A 111 -4.805 -3.103 -5.790 1.00 0.00 O ATOM 1616 CB LEU A 111 -5.321 -1.732 -2.949 1.00 0.00 C ATOM 1617 CG LEU A 111 -4.790 -1.314 -1.565 1.00 0.00 C ATOM 1618 CD1 LEU A 111 -4.450 0.180 -1.566 1.00 0.00 C ATOM 1619 CD2 LEU A 111 -5.861 -1.570 -0.502 1.00 0.00 C ATOM 0 H LEU A 111 -2.934 -1.838 -3.828 1.00 0.00 H new ATOM 0 HA LEU A 111 -4.799 -3.798 -2.645 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -5.128 -0.941 -3.674 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -6.402 -1.868 -2.906 1.00 0.00 H new ATOM 0 HG LEU A 111 -3.896 -1.897 -1.343 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -4.075 0.468 -0.584 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -3.687 0.379 -2.319 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -5.346 0.757 -1.796 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -5.482 -1.273 0.476 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -6.753 -0.989 -0.737 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -6.112 -2.631 -0.487 1.00 0.00 H new ATOM 1631 N SER A 112 -6.284 -4.289 -4.686 1.00 0.00 N ATOM 1632 CA SER A 112 -6.928 -4.777 -5.947 1.00 0.00 C ATOM 1633 C SER A 112 -8.360 -4.245 -6.037 1.00 0.00 C ATOM 1634 O SER A 112 -9.202 -4.571 -5.223 1.00 0.00 O ATOM 1635 CB SER A 112 -6.957 -6.306 -5.932 1.00 0.00 C ATOM 1636 OG SER A 112 -5.708 -6.794 -5.460 1.00 0.00 O ATOM 0 H SER A 112 -6.705 -4.638 -3.825 1.00 0.00 H new ATOM 0 HA SER A 112 -6.359 -4.423 -6.807 1.00 0.00 H new ATOM 0 HB2 SER A 112 -7.765 -6.660 -5.291 1.00 0.00 H new ATOM 0 HB3 SER A 112 -7.155 -6.687 -6.934 1.00 0.00 H new ATOM 0 HG SER A 112 -4.979 -6.327 -5.920 1.00 0.00 H new ATOM 1642 N ARG A 113 -8.652 -3.431 -7.019 1.00 0.00 N ATOM 1643 CA ARG A 113 -10.039 -2.893 -7.147 1.00 0.00 C ATOM 1644 C ARG A 113 -11.034 -4.055 -7.202 1.00 0.00 C ATOM 1645 O ARG A 113 -12.216 -3.884 -6.975 1.00 0.00 O ATOM 1646 CB ARG A 113 -10.154 -2.063 -8.432 1.00 0.00 C ATOM 1647 CG ARG A 113 -11.623 -1.725 -8.703 1.00 0.00 C ATOM 1648 CD ARG A 113 -11.713 -0.685 -9.820 1.00 0.00 C ATOM 1649 NE ARG A 113 -13.106 -0.157 -9.896 1.00 0.00 N ATOM 1650 CZ ARG A 113 -13.328 1.045 -10.353 1.00 0.00 C ATOM 1651 NH1 ARG A 113 -12.711 1.460 -11.425 1.00 0.00 N ATOM 1652 NH2 ARG A 113 -14.166 1.833 -9.735 1.00 0.00 N ATOM 0 H ARG A 113 -7.995 -3.117 -7.733 1.00 0.00 H new ATOM 0 HA ARG A 113 -10.262 -2.262 -6.287 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -9.572 -1.146 -8.337 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -9.738 -2.618 -9.273 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -12.167 -2.626 -8.986 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -12.091 -1.341 -7.797 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -11.014 0.129 -9.631 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -11.430 -1.133 -10.772 1.00 0.00 H new ATOM 0 HE ARG A 113 -13.887 -0.737 -9.590 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -12.055 0.845 -11.906 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -12.885 2.400 -11.782 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -14.646 1.509 -8.896 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -14.340 2.773 -10.092 1.00 0.00 H new ATOM 1666 N SER A 114 -10.569 -5.235 -7.508 1.00 0.00 N ATOM 1667 CA SER A 114 -11.491 -6.404 -7.588 1.00 0.00 C ATOM 1668 C SER A 114 -12.066 -6.711 -6.203 1.00 0.00 C ATOM 1669 O SER A 114 -13.199 -7.132 -6.073 1.00 0.00 O ATOM 1670 CB SER A 114 -10.721 -7.622 -8.099 1.00 0.00 C ATOM 1671 OG SER A 114 -11.617 -8.718 -8.236 1.00 0.00 O ATOM 0 H SER A 114 -9.590 -5.441 -7.706 1.00 0.00 H new ATOM 0 HA SER A 114 -12.308 -6.171 -8.271 1.00 0.00 H new ATOM 0 HB2 SER A 114 -10.254 -7.396 -9.058 1.00 0.00 H new ATOM 0 HB3 SER A 114 -9.919 -7.877 -7.406 1.00 0.00 H new ATOM 0 HG SER A 114 -11.128 -9.501 -8.565 1.00 0.00 H new ATOM 1677 N THR A 115 -11.295 -6.509 -5.166 1.00 0.00 N ATOM 1678 CA THR A 115 -11.799 -6.795 -3.789 1.00 0.00 C ATOM 1679 C THR A 115 -12.181 -5.484 -3.102 1.00 0.00 C ATOM 1680 O THR A 115 -12.119 -5.364 -1.894 1.00 0.00 O ATOM 1681 CB THR A 115 -10.704 -7.493 -2.979 1.00 0.00 C ATOM 1682 OG1 THR A 115 -9.588 -6.623 -2.845 1.00 0.00 O ATOM 1683 CG2 THR A 115 -10.271 -8.773 -3.695 1.00 0.00 C ATOM 0 H THR A 115 -10.338 -6.158 -5.213 1.00 0.00 H new ATOM 0 HA THR A 115 -12.674 -7.442 -3.851 1.00 0.00 H new ATOM 0 HB THR A 115 -11.090 -7.746 -1.991 1.00 0.00 H new ATOM 0 HG1 THR A 115 -8.797 -7.042 -3.244 1.00 0.00 H new ATOM 0 HG21 THR A 115 -9.491 -9.268 -3.116 1.00 0.00 H new ATOM 0 HG22 THR A 115 -11.127 -9.441 -3.796 1.00 0.00 H new ATOM 0 HG23 THR A 115 -9.886 -8.524 -4.684 1.00 0.00 H new ATOM 1691 N ALA A 116 -12.573 -4.500 -3.862 1.00 0.00 N ATOM 1692 CA ALA A 116 -12.957 -3.194 -3.252 1.00 0.00 C ATOM 1693 C ALA A 116 -11.746 -2.593 -2.535 1.00 0.00 C ATOM 1694 O ALA A 116 -11.882 -1.846 -1.586 1.00 0.00 O ATOM 1695 CB ALA A 116 -14.097 -3.411 -2.253 1.00 0.00 C ATOM 0 H ALA A 116 -12.644 -4.542 -4.879 1.00 0.00 H new ATOM 0 HA ALA A 116 -13.290 -2.510 -4.032 1.00 0.00 H new ATOM 0 HB1 ALA A 116 -14.377 -2.456 -1.808 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -14.957 -3.837 -2.769 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -13.769 -4.095 -1.470 1.00 0.00 H new ATOM 1701 N PHE A 117 -10.565 -2.916 -2.985 1.00 0.00 N ATOM 1702 CA PHE A 117 -9.335 -2.369 -2.343 1.00 0.00 C ATOM 1703 C PHE A 117 -9.276 -2.812 -0.881 1.00 0.00 C ATOM 1704 O PHE A 117 -8.718 -2.135 -0.041 1.00 0.00 O ATOM 1705 CB PHE A 117 -9.349 -0.840 -2.414 1.00 0.00 C ATOM 1706 CG PHE A 117 -9.716 -0.400 -3.811 1.00 0.00 C ATOM 1707 CD1 PHE A 117 -8.728 -0.312 -4.798 1.00 0.00 C ATOM 1708 CD2 PHE A 117 -11.044 -0.081 -4.119 1.00 0.00 C ATOM 1709 CE1 PHE A 117 -9.069 0.096 -6.093 1.00 0.00 C ATOM 1710 CE2 PHE A 117 -11.383 0.327 -5.413 1.00 0.00 C ATOM 1711 CZ PHE A 117 -10.397 0.415 -6.400 1.00 0.00 C ATOM 0 H PHE A 117 -10.398 -3.539 -3.775 1.00 0.00 H new ATOM 0 HA PHE A 117 -8.459 -2.746 -2.871 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -10.065 -0.439 -1.696 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -8.370 -0.445 -2.143 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -7.704 -0.559 -4.561 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -11.807 -0.150 -3.357 1.00 0.00 H new ATOM 0 HE1 PHE A 117 -8.307 0.165 -6.855 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -12.407 0.574 -5.650 1.00 0.00 H new ATOM 0 HZ PHE A 117 -10.660 0.729 -7.399 1.00 0.00 H new ATOM 1721 N LEU A 118 -9.845 -3.945 -0.573 1.00 0.00 N ATOM 1722 CA LEU A 118 -9.823 -4.440 0.834 1.00 0.00 C ATOM 1723 C LEU A 118 -8.847 -5.613 0.946 1.00 0.00 C ATOM 1724 O LEU A 118 -8.543 -6.078 2.027 1.00 0.00 O ATOM 1725 CB LEU A 118 -11.227 -4.904 1.226 1.00 0.00 C ATOM 1726 CG LEU A 118 -12.175 -3.700 1.280 1.00 0.00 C ATOM 1727 CD1 LEU A 118 -13.604 -4.189 1.531 1.00 0.00 C ATOM 1728 CD2 LEU A 118 -11.753 -2.751 2.412 1.00 0.00 C ATOM 0 H LEU A 118 -10.326 -4.552 -1.237 1.00 0.00 H new ATOM 0 HA LEU A 118 -9.503 -3.639 1.500 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -11.593 -5.635 0.505 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -11.199 -5.400 2.196 1.00 0.00 H new ATOM 0 HG LEU A 118 -12.131 -3.166 0.331 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -14.279 -3.334 1.570 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -13.908 -4.855 0.724 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -13.644 -4.726 2.479 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -12.431 -1.898 2.444 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -11.791 -3.281 3.364 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -10.737 -2.400 2.233 1.00 0.00 H new ATOM 1740 N ARG A 119 -8.348 -6.090 -0.166 1.00 0.00 N ATOM 1741 CA ARG A 119 -7.385 -7.232 -0.135 1.00 0.00 C ATOM 1742 C ARG A 119 -6.057 -6.785 -0.753 1.00 0.00 C ATOM 1743 O ARG A 119 -6.016 -5.890 -1.576 1.00 0.00 O ATOM 1744 CB ARG A 119 -7.964 -8.406 -0.938 1.00 0.00 C ATOM 1745 CG ARG A 119 -7.763 -9.719 -0.170 1.00 0.00 C ATOM 1746 CD ARG A 119 -8.636 -9.732 1.092 1.00 0.00 C ATOM 1747 NE ARG A 119 -9.115 -11.121 1.345 1.00 0.00 N ATOM 1748 CZ ARG A 119 -9.990 -11.347 2.288 1.00 0.00 C ATOM 1749 NH1 ARG A 119 -11.083 -10.638 2.347 1.00 0.00 N ATOM 1750 NH2 ARG A 119 -9.770 -12.283 3.171 1.00 0.00 N ATOM 0 H ARG A 119 -8.567 -5.736 -1.097 1.00 0.00 H new ATOM 0 HA ARG A 119 -7.217 -7.549 0.894 1.00 0.00 H new ATOM 0 HB2 ARG A 119 -9.026 -8.242 -1.122 1.00 0.00 H new ATOM 0 HB3 ARG A 119 -7.477 -8.467 -1.911 1.00 0.00 H new ATOM 0 HG2 ARG A 119 -8.020 -10.565 -0.808 1.00 0.00 H new ATOM 0 HG3 ARG A 119 -6.714 -9.832 0.103 1.00 0.00 H new ATOM 0 HD2 ARG A 119 -8.065 -9.371 1.947 1.00 0.00 H new ATOM 0 HD3 ARG A 119 -9.485 -9.059 0.968 1.00 0.00 H new ATOM 0 HE ARG A 119 -8.760 -11.894 0.782 1.00 0.00 H new ATOM 0 HH11 ARG A 119 -11.255 -9.907 1.657 1.00 0.00 H new ATOM 0 HH12 ARG A 119 -11.766 -10.815 3.083 1.00 0.00 H new ATOM 0 HH21 ARG A 119 -8.915 -12.837 3.124 1.00 0.00 H new ATOM 0 HH22 ARG A 119 -10.453 -12.460 3.908 1.00 0.00 H new ATOM 1764 N TRP A 120 -4.970 -7.397 -0.360 1.00 0.00 N ATOM 1765 CA TRP A 120 -3.643 -7.006 -0.922 1.00 0.00 C ATOM 1766 C TRP A 120 -3.147 -8.083 -1.887 1.00 0.00 C ATOM 1767 O TRP A 120 -3.218 -9.262 -1.604 1.00 0.00 O ATOM 1768 CB TRP A 120 -2.633 -6.859 0.217 1.00 0.00 C ATOM 1769 CG TRP A 120 -3.217 -6.033 1.314 1.00 0.00 C ATOM 1770 CD1 TRP A 120 -3.873 -4.862 1.146 1.00 0.00 C ATOM 1771 CD2 TRP A 120 -3.207 -6.295 2.746 1.00 0.00 C ATOM 1772 NE1 TRP A 120 -4.265 -4.389 2.386 1.00 0.00 N ATOM 1773 CE2 TRP A 120 -3.879 -5.238 3.403 1.00 0.00 C ATOM 1774 CE3 TRP A 120 -2.685 -7.339 3.528 1.00 0.00 C ATOM 1775 CZ2 TRP A 120 -4.027 -5.219 4.790 1.00 0.00 C ATOM 1776 CZ3 TRP A 120 -2.832 -7.323 4.923 1.00 0.00 C ATOM 1777 CH2 TRP A 120 -3.501 -6.267 5.553 1.00 0.00 C ATOM 0 H TRP A 120 -4.944 -8.151 0.326 1.00 0.00 H new ATOM 0 HA TRP A 120 -3.747 -6.061 -1.454 1.00 0.00 H new ATOM 0 HB2 TRP A 120 -2.357 -7.842 0.598 1.00 0.00 H new ATOM 0 HB3 TRP A 120 -1.720 -6.393 -0.154 1.00 0.00 H new ATOM 0 HD1 TRP A 120 -4.060 -4.376 0.200 1.00 0.00 H new ATOM 0 HE1 TRP A 120 -4.777 -3.519 2.531 1.00 0.00 H new ATOM 0 HE3 TRP A 120 -2.167 -8.159 3.052 1.00 0.00 H new ATOM 0 HZ2 TRP A 120 -4.544 -4.402 5.271 1.00 0.00 H new ATOM 0 HZ3 TRP A 120 -2.427 -8.130 5.515 1.00 0.00 H new ATOM 0 HH2 TRP A 120 -3.611 -6.261 6.627 1.00 0.00 H new ATOM 1788 N LYS A 121 -2.638 -7.682 -3.022 1.00 0.00 N ATOM 1789 CA LYS A 121 -2.119 -8.673 -4.013 1.00 0.00 C ATOM 1790 C LYS A 121 -0.635 -8.408 -4.249 1.00 0.00 C ATOM 1791 O LYS A 121 -0.192 -7.277 -4.279 1.00 0.00 O ATOM 1792 CB LYS A 121 -2.897 -8.530 -5.333 1.00 0.00 C ATOM 1793 CG LYS A 121 -3.783 -9.761 -5.561 1.00 0.00 C ATOM 1794 CD LYS A 121 -2.934 -10.920 -6.092 1.00 0.00 C ATOM 1795 CE LYS A 121 -3.839 -12.109 -6.420 1.00 0.00 C ATOM 1796 NZ LYS A 121 -4.279 -12.762 -5.154 1.00 0.00 N ATOM 0 H LYS A 121 -2.559 -6.706 -3.307 1.00 0.00 H new ATOM 0 HA LYS A 121 -2.249 -9.686 -3.632 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -3.512 -7.630 -5.306 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -2.201 -8.415 -6.164 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -4.267 -10.050 -4.628 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -4.576 -9.524 -6.271 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -2.390 -10.607 -6.983 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -2.190 -11.210 -5.350 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -4.706 -11.774 -6.989 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -3.305 -12.825 -7.045 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -5.046 -13.434 -5.358 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -3.478 -13.270 -4.729 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -4.621 -12.038 -4.490 1.00 0.00 H new ATOM 1810 N ASP A 122 0.139 -9.445 -4.407 1.00 0.00 N ATOM 1811 CA ASP A 122 1.593 -9.250 -4.628 1.00 0.00 C ATOM 1812 C ASP A 122 1.837 -8.752 -6.053 1.00 0.00 C ATOM 1813 O ASP A 122 1.089 -9.058 -6.963 1.00 0.00 O ATOM 1814 CB ASP A 122 2.325 -10.576 -4.414 1.00 0.00 C ATOM 1815 CG ASP A 122 1.834 -11.230 -3.121 1.00 0.00 C ATOM 1816 OD1 ASP A 122 0.643 -11.467 -3.017 1.00 0.00 O ATOM 1817 OD2 ASP A 122 2.658 -11.481 -2.258 1.00 0.00 O ATOM 0 H ASP A 122 -0.174 -10.416 -4.392 1.00 0.00 H new ATOM 0 HA ASP A 122 1.969 -8.510 -3.921 1.00 0.00 H new ATOM 0 HB2 ASP A 122 2.149 -11.241 -5.260 1.00 0.00 H new ATOM 0 HB3 ASP A 122 3.400 -10.405 -4.362 1.00 0.00 H new ATOM 1822 N TYR A 123 2.872 -7.982 -6.258 1.00 0.00 N ATOM 1823 CA TYR A 123 3.154 -7.466 -7.628 1.00 0.00 C ATOM 1824 C TYR A 123 4.647 -7.124 -7.755 1.00 0.00 C ATOM 1825 O TYR A 123 5.327 -6.898 -6.774 1.00 0.00 O ATOM 1826 CB TYR A 123 2.302 -6.210 -7.876 1.00 0.00 C ATOM 1827 CG TYR A 123 1.299 -6.478 -8.977 1.00 0.00 C ATOM 1828 CD1 TYR A 123 1.744 -6.799 -10.265 1.00 0.00 C ATOM 1829 CD2 TYR A 123 -0.076 -6.404 -8.710 1.00 0.00 C ATOM 1830 CE1 TYR A 123 0.818 -7.046 -11.286 1.00 0.00 C ATOM 1831 CE2 TYR A 123 -1.000 -6.651 -9.732 1.00 0.00 C ATOM 1832 CZ TYR A 123 -0.554 -6.972 -11.019 1.00 0.00 C ATOM 1833 OH TYR A 123 -1.467 -7.215 -12.025 1.00 0.00 O ATOM 0 H TYR A 123 3.532 -7.689 -5.538 1.00 0.00 H new ATOM 0 HA TYR A 123 2.904 -8.226 -8.368 1.00 0.00 H new ATOM 0 HB2 TYR A 123 1.783 -5.925 -6.961 1.00 0.00 H new ATOM 0 HB3 TYR A 123 2.944 -5.373 -8.152 1.00 0.00 H new ATOM 0 HD1 TYR A 123 2.803 -6.856 -10.471 1.00 0.00 H new ATOM 0 HD2 TYR A 123 -0.421 -6.157 -7.717 1.00 0.00 H new ATOM 0 HE1 TYR A 123 1.162 -7.294 -12.279 1.00 0.00 H new ATOM 0 HE2 TYR A 123 -2.059 -6.594 -9.527 1.00 0.00 H new ATOM 0 HH TYR A 123 -2.376 -7.123 -11.671 1.00 0.00 H new ATOM 1843 N ASN A 124 5.157 -7.091 -8.958 1.00 0.00 N ATOM 1844 CA ASN A 124 6.601 -6.767 -9.156 1.00 0.00 C ATOM 1845 C ASN A 124 6.924 -5.425 -8.496 1.00 0.00 C ATOM 1846 O ASN A 124 6.433 -4.392 -8.901 1.00 0.00 O ATOM 1847 CB ASN A 124 6.904 -6.686 -10.653 1.00 0.00 C ATOM 1848 CG ASN A 124 6.616 -8.039 -11.307 1.00 0.00 C ATOM 1849 OD1 ASN A 124 5.509 -8.293 -11.742 1.00 0.00 O ATOM 1850 ND2 ASN A 124 7.570 -8.923 -11.395 1.00 0.00 N ATOM 0 H ASN A 124 4.634 -7.275 -9.814 1.00 0.00 H new ATOM 0 HA ASN A 124 7.212 -7.547 -8.702 1.00 0.00 H new ATOM 0 HB2 ASN A 124 6.295 -5.909 -11.116 1.00 0.00 H new ATOM 0 HB3 ASN A 124 7.947 -6.409 -10.809 1.00 0.00 H new ATOM 0 HD21 ASN A 124 7.388 -9.828 -11.829 1.00 0.00 H new ATOM 0 HD22 ASN A 124 8.498 -8.710 -11.030 1.00 0.00 H new ATOM 1857 N CYS A 125 7.742 -5.437 -7.482 1.00 0.00 N ATOM 1858 CA CYS A 125 8.100 -4.172 -6.777 1.00 0.00 C ATOM 1859 C CYS A 125 8.503 -3.083 -7.778 1.00 0.00 C ATOM 1860 O CYS A 125 8.717 -1.946 -7.403 1.00 0.00 O ATOM 1861 CB CYS A 125 9.282 -4.431 -5.840 1.00 0.00 C ATOM 1862 SG CYS A 125 8.733 -5.419 -4.428 1.00 0.00 S ATOM 0 H CYS A 125 8.183 -6.277 -7.107 1.00 0.00 H new ATOM 0 HA CYS A 125 7.229 -3.836 -6.215 1.00 0.00 H new ATOM 0 HB2 CYS A 125 10.075 -4.953 -6.375 1.00 0.00 H new ATOM 0 HB3 CYS A 125 9.699 -3.485 -5.494 1.00 0.00 H new ATOM 1867 N ASN A 126 8.630 -3.409 -9.037 1.00 0.00 N ATOM 1868 CA ASN A 126 9.045 -2.369 -10.026 1.00 0.00 C ATOM 1869 C ASN A 126 7.829 -1.817 -10.778 1.00 0.00 C ATOM 1870 O ASN A 126 7.789 -0.653 -11.125 1.00 0.00 O ATOM 1871 CB ASN A 126 10.027 -2.982 -11.027 1.00 0.00 C ATOM 1872 CG ASN A 126 11.325 -3.355 -10.306 1.00 0.00 C ATOM 1873 OD1 ASN A 126 11.735 -2.682 -9.382 1.00 0.00 O ATOM 1874 ND2 ASN A 126 11.991 -4.407 -10.694 1.00 0.00 N ATOM 0 H ASN A 126 8.467 -4.340 -9.421 1.00 0.00 H new ATOM 0 HA ASN A 126 9.523 -1.550 -9.489 1.00 0.00 H new ATOM 0 HB2 ASN A 126 9.588 -3.866 -11.488 1.00 0.00 H new ATOM 0 HB3 ASN A 126 10.235 -2.274 -11.829 1.00 0.00 H new ATOM 0 HD21 ASN A 126 12.857 -4.665 -10.221 1.00 0.00 H new ATOM 0 HD22 ASN A 126 11.646 -4.972 -11.470 1.00 0.00 H new ATOM 1881 N VAL A 127 6.831 -2.622 -11.028 1.00 0.00 N ATOM 1882 CA VAL A 127 5.635 -2.095 -11.750 1.00 0.00 C ATOM 1883 C VAL A 127 5.132 -0.887 -10.967 1.00 0.00 C ATOM 1884 O VAL A 127 4.949 -0.958 -9.769 1.00 0.00 O ATOM 1885 CB VAL A 127 4.544 -3.174 -11.805 1.00 0.00 C ATOM 1886 CG1 VAL A 127 3.182 -2.529 -12.086 1.00 0.00 C ATOM 1887 CG2 VAL A 127 4.872 -4.171 -12.920 1.00 0.00 C ATOM 0 H VAL A 127 6.790 -3.608 -10.768 1.00 0.00 H new ATOM 0 HA VAL A 127 5.890 -1.815 -12.772 1.00 0.00 H new ATOM 0 HB VAL A 127 4.504 -3.691 -10.846 1.00 0.00 H new ATOM 0 HG11 VAL A 127 2.414 -3.302 -12.123 1.00 0.00 H new ATOM 0 HG12 VAL A 127 2.945 -1.820 -11.293 1.00 0.00 H new ATOM 0 HG13 VAL A 127 3.217 -2.006 -13.042 1.00 0.00 H new ATOM 0 HG21 VAL A 127 4.099 -4.938 -12.961 1.00 0.00 H new ATOM 0 HG22 VAL A 127 4.915 -3.648 -13.875 1.00 0.00 H new ATOM 0 HG23 VAL A 127 5.836 -4.638 -12.719 1.00 0.00 H new ATOM 1897 N ARG A 128 4.943 0.240 -11.605 1.00 0.00 N ATOM 1898 CA ARG A 128 4.501 1.420 -10.831 1.00 0.00 C ATOM 1899 C ARG A 128 2.998 1.450 -10.729 1.00 0.00 C ATOM 1900 O ARG A 128 2.314 0.954 -11.600 1.00 0.00 O ATOM 1901 CB ARG A 128 4.992 2.684 -11.549 1.00 0.00 C ATOM 1902 CG ARG A 128 5.129 2.405 -13.050 1.00 0.00 C ATOM 1903 CD ARG A 128 5.387 3.716 -13.806 1.00 0.00 C ATOM 1904 NE ARG A 128 4.238 3.999 -14.711 1.00 0.00 N ATOM 1905 CZ ARG A 128 4.376 4.844 -15.696 1.00 0.00 C ATOM 1906 NH1 ARG A 128 4.486 6.120 -15.449 1.00 0.00 N ATOM 1907 NH2 ARG A 128 4.405 4.412 -16.928 1.00 0.00 N ATOM 0 H ARG A 128 5.074 0.386 -12.606 1.00 0.00 H new ATOM 0 HA ARG A 128 4.914 1.370 -9.824 1.00 0.00 H new ATOM 0 HB2 ARG A 128 4.292 3.503 -11.384 1.00 0.00 H new ATOM 0 HB3 ARG A 128 5.952 2.998 -11.138 1.00 0.00 H new ATOM 0 HG2 ARG A 128 5.948 1.707 -13.225 1.00 0.00 H new ATOM 0 HG3 ARG A 128 4.221 1.932 -13.425 1.00 0.00 H new ATOM 0 HD2 ARG A 128 5.519 4.536 -13.100 1.00 0.00 H new ATOM 0 HD3 ARG A 128 6.309 3.641 -14.383 1.00 0.00 H new ATOM 0 HE ARG A 128 3.344 3.532 -14.561 1.00 0.00 H new ATOM 0 HH11 ARG A 128 4.464 6.457 -14.486 1.00 0.00 H new ATOM 0 HH12 ARG A 128 4.594 6.781 -16.218 1.00 0.00 H new ATOM 0 HH21 ARG A 128 4.320 3.414 -17.121 1.00 0.00 H new ATOM 0 HH22 ARG A 128 4.513 5.073 -17.698 1.00 0.00 H new ATOM 1921 N LEU A 129 2.445 2.022 -9.679 1.00 0.00 N ATOM 1922 CA LEU A 129 0.943 2.016 -9.632 1.00 0.00 C ATOM 1923 C LEU A 129 0.451 3.280 -8.979 1.00 0.00 C ATOM 1924 O LEU A 129 1.176 3.872 -8.202 1.00 0.00 O ATOM 1925 CB LEU A 129 0.480 0.828 -8.777 1.00 0.00 C ATOM 1926 CG LEU A 129 0.430 -0.461 -9.614 1.00 0.00 C ATOM 1927 CD1 LEU A 129 1.362 -1.513 -9.006 1.00 0.00 C ATOM 1928 CD2 LEU A 129 -0.998 -1.000 -9.611 1.00 0.00 C ATOM 0 H LEU A 129 2.931 2.466 -8.900 1.00 0.00 H new ATOM 0 HA LEU A 129 0.551 1.942 -10.646 1.00 0.00 H new ATOM 0 HB2 LEU A 129 1.159 0.694 -7.935 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -0.506 1.036 -8.362 1.00 0.00 H new ATOM 0 HG LEU A 129 0.748 -0.243 -10.633 1.00 0.00 H new ATOM 0 HD11 LEU A 129 1.322 -2.424 -9.604 1.00 0.00 H new ATOM 0 HD12 LEU A 129 2.383 -1.131 -8.994 1.00 0.00 H new ATOM 0 HD13 LEU A 129 1.046 -1.734 -7.987 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -1.043 -1.914 -10.202 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -1.304 -1.215 -8.587 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -1.669 -0.256 -10.041 1.00 0.00 H new ATOM 1940 N PRO A 130 -0.766 3.683 -9.189 1.00 0.00 N ATOM 1941 CA PRO A 130 -1.252 4.869 -8.461 1.00 0.00 C ATOM 1942 C PRO A 130 -1.080 4.562 -6.970 1.00 0.00 C ATOM 1943 O PRO A 130 -1.344 3.455 -6.551 1.00 0.00 O ATOM 1944 CB PRO A 130 -2.727 4.942 -8.877 1.00 0.00 C ATOM 1945 CG PRO A 130 -3.018 3.783 -9.850 1.00 0.00 C ATOM 1946 CD PRO A 130 -1.710 3.024 -10.124 1.00 0.00 C ATOM 0 HA PRO A 130 -0.741 5.810 -8.666 1.00 0.00 H new ATOM 0 HB2 PRO A 130 -3.372 4.872 -8.001 1.00 0.00 H new ATOM 0 HB3 PRO A 130 -2.939 5.899 -9.353 1.00 0.00 H new ATOM 0 HG2 PRO A 130 -3.762 3.110 -9.423 1.00 0.00 H new ATOM 0 HG3 PRO A 130 -3.433 4.168 -10.782 1.00 0.00 H new ATOM 0 HD2 PRO A 130 -1.807 1.958 -9.920 1.00 0.00 H new ATOM 0 HD3 PRO A 130 -1.391 3.123 -11.162 1.00 0.00 H new ATOM 1954 N TYR A 131 -0.579 5.462 -6.168 1.00 0.00 N ATOM 1955 CA TYR A 131 -0.354 5.079 -4.738 1.00 0.00 C ATOM 1956 C TYR A 131 -0.786 6.165 -3.761 1.00 0.00 C ATOM 1957 O TYR A 131 -1.164 7.256 -4.138 1.00 0.00 O ATOM 1958 CB TYR A 131 1.140 4.829 -4.543 1.00 0.00 C ATOM 1959 CG TYR A 131 1.891 6.128 -4.725 1.00 0.00 C ATOM 1960 CD1 TYR A 131 2.039 6.674 -6.006 1.00 0.00 C ATOM 1961 CD2 TYR A 131 2.435 6.786 -3.616 1.00 0.00 C ATOM 1962 CE1 TYR A 131 2.732 7.878 -6.178 1.00 0.00 C ATOM 1963 CE2 TYR A 131 3.128 7.991 -3.789 1.00 0.00 C ATOM 1964 CZ TYR A 131 3.277 8.536 -5.069 1.00 0.00 C ATOM 1965 OH TYR A 131 3.959 9.724 -5.238 1.00 0.00 O ATOM 0 H TYR A 131 -0.322 6.415 -6.425 1.00 0.00 H new ATOM 0 HA TYR A 131 -0.954 4.192 -4.533 1.00 0.00 H new ATOM 0 HB2 TYR A 131 1.326 4.424 -3.548 1.00 0.00 H new ATOM 0 HB3 TYR A 131 1.493 4.088 -5.260 1.00 0.00 H new ATOM 0 HD1 TYR A 131 1.618 6.166 -6.861 1.00 0.00 H new ATOM 0 HD2 TYR A 131 2.321 6.365 -2.628 1.00 0.00 H new ATOM 0 HE1 TYR A 131 2.846 8.299 -7.166 1.00 0.00 H new ATOM 0 HE2 TYR A 131 3.548 8.500 -2.934 1.00 0.00 H new ATOM 0 HH TYR A 131 4.271 10.049 -4.368 1.00 0.00 H new ATOM 1975 N VAL A 132 -0.693 5.860 -2.487 1.00 0.00 N ATOM 1976 CA VAL A 132 -1.054 6.855 -1.437 1.00 0.00 C ATOM 1977 C VAL A 132 0.203 7.131 -0.612 1.00 0.00 C ATOM 1978 O VAL A 132 1.140 6.359 -0.636 1.00 0.00 O ATOM 1979 CB VAL A 132 -2.153 6.284 -0.538 1.00 0.00 C ATOM 1980 CG1 VAL A 132 -2.462 7.273 0.590 1.00 0.00 C ATOM 1981 CG2 VAL A 132 -3.420 6.045 -1.363 1.00 0.00 C ATOM 0 H VAL A 132 -0.380 4.957 -2.132 1.00 0.00 H new ATOM 0 HA VAL A 132 -1.424 7.775 -1.889 1.00 0.00 H new ATOM 0 HB VAL A 132 -1.812 5.340 -0.112 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -3.245 6.864 1.228 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -1.563 7.442 1.182 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -2.799 8.218 0.163 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -4.201 5.638 -0.721 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -3.758 6.988 -1.793 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -3.205 5.338 -2.164 1.00 0.00 H new ATOM 1991 N CYS A 133 0.251 8.219 0.103 1.00 0.00 N ATOM 1992 CA CYS A 133 1.480 8.513 0.899 1.00 0.00 C ATOM 1993 C CYS A 133 1.111 9.194 2.220 1.00 0.00 C ATOM 1994 O CYS A 133 0.374 10.157 2.244 1.00 0.00 O ATOM 1995 CB CYS A 133 2.381 9.441 0.079 1.00 0.00 C ATOM 1996 SG CYS A 133 3.766 10.010 1.092 1.00 0.00 S ATOM 0 H CYS A 133 -0.495 8.911 0.173 1.00 0.00 H new ATOM 0 HA CYS A 133 1.999 7.581 1.124 1.00 0.00 H new ATOM 0 HB2 CYS A 133 2.754 8.916 -0.800 1.00 0.00 H new ATOM 0 HB3 CYS A 133 1.807 10.295 -0.280 1.00 0.00 H new ATOM 2001 N LYS A 134 1.634 8.706 3.323 1.00 0.00 N ATOM 2002 CA LYS A 134 1.321 9.336 4.642 1.00 0.00 C ATOM 2003 C LYS A 134 2.502 10.215 5.061 1.00 0.00 C ATOM 2004 O LYS A 134 3.615 10.003 4.629 1.00 0.00 O ATOM 2005 CB LYS A 134 1.079 8.237 5.690 1.00 0.00 C ATOM 2006 CG LYS A 134 2.397 7.847 6.369 1.00 0.00 C ATOM 2007 CD LYS A 134 2.197 6.554 7.165 1.00 0.00 C ATOM 2008 CE LYS A 134 3.334 6.389 8.179 1.00 0.00 C ATOM 2009 NZ LYS A 134 2.975 5.321 9.155 1.00 0.00 N ATOM 0 H LYS A 134 2.261 7.902 3.364 1.00 0.00 H new ATOM 0 HA LYS A 134 0.423 9.949 4.563 1.00 0.00 H new ATOM 0 HB2 LYS A 134 0.368 8.588 6.437 1.00 0.00 H new ATOM 0 HB3 LYS A 134 0.635 7.363 5.214 1.00 0.00 H new ATOM 0 HG2 LYS A 134 3.177 7.709 5.621 1.00 0.00 H new ATOM 0 HG3 LYS A 134 2.728 8.647 7.031 1.00 0.00 H new ATOM 0 HD2 LYS A 134 1.237 6.579 7.681 1.00 0.00 H new ATOM 0 HD3 LYS A 134 2.173 5.699 6.489 1.00 0.00 H new ATOM 0 HE2 LYS A 134 4.260 6.131 7.665 1.00 0.00 H new ATOM 0 HE3 LYS A 134 3.510 7.330 8.701 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 3.745 5.207 9.844 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 2.101 5.585 9.653 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 2.828 4.424 8.650 1.00 0.00 H new ATOM 2023 N PHE A 135 2.274 11.205 5.890 1.00 0.00 N ATOM 2024 CA PHE A 135 3.405 12.093 6.312 1.00 0.00 C ATOM 2025 C PHE A 135 2.904 13.165 7.283 1.00 0.00 C ATOM 2026 O PHE A 135 1.958 13.872 7.004 1.00 0.00 O ATOM 2027 CB PHE A 135 3.999 12.789 5.084 1.00 0.00 C ATOM 2028 CG PHE A 135 2.921 13.575 4.376 1.00 0.00 C ATOM 2029 CD1 PHE A 135 2.151 12.967 3.377 1.00 0.00 C ATOM 2030 CD2 PHE A 135 2.695 14.913 4.716 1.00 0.00 C ATOM 2031 CE1 PHE A 135 1.155 13.696 2.720 1.00 0.00 C ATOM 2032 CE2 PHE A 135 1.698 15.644 4.059 1.00 0.00 C ATOM 2033 CZ PHE A 135 0.927 15.035 3.060 1.00 0.00 C ATOM 0 H PHE A 135 1.364 11.436 6.290 1.00 0.00 H new ATOM 0 HA PHE A 135 4.162 11.480 6.802 1.00 0.00 H new ATOM 0 HB2 PHE A 135 4.809 13.453 5.386 1.00 0.00 H new ATOM 0 HB3 PHE A 135 4.429 12.050 4.407 1.00 0.00 H new ATOM 0 HD1 PHE A 135 2.326 11.934 3.114 1.00 0.00 H new ATOM 0 HD2 PHE A 135 3.290 15.382 5.486 1.00 0.00 H new ATOM 0 HE1 PHE A 135 0.561 13.226 1.950 1.00 0.00 H new ATOM 0 HE2 PHE A 135 1.523 16.677 4.322 1.00 0.00 H new ATOM 0 HZ PHE A 135 0.158 15.598 2.553 1.00 0.00 H new