USER MOD reduce.3.24.130724 H: found=0, std=0, add=1032, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1032 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 103 MET CE :methyl -173:sc= -3.43! (180deg=-2.5) USER MOD Set 1.2: A 123 GLN : amide:sc= -1.76 K(o=-5.2,f=-9.8!) USER MOD Set 2.1: A 111 CYS SG : rot 85:sc= 0.292 USER MOD Set 2.2: A 115 ASN : amide:sc= -0.262 X(o=0.03,f=0.07) USER MOD Single : A 9 GLN : amide:sc= -3.54! K(o=-3.5!,f=-1.5) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 GLN : amide:sc= -0.23 K(o=-0.23,f=-1.6!) USER MOD Single : A 15 GLN : amide:sc= -1.26 K(o=-1.3,f=-0.51) USER MOD Single : A 17 TYR OH : rot -91:sc= 0.527 USER MOD Single : A 20 ASN : amide:sc= -1.94 K(o=-1.9,f=-2.5!) USER MOD Single : A 24 LYS NZ :NH3+ -162:sc= -0.0075 (180deg=-0.228) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 SER OG : rot 82:sc= 0.934 USER MOD Single : A 36 MET CE :methyl 157:sc= -1.42 (180deg=-3.59!) USER MOD Single : A 37 GLN : amide:sc= 0 K(o=0,f=-0.89) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 THR OG1 : rot 60:sc= 0.36 USER MOD Single : A 44 ASN : amide:sc= -0.284 K(o=-0.28,f=-1.4!) USER MOD Single : A 49 MET CE :methyl 143:sc=-0.00355 (180deg=-3.13!) USER MOD Single : A 51 LYS NZ :NH3+ 166:sc= 0 (180deg=-0.126) USER MOD Single : A 52 SER OG : rot 70:sc= 0.0178 USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 TYR OH : rot 180:sc= -0.674 USER MOD Single : A 61 ASN : amide:sc= -0.114 K(o=-0.11,f=-1.6!) USER MOD Single : A 74 ASN : amide:sc= -0.445 K(o=-0.44,f=-3.8!) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 GLN : amide:sc= -0.47 X(o=-0.47,f=-0.33) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 HIS : no HD1:sc= -1.58 K(o=-1.6,f=-0.95) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot 96:sc= 1.05 USER MOD Single : A 100 THR OG1 : rot 88:sc= 1.16 USER MOD Single : A 101 GLN : amide:sc= -1.2 K(o=-1.2,f=-3.4!) USER MOD Single : A 102 TYR OH : rot 124:sc= 0.25 USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 TYR OH : rot 30:sc= -0.956 USER MOD Single : A 109 TYR OH : rot 138:sc= 0.392 USER MOD Single : A 113 LYS NZ :NH3+ -152:sc= 1.45 (180deg=-0.576) USER MOD Single : A 114 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0463) USER MOD Single : A 117 SER OG : rot 25:sc= 0.553 USER MOD Single : A 118 THR OG1 : rot 180:sc= -0.715 USER MOD Single : A 129 ASN : amide:sc= -15.7! C(o=-16!,f=-13!) USER MOD ----------------------------------------------------------------- ATOM 93 N GLN A 9 -15.660 -2.227 -7.486 1.00 0.00 N ATOM 94 CA GLN A 9 -14.318 -1.982 -8.098 1.00 0.00 C ATOM 95 C GLN A 9 -14.386 -0.800 -9.070 1.00 0.00 C ATOM 96 O GLN A 9 -13.483 0.012 -9.130 1.00 0.00 O ATOM 97 CB GLN A 9 -13.833 -3.231 -8.837 1.00 0.00 C ATOM 98 CG GLN A 9 -13.579 -4.349 -7.825 1.00 0.00 C ATOM 99 CD GLN A 9 -12.699 -5.422 -8.466 1.00 0.00 C ATOM 100 OE1 GLN A 9 -13.194 -6.408 -8.977 1.00 0.00 O ATOM 101 NE2 GLN A 9 -11.403 -5.265 -8.463 1.00 0.00 N ATOM 0 HA GLN A 9 -13.614 -1.747 -7.300 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -14.578 -3.548 -9.567 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -12.919 -3.010 -9.389 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -13.093 -3.947 -6.936 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -14.525 -4.784 -7.501 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -10.991 -4.437 -8.034 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -10.803 -5.971 -8.890 1.00 0.00 H new ATOM 110 N PHE A 10 -15.445 -0.684 -9.827 1.00 0.00 N ATOM 111 CA PHE A 10 -15.550 0.457 -10.784 1.00 0.00 C ATOM 112 C PHE A 10 -15.385 1.762 -10.019 1.00 0.00 C ATOM 113 O PHE A 10 -14.656 2.648 -10.418 1.00 0.00 O ATOM 114 CB PHE A 10 -16.922 0.431 -11.457 1.00 0.00 C ATOM 115 CG PHE A 10 -16.862 -0.481 -12.651 1.00 0.00 C ATOM 116 CD1 PHE A 10 -16.494 -1.814 -12.478 1.00 0.00 C ATOM 117 CD2 PHE A 10 -17.182 0.001 -13.924 1.00 0.00 C ATOM 118 CE1 PHE A 10 -16.440 -2.675 -13.579 1.00 0.00 C ATOM 119 CE2 PHE A 10 -17.129 -0.857 -15.028 1.00 0.00 C ATOM 120 CZ PHE A 10 -16.758 -2.196 -14.856 1.00 0.00 C ATOM 0 H PHE A 10 -16.238 -1.326 -9.825 1.00 0.00 H new ATOM 0 HA PHE A 10 -14.773 0.375 -11.544 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -17.680 0.083 -10.755 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -17.210 1.436 -11.765 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -16.250 -2.183 -11.493 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -17.470 1.034 -14.055 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -16.154 -3.708 -13.445 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -17.374 -0.487 -16.012 1.00 0.00 H new ATOM 0 HZ PHE A 10 -16.717 -2.859 -15.708 1.00 0.00 H new ATOM 130 N LYS A 11 -16.053 1.881 -8.915 1.00 0.00 N ATOM 131 CA LYS A 11 -15.927 3.125 -8.109 1.00 0.00 C ATOM 132 C LYS A 11 -14.474 3.281 -7.668 1.00 0.00 C ATOM 133 O LYS A 11 -13.919 4.356 -7.681 1.00 0.00 O ATOM 134 CB LYS A 11 -16.821 3.021 -6.872 1.00 0.00 C ATOM 135 CG LYS A 11 -18.285 2.835 -7.292 1.00 0.00 C ATOM 136 CD LYS A 11 -18.911 4.187 -7.658 1.00 0.00 C ATOM 137 CE LYS A 11 -18.925 5.105 -6.431 1.00 0.00 C ATOM 138 NZ LYS A 11 -20.166 5.930 -6.446 1.00 0.00 N ATOM 0 H LYS A 11 -16.681 1.174 -8.532 1.00 0.00 H new ATOM 0 HA LYS A 11 -16.230 3.986 -8.705 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -16.503 2.182 -6.254 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -16.720 3.921 -6.265 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -18.343 2.158 -8.144 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -18.847 2.374 -6.480 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -18.345 4.653 -8.465 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -19.927 4.040 -8.024 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -18.881 4.511 -5.518 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -18.046 5.750 -6.435 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -20.178 6.554 -5.614 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -20.189 6.506 -7.311 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -20.998 5.306 -6.423 1.00 0.00 H new ATOM 152 N GLN A 12 -13.860 2.207 -7.274 1.00 0.00 N ATOM 153 CA GLN A 12 -12.440 2.263 -6.815 1.00 0.00 C ATOM 154 C GLN A 12 -11.495 2.631 -7.965 1.00 0.00 C ATOM 155 O GLN A 12 -10.702 3.546 -7.860 1.00 0.00 O ATOM 156 CB GLN A 12 -12.054 0.878 -6.292 1.00 0.00 C ATOM 157 CG GLN A 12 -12.740 0.609 -4.957 1.00 0.00 C ATOM 158 CD GLN A 12 -11.998 1.352 -3.849 1.00 0.00 C ATOM 159 OE1 GLN A 12 -10.786 1.436 -3.864 1.00 0.00 O ATOM 160 NE2 GLN A 12 -12.674 1.892 -2.876 1.00 0.00 N ATOM 0 H GLN A 12 -14.282 1.279 -7.248 1.00 0.00 H new ATOM 0 HA GLN A 12 -12.351 3.024 -6.040 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -12.340 0.115 -7.016 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -10.972 0.815 -6.173 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -13.779 0.936 -4.997 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -12.750 -0.461 -4.749 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -13.692 1.822 -2.862 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -12.186 2.385 -2.128 1.00 0.00 H new ATOM 169 N VAL A 13 -11.559 1.919 -9.052 1.00 0.00 N ATOM 170 CA VAL A 13 -10.652 2.211 -10.196 1.00 0.00 C ATOM 171 C VAL A 13 -11.033 3.540 -10.865 1.00 0.00 C ATOM 172 O VAL A 13 -10.182 4.275 -11.309 1.00 0.00 O ATOM 173 CB VAL A 13 -10.732 1.051 -11.196 1.00 0.00 C ATOM 174 CG1 VAL A 13 -12.205 0.656 -11.438 1.00 0.00 C ATOM 175 CG2 VAL A 13 -10.086 1.469 -12.515 1.00 0.00 C ATOM 0 H VAL A 13 -12.204 1.143 -9.199 1.00 0.00 H new ATOM 0 HA VAL A 13 -9.628 2.309 -9.836 1.00 0.00 H new ATOM 0 HB VAL A 13 -10.201 0.192 -10.787 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -12.248 -0.168 -12.150 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -12.658 0.347 -10.496 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -12.750 1.511 -11.839 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -10.143 0.644 -13.225 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -10.612 2.334 -12.920 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -9.041 1.728 -12.343 1.00 0.00 H new ATOM 185 N ARG A 14 -12.288 3.882 -10.943 1.00 0.00 N ATOM 186 CA ARG A 14 -12.619 5.191 -11.577 1.00 0.00 C ATOM 187 C ARG A 14 -11.978 6.292 -10.739 1.00 0.00 C ATOM 188 O ARG A 14 -11.489 7.275 -11.256 1.00 0.00 O ATOM 189 CB ARG A 14 -14.134 5.405 -11.640 1.00 0.00 C ATOM 190 CG ARG A 14 -14.444 6.617 -12.531 1.00 0.00 C ATOM 191 CD ARG A 14 -14.542 6.161 -13.994 1.00 0.00 C ATOM 192 NE ARG A 14 -14.376 7.330 -14.923 1.00 0.00 N ATOM 193 CZ ARG A 14 -15.077 8.428 -14.788 1.00 0.00 C ATOM 194 NH1 ARG A 14 -16.064 8.492 -13.937 1.00 0.00 N ATOM 195 NH2 ARG A 14 -14.824 9.452 -15.556 1.00 0.00 N ATOM 0 H ARG A 14 -13.079 3.332 -10.607 1.00 0.00 H new ATOM 0 HA ARG A 14 -12.239 5.208 -12.599 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -14.621 4.514 -12.037 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -14.531 5.566 -10.638 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -15.380 7.082 -12.220 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -13.663 7.370 -12.425 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -13.776 5.414 -14.200 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -15.507 5.685 -14.169 1.00 0.00 H new ATOM 0 HE ARG A 14 -13.697 7.267 -15.682 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -16.298 7.680 -13.366 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -16.601 9.354 -13.843 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -14.084 9.394 -16.256 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -15.366 10.310 -15.456 1.00 0.00 H new ATOM 209 N GLN A 15 -11.947 6.119 -9.446 1.00 0.00 N ATOM 210 CA GLN A 15 -11.304 7.142 -8.588 1.00 0.00 C ATOM 211 C GLN A 15 -9.846 7.278 -9.016 1.00 0.00 C ATOM 212 O GLN A 15 -9.269 8.341 -8.960 1.00 0.00 O ATOM 213 CB GLN A 15 -11.378 6.713 -7.117 1.00 0.00 C ATOM 214 CG GLN A 15 -12.804 6.907 -6.600 1.00 0.00 C ATOM 215 CD GLN A 15 -13.078 8.398 -6.400 1.00 0.00 C ATOM 216 OE1 GLN A 15 -12.892 8.924 -5.320 1.00 0.00 O ATOM 217 NE2 GLN A 15 -13.505 9.108 -7.407 1.00 0.00 N ATOM 0 H GLN A 15 -12.338 5.316 -8.953 1.00 0.00 H new ATOM 0 HA GLN A 15 -11.818 8.097 -8.696 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -11.082 5.669 -7.016 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -10.680 7.301 -6.520 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -13.519 6.487 -7.308 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -12.936 6.373 -5.659 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -13.661 8.666 -8.313 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -13.683 10.105 -7.289 1.00 0.00 H new ATOM 226 N LEU A 16 -9.251 6.205 -9.462 1.00 0.00 N ATOM 227 CA LEU A 16 -7.829 6.280 -9.904 1.00 0.00 C ATOM 228 C LEU A 16 -7.685 7.223 -11.107 1.00 0.00 C ATOM 229 O LEU A 16 -6.727 7.964 -11.200 1.00 0.00 O ATOM 230 CB LEU A 16 -7.306 4.878 -10.267 1.00 0.00 C ATOM 231 CG LEU A 16 -6.655 4.216 -9.049 1.00 0.00 C ATOM 232 CD1 LEU A 16 -6.526 2.710 -9.305 1.00 0.00 C ATOM 233 CD2 LEU A 16 -5.256 4.819 -8.807 1.00 0.00 C ATOM 0 H LEU A 16 -9.685 5.285 -9.539 1.00 0.00 H new ATOM 0 HA LEU A 16 -7.236 6.675 -9.080 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -8.127 4.259 -10.629 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -6.582 4.952 -11.078 1.00 0.00 H new ATOM 0 HG LEU A 16 -7.274 4.390 -8.169 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -6.063 2.232 -8.441 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -7.515 2.283 -9.469 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -5.908 2.542 -10.187 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -4.800 4.343 -7.939 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -4.631 4.651 -9.684 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -5.348 5.890 -8.627 1.00 0.00 H new ATOM 245 N TYR A 17 -8.612 7.213 -12.033 1.00 0.00 N ATOM 246 CA TYR A 17 -8.473 8.125 -13.204 1.00 0.00 C ATOM 247 C TYR A 17 -8.928 9.538 -12.833 1.00 0.00 C ATOM 248 O TYR A 17 -8.391 10.515 -13.313 1.00 0.00 O ATOM 249 CB TYR A 17 -9.329 7.624 -14.372 1.00 0.00 C ATOM 250 CG TYR A 17 -8.827 6.284 -14.857 1.00 0.00 C ATOM 251 CD1 TYR A 17 -7.807 6.208 -15.819 1.00 0.00 C ATOM 252 CD2 TYR A 17 -9.397 5.112 -14.358 1.00 0.00 C ATOM 253 CE1 TYR A 17 -7.364 4.962 -16.270 1.00 0.00 C ATOM 254 CE2 TYR A 17 -8.949 3.868 -14.814 1.00 0.00 C ATOM 255 CZ TYR A 17 -7.935 3.794 -15.768 1.00 0.00 C ATOM 256 OH TYR A 17 -7.493 2.564 -16.209 1.00 0.00 O ATOM 0 H TYR A 17 -9.444 6.623 -12.028 1.00 0.00 H new ATOM 0 HA TYR A 17 -7.423 8.142 -13.498 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -10.369 7.538 -14.058 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -9.301 8.347 -15.188 1.00 0.00 H new ATOM 0 HD1 TYR A 17 -7.365 7.112 -16.210 1.00 0.00 H new ATOM 0 HD2 TYR A 17 -10.184 5.166 -13.620 1.00 0.00 H new ATOM 0 HE1 TYR A 17 -6.578 4.904 -17.009 1.00 0.00 H new ATOM 0 HE2 TYR A 17 -9.390 2.962 -14.426 1.00 0.00 H new ATOM 0 HH TYR A 17 -8.029 2.280 -16.979 1.00 0.00 H new ATOM 266 N GLU A 18 -9.942 9.662 -12.017 1.00 0.00 N ATOM 267 CA GLU A 18 -10.452 11.023 -11.667 1.00 0.00 C ATOM 268 C GLU A 18 -9.407 11.815 -10.883 1.00 0.00 C ATOM 269 O GLU A 18 -9.369 13.027 -10.935 1.00 0.00 O ATOM 270 CB GLU A 18 -11.718 10.889 -10.819 1.00 0.00 C ATOM 271 CG GLU A 18 -12.842 10.281 -11.659 1.00 0.00 C ATOM 272 CD GLU A 18 -13.203 11.234 -12.801 1.00 0.00 C ATOM 273 OE1 GLU A 18 -12.826 12.391 -12.721 1.00 0.00 O ATOM 274 OE2 GLU A 18 -13.853 10.792 -13.733 1.00 0.00 O ATOM 0 H GLU A 18 -10.437 8.885 -11.579 1.00 0.00 H new ATOM 0 HA GLU A 18 -10.671 11.556 -12.592 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -11.520 10.261 -9.950 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -12.020 11.867 -10.443 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -12.529 9.318 -12.061 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -13.717 10.097 -11.035 1.00 0.00 H new ATOM 281 N ILE A 19 -8.586 11.142 -10.136 1.00 0.00 N ATOM 282 CA ILE A 19 -7.564 11.843 -9.321 1.00 0.00 C ATOM 283 C ILE A 19 -6.983 13.044 -10.079 1.00 0.00 C ATOM 284 O ILE A 19 -6.725 14.077 -9.495 1.00 0.00 O ATOM 285 CB ILE A 19 -6.480 10.837 -8.959 1.00 0.00 C ATOM 286 CG1 ILE A 19 -6.966 10.009 -7.766 1.00 0.00 C ATOM 287 CG2 ILE A 19 -5.190 11.550 -8.580 1.00 0.00 C ATOM 288 CD1 ILE A 19 -6.219 8.683 -7.702 1.00 0.00 C ATOM 0 H ILE A 19 -8.579 10.125 -10.054 1.00 0.00 H new ATOM 0 HA ILE A 19 -8.017 12.239 -8.412 1.00 0.00 H new ATOM 0 HB ILE A 19 -6.282 10.197 -9.819 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -6.812 10.566 -6.842 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -8.037 9.827 -7.854 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -4.428 10.813 -8.325 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -4.846 12.151 -9.422 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -5.371 12.197 -7.722 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -6.575 8.106 -6.849 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -6.395 8.121 -8.619 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -5.151 8.872 -7.592 1.00 0.00 H new ATOM 300 N ASN A 20 -6.759 12.932 -11.361 1.00 0.00 N ATOM 301 CA ASN A 20 -6.179 14.099 -12.092 1.00 0.00 C ATOM 302 C ASN A 20 -6.214 13.864 -13.608 1.00 0.00 C ATOM 303 O ASN A 20 -6.395 12.760 -14.084 1.00 0.00 O ATOM 304 CB ASN A 20 -4.721 14.301 -11.635 1.00 0.00 C ATOM 305 CG ASN A 20 -4.628 15.500 -10.690 1.00 0.00 C ATOM 306 OD1 ASN A 20 -4.680 15.350 -9.485 1.00 0.00 O ATOM 307 ND2 ASN A 20 -4.491 16.694 -11.195 1.00 0.00 N ATOM 0 H ASN A 20 -6.947 12.103 -11.925 1.00 0.00 H new ATOM 0 HA ASN A 20 -6.770 14.987 -11.868 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -4.362 13.403 -11.132 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -4.079 14.460 -12.501 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -4.427 17.504 -10.579 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -4.448 16.818 -12.206 1.00 0.00 H new ATOM 314 N ASP A 21 -6.060 14.923 -14.362 1.00 0.00 N ATOM 315 CA ASP A 21 -6.101 14.816 -15.848 1.00 0.00 C ATOM 316 C ASP A 21 -4.698 14.556 -16.406 1.00 0.00 C ATOM 317 O ASP A 21 -4.135 15.381 -17.098 1.00 0.00 O ATOM 318 CB ASP A 21 -6.641 16.123 -16.429 1.00 0.00 C ATOM 319 CG ASP A 21 -8.118 16.279 -16.060 1.00 0.00 C ATOM 320 OD1 ASP A 21 -8.705 15.307 -15.618 1.00 0.00 O ATOM 321 OD2 ASP A 21 -8.637 17.372 -16.224 1.00 0.00 O ATOM 0 H ASP A 21 -5.906 15.866 -14.005 1.00 0.00 H new ATOM 0 HA ASP A 21 -6.749 13.985 -16.126 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -6.069 16.967 -16.044 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -6.524 16.126 -17.513 1.00 0.00 H new ATOM 326 N ASP A 22 -4.141 13.410 -16.127 1.00 0.00 N ATOM 327 CA ASP A 22 -2.783 13.082 -16.657 1.00 0.00 C ATOM 328 C ASP A 22 -2.917 11.947 -17.687 1.00 0.00 C ATOM 329 O ASP A 22 -3.028 10.793 -17.325 1.00 0.00 O ATOM 330 CB ASP A 22 -1.882 12.624 -15.509 1.00 0.00 C ATOM 331 CG ASP A 22 -0.530 12.184 -16.074 1.00 0.00 C ATOM 332 OD1 ASP A 22 -0.381 12.206 -17.285 1.00 0.00 O ATOM 333 OD2 ASP A 22 0.333 11.832 -15.286 1.00 0.00 O ATOM 0 H ASP A 22 -4.568 12.683 -15.553 1.00 0.00 H new ATOM 0 HA ASP A 22 -2.345 13.963 -17.126 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -1.744 13.435 -14.794 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -2.350 11.800 -14.970 1.00 0.00 H new ATOM 338 N PRO A 23 -2.921 12.265 -18.964 1.00 0.00 N ATOM 339 CA PRO A 23 -3.065 11.242 -20.043 1.00 0.00 C ATOM 340 C PRO A 23 -2.106 10.059 -19.873 1.00 0.00 C ATOM 341 O PRO A 23 -2.501 8.912 -19.967 1.00 0.00 O ATOM 342 CB PRO A 23 -2.734 12.009 -21.326 1.00 0.00 C ATOM 343 CG PRO A 23 -3.015 13.442 -21.019 1.00 0.00 C ATOM 344 CD PRO A 23 -2.794 13.624 -19.518 1.00 0.00 C ATOM 0 HA PRO A 23 -4.062 10.802 -20.038 1.00 0.00 H new ATOM 0 HB2 PRO A 23 -1.692 11.866 -21.611 1.00 0.00 H new ATOM 0 HB3 PRO A 23 -3.343 11.660 -22.160 1.00 0.00 H new ATOM 0 HG2 PRO A 23 -2.355 14.096 -21.589 1.00 0.00 H new ATOM 0 HG3 PRO A 23 -4.037 13.703 -21.294 1.00 0.00 H new ATOM 0 HD2 PRO A 23 -1.812 14.049 -19.309 1.00 0.00 H new ATOM 0 HD3 PRO A 23 -3.532 14.300 -19.086 1.00 0.00 H new ATOM 352 N LYS A 24 -0.854 10.320 -19.625 1.00 0.00 N ATOM 353 CA LYS A 24 0.108 9.199 -19.453 1.00 0.00 C ATOM 354 C LYS A 24 -0.345 8.332 -18.279 1.00 0.00 C ATOM 355 O LYS A 24 -0.244 7.123 -18.311 1.00 0.00 O ATOM 356 CB LYS A 24 1.510 9.756 -19.180 1.00 0.00 C ATOM 357 CG LYS A 24 2.114 10.312 -20.475 1.00 0.00 C ATOM 358 CD LYS A 24 1.553 11.709 -20.752 1.00 0.00 C ATOM 359 CE LYS A 24 2.297 12.334 -21.934 1.00 0.00 C ATOM 360 NZ LYS A 24 3.662 12.745 -21.501 1.00 0.00 N ATOM 0 H LYS A 24 -0.457 11.255 -19.534 1.00 0.00 H new ATOM 0 HA LYS A 24 0.140 8.598 -20.362 1.00 0.00 H new ATOM 0 HB2 LYS A 24 1.458 10.542 -18.427 1.00 0.00 H new ATOM 0 HB3 LYS A 24 2.150 8.971 -18.778 1.00 0.00 H new ATOM 0 HG2 LYS A 24 3.200 10.357 -20.391 1.00 0.00 H new ATOM 0 HG3 LYS A 24 1.886 9.647 -21.308 1.00 0.00 H new ATOM 0 HD2 LYS A 24 0.487 11.647 -20.971 1.00 0.00 H new ATOM 0 HD3 LYS A 24 1.661 12.337 -19.868 1.00 0.00 H new ATOM 0 HE2 LYS A 24 2.364 11.619 -22.754 1.00 0.00 H new ATOM 0 HE3 LYS A 24 1.747 13.198 -22.308 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 4.052 13.427 -22.183 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 3.610 13.187 -20.561 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 4.279 11.909 -21.456 1.00 0.00 H new ATOM 374 N ARG A 25 -0.859 8.941 -17.247 1.00 0.00 N ATOM 375 CA ARG A 25 -1.332 8.150 -16.079 1.00 0.00 C ATOM 376 C ARG A 25 -2.438 7.193 -16.526 1.00 0.00 C ATOM 377 O ARG A 25 -2.546 6.082 -16.046 1.00 0.00 O ATOM 378 CB ARG A 25 -1.886 9.086 -15.005 1.00 0.00 C ATOM 379 CG ARG A 25 -2.280 8.261 -13.779 1.00 0.00 C ATOM 380 CD ARG A 25 -2.832 9.171 -12.680 1.00 0.00 C ATOM 381 NE ARG A 25 -3.027 8.369 -11.438 1.00 0.00 N ATOM 382 CZ ARG A 25 -3.205 8.965 -10.291 1.00 0.00 C ATOM 383 NH1 ARG A 25 -3.209 10.266 -10.226 1.00 0.00 N ATOM 384 NH2 ARG A 25 -3.374 8.257 -9.210 1.00 0.00 N ATOM 0 H ARG A 25 -0.972 9.951 -17.163 1.00 0.00 H new ATOM 0 HA ARG A 25 -0.495 7.585 -15.670 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -1.138 9.831 -14.733 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -2.751 9.628 -15.388 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -3.029 7.520 -14.057 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -1.414 7.714 -13.407 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -2.143 9.995 -12.492 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -3.778 9.612 -12.996 1.00 0.00 H new ATOM 0 HE ARG A 25 -3.021 7.350 -11.485 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -3.073 10.819 -11.072 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -3.348 10.731 -9.329 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -3.367 7.238 -9.261 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -3.513 8.722 -8.313 1.00 0.00 H new ATOM 398 N LYS A 26 -3.272 7.621 -17.432 1.00 0.00 N ATOM 399 CA LYS A 26 -4.379 6.740 -17.892 1.00 0.00 C ATOM 400 C LYS A 26 -3.788 5.458 -18.486 1.00 0.00 C ATOM 401 O LYS A 26 -4.177 4.360 -18.137 1.00 0.00 O ATOM 402 CB LYS A 26 -5.189 7.478 -18.963 1.00 0.00 C ATOM 403 CG LYS A 26 -6.396 6.634 -19.372 1.00 0.00 C ATOM 404 CD LYS A 26 -7.142 7.336 -20.510 1.00 0.00 C ATOM 405 CE LYS A 26 -8.383 6.523 -20.885 1.00 0.00 C ATOM 406 NZ LYS A 26 -9.280 7.350 -21.742 1.00 0.00 N ATOM 0 H LYS A 26 -3.235 8.540 -17.872 1.00 0.00 H new ATOM 0 HA LYS A 26 -5.027 6.485 -17.054 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -5.521 8.443 -18.580 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -4.562 7.678 -19.832 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -6.071 5.644 -19.691 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -7.060 6.492 -18.520 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -7.432 8.341 -20.204 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -6.489 7.443 -21.376 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -8.090 5.617 -21.415 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -8.911 6.209 -19.984 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -10.123 6.797 -21.997 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -9.569 8.202 -21.221 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -8.774 7.628 -22.607 1.00 0.00 H new ATOM 420 N GLU A 27 -2.851 5.593 -19.380 1.00 0.00 N ATOM 421 CA GLU A 27 -2.228 4.388 -19.998 1.00 0.00 C ATOM 422 C GLU A 27 -1.723 3.458 -18.894 1.00 0.00 C ATOM 423 O GLU A 27 -1.787 2.251 -19.007 1.00 0.00 O ATOM 424 CB GLU A 27 -1.051 4.810 -20.880 1.00 0.00 C ATOM 425 CG GLU A 27 -1.565 5.613 -22.073 1.00 0.00 C ATOM 426 CD GLU A 27 -0.385 6.037 -22.949 1.00 0.00 C ATOM 427 OE1 GLU A 27 0.742 5.788 -22.551 1.00 0.00 O ATOM 428 OE2 GLU A 27 -0.627 6.601 -24.002 1.00 0.00 O ATOM 0 H GLU A 27 -2.488 6.487 -19.711 1.00 0.00 H new ATOM 0 HA GLU A 27 -2.969 3.870 -20.607 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -0.347 5.409 -20.302 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -0.510 3.930 -21.227 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -2.266 5.013 -22.654 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -2.109 6.492 -21.726 1.00 0.00 H new ATOM 435 N PHE A 28 -1.213 4.017 -17.832 1.00 0.00 N ATOM 436 CA PHE A 28 -0.689 3.186 -16.715 1.00 0.00 C ATOM 437 C PHE A 28 -1.804 2.348 -16.088 1.00 0.00 C ATOM 438 O PHE A 28 -1.756 1.134 -16.084 1.00 0.00 O ATOM 439 CB PHE A 28 -0.144 4.124 -15.650 1.00 0.00 C ATOM 440 CG PHE A 28 0.549 3.327 -14.587 1.00 0.00 C ATOM 441 CD1 PHE A 28 1.882 2.962 -14.772 1.00 0.00 C ATOM 442 CD2 PHE A 28 -0.124 2.978 -13.407 1.00 0.00 C ATOM 443 CE1 PHE A 28 2.551 2.245 -13.786 1.00 0.00 C ATOM 444 CE2 PHE A 28 0.546 2.255 -12.419 1.00 0.00 C ATOM 445 CZ PHE A 28 1.885 1.887 -12.606 1.00 0.00 C ATOM 0 H PHE A 28 -1.137 5.024 -17.690 1.00 0.00 H new ATOM 0 HA PHE A 28 0.081 2.517 -17.098 1.00 0.00 H new ATOM 0 HB2 PHE A 28 0.551 4.834 -16.098 1.00 0.00 H new ATOM 0 HB3 PHE A 28 -0.956 4.705 -15.212 1.00 0.00 H new ATOM 0 HD1 PHE A 28 2.395 3.236 -15.682 1.00 0.00 H new ATOM 0 HD2 PHE A 28 -1.155 3.267 -13.264 1.00 0.00 H new ATOM 0 HE1 PHE A 28 3.584 1.964 -13.930 1.00 0.00 H new ATOM 0 HE2 PHE A 28 0.032 1.979 -11.510 1.00 0.00 H new ATOM 0 HZ PHE A 28 2.404 1.328 -11.841 1.00 0.00 H new ATOM 455 N LEU A 29 -2.798 2.991 -15.543 1.00 0.00 N ATOM 456 CA LEU A 29 -3.914 2.247 -14.890 1.00 0.00 C ATOM 457 C LEU A 29 -4.500 1.224 -15.855 1.00 0.00 C ATOM 458 O LEU A 29 -4.707 0.076 -15.515 1.00 0.00 O ATOM 459 CB LEU A 29 -5.012 3.242 -14.531 1.00 0.00 C ATOM 460 CG LEU A 29 -4.459 4.316 -13.598 1.00 0.00 C ATOM 461 CD1 LEU A 29 -5.497 5.428 -13.437 1.00 0.00 C ATOM 462 CD2 LEU A 29 -4.149 3.703 -12.227 1.00 0.00 C ATOM 0 H LEU A 29 -2.887 4.007 -15.521 1.00 0.00 H new ATOM 0 HA LEU A 29 -3.536 1.738 -14.004 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -5.406 3.703 -15.436 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -5.841 2.723 -14.050 1.00 0.00 H new ATOM 0 HG LEU A 29 -3.543 4.727 -14.022 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -5.106 6.197 -12.771 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -5.714 5.867 -14.411 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -6.412 5.013 -13.014 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -3.755 4.474 -11.565 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -5.062 3.289 -11.799 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -3.410 2.910 -12.342 1.00 0.00 H new ATOM 474 N ASP A 30 -4.781 1.639 -17.052 1.00 0.00 N ATOM 475 CA ASP A 30 -5.373 0.691 -18.042 1.00 0.00 C ATOM 476 C ASP A 30 -4.431 -0.488 -18.279 1.00 0.00 C ATOM 477 O ASP A 30 -4.824 -1.634 -18.190 1.00 0.00 O ATOM 478 CB ASP A 30 -5.612 1.412 -19.370 1.00 0.00 C ATOM 479 CG ASP A 30 -6.836 2.322 -19.252 1.00 0.00 C ATOM 480 OD1 ASP A 30 -7.690 2.030 -18.432 1.00 0.00 O ATOM 481 OD2 ASP A 30 -6.896 3.296 -19.983 1.00 0.00 O ATOM 0 H ASP A 30 -4.629 2.588 -17.393 1.00 0.00 H new ATOM 0 HA ASP A 30 -6.319 0.322 -17.645 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -4.734 2.000 -19.638 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -5.764 0.684 -20.167 1.00 0.00 H new ATOM 486 N ASP A 31 -3.191 -0.226 -18.583 1.00 0.00 N ATOM 487 CA ASP A 31 -2.244 -1.347 -18.828 1.00 0.00 C ATOM 488 C ASP A 31 -2.029 -2.137 -17.533 1.00 0.00 C ATOM 489 O ASP A 31 -1.977 -3.351 -17.543 1.00 0.00 O ATOM 490 CB ASP A 31 -0.907 -0.791 -19.322 1.00 0.00 C ATOM 491 CG ASP A 31 -0.063 -1.934 -19.889 1.00 0.00 C ATOM 492 OD1 ASP A 31 -0.591 -3.027 -20.017 1.00 0.00 O ATOM 493 OD2 ASP A 31 1.096 -1.698 -20.189 1.00 0.00 O ATOM 0 H ASP A 31 -2.795 0.710 -18.672 1.00 0.00 H new ATOM 0 HA ASP A 31 -2.661 -2.010 -19.586 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -1.076 -0.034 -20.088 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -0.378 -0.304 -18.503 1.00 0.00 H new ATOM 498 N LEU A 32 -1.884 -1.465 -16.419 1.00 0.00 N ATOM 499 CA LEU A 32 -1.650 -2.203 -15.142 1.00 0.00 C ATOM 500 C LEU A 32 -2.790 -3.183 -14.881 1.00 0.00 C ATOM 501 O LEU A 32 -2.562 -4.348 -14.632 1.00 0.00 O ATOM 502 CB LEU A 32 -1.542 -1.217 -13.975 1.00 0.00 C ATOM 503 CG LEU A 32 -1.288 -1.978 -12.666 1.00 0.00 C ATOM 504 CD1 LEU A 32 0.076 -2.669 -12.717 1.00 0.00 C ATOM 505 CD2 LEU A 32 -1.291 -0.991 -11.501 1.00 0.00 C ATOM 0 H LEU A 32 -1.917 -0.449 -16.339 1.00 0.00 H new ATOM 0 HA LEU A 32 -0.716 -2.758 -15.229 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -0.732 -0.511 -14.158 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -2.460 -0.634 -13.894 1.00 0.00 H new ATOM 0 HG LEU A 32 -2.071 -2.725 -12.533 1.00 0.00 H new ATOM 0 HD11 LEU A 32 0.247 -3.206 -11.784 1.00 0.00 H new ATOM 0 HD12 LEU A 32 0.097 -3.372 -13.550 1.00 0.00 H new ATOM 0 HD13 LEU A 32 0.858 -1.922 -12.854 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -1.111 -1.527 -10.569 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -0.506 -0.249 -11.650 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -2.258 -0.491 -11.451 1.00 0.00 H new ATOM 517 N PHE A 33 -4.013 -2.742 -14.935 1.00 0.00 N ATOM 518 CA PHE A 33 -5.121 -3.697 -14.680 1.00 0.00 C ATOM 519 C PHE A 33 -5.039 -4.805 -15.726 1.00 0.00 C ATOM 520 O PHE A 33 -5.335 -5.953 -15.460 1.00 0.00 O ATOM 521 CB PHE A 33 -6.478 -2.994 -14.804 1.00 0.00 C ATOM 522 CG PHE A 33 -6.703 -2.039 -13.649 1.00 0.00 C ATOM 523 CD1 PHE A 33 -6.729 -2.513 -12.328 1.00 0.00 C ATOM 524 CD2 PHE A 33 -6.910 -0.675 -13.904 1.00 0.00 C ATOM 525 CE1 PHE A 33 -6.960 -1.624 -11.271 1.00 0.00 C ATOM 526 CE2 PHE A 33 -7.146 0.211 -12.845 1.00 0.00 C ATOM 527 CZ PHE A 33 -7.172 -0.263 -11.528 1.00 0.00 C ATOM 0 H PHE A 33 -4.290 -1.782 -15.140 1.00 0.00 H new ATOM 0 HA PHE A 33 -5.030 -4.101 -13.672 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -6.524 -2.448 -15.746 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -7.275 -3.737 -14.827 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -6.571 -3.562 -12.127 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -6.887 -0.307 -14.919 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -6.975 -1.989 -10.254 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -7.308 1.260 -13.045 1.00 0.00 H new ATOM 0 HZ PHE A 33 -7.355 0.419 -10.711 1.00 0.00 H new ATOM 537 N SER A 34 -4.632 -4.468 -16.920 1.00 0.00 N ATOM 538 CA SER A 34 -4.525 -5.500 -17.989 1.00 0.00 C ATOM 539 C SER A 34 -3.405 -6.488 -17.647 1.00 0.00 C ATOM 540 O SER A 34 -3.613 -7.684 -17.610 1.00 0.00 O ATOM 541 CB SER A 34 -4.223 -4.823 -19.327 1.00 0.00 C ATOM 542 OG SER A 34 -5.318 -3.990 -19.686 1.00 0.00 O ATOM 0 H SER A 34 -4.369 -3.523 -17.201 1.00 0.00 H new ATOM 0 HA SER A 34 -5.469 -6.040 -18.062 1.00 0.00 H new ATOM 0 HB2 SER A 34 -3.310 -4.232 -19.252 1.00 0.00 H new ATOM 0 HB3 SER A 34 -4.054 -5.574 -20.098 1.00 0.00 H new ATOM 0 HG SER A 34 -5.246 -3.134 -19.215 1.00 0.00 H new ATOM 548 N PHE A 35 -2.218 -5.999 -17.396 1.00 0.00 N ATOM 549 CA PHE A 35 -1.089 -6.908 -17.059 1.00 0.00 C ATOM 550 C PHE A 35 -1.417 -7.700 -15.797 1.00 0.00 C ATOM 551 O PHE A 35 -1.104 -8.867 -15.683 1.00 0.00 O ATOM 552 CB PHE A 35 0.161 -6.062 -16.824 1.00 0.00 C ATOM 553 CG PHE A 35 1.342 -6.949 -16.518 1.00 0.00 C ATOM 554 CD1 PHE A 35 1.775 -7.885 -17.462 1.00 0.00 C ATOM 555 CD2 PHE A 35 2.020 -6.815 -15.302 1.00 0.00 C ATOM 556 CE1 PHE A 35 2.889 -8.688 -17.189 1.00 0.00 C ATOM 557 CE2 PHE A 35 3.132 -7.617 -15.027 1.00 0.00 C ATOM 558 CZ PHE A 35 3.568 -8.551 -15.972 1.00 0.00 C ATOM 0 H PHE A 35 -1.984 -5.006 -17.411 1.00 0.00 H new ATOM 0 HA PHE A 35 -0.921 -7.608 -17.877 1.00 0.00 H new ATOM 0 HB2 PHE A 35 0.370 -5.457 -17.706 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -0.008 -5.372 -15.997 1.00 0.00 H new ATOM 0 HD1 PHE A 35 1.251 -7.988 -18.401 1.00 0.00 H new ATOM 0 HD2 PHE A 35 1.684 -6.091 -14.574 1.00 0.00 H new ATOM 0 HE1 PHE A 35 3.224 -9.412 -17.916 1.00 0.00 H new ATOM 0 HE2 PHE A 35 3.653 -7.515 -14.087 1.00 0.00 H new ATOM 0 HZ PHE A 35 4.430 -9.168 -15.763 1.00 0.00 H new ATOM 568 N MET A 36 -2.032 -7.066 -14.842 1.00 0.00 N ATOM 569 CA MET A 36 -2.372 -7.765 -13.574 1.00 0.00 C ATOM 570 C MET A 36 -3.267 -8.978 -13.847 1.00 0.00 C ATOM 571 O MET A 36 -3.076 -10.035 -13.280 1.00 0.00 O ATOM 572 CB MET A 36 -3.097 -6.781 -12.660 1.00 0.00 C ATOM 573 CG MET A 36 -2.086 -5.770 -12.119 1.00 0.00 C ATOM 574 SD MET A 36 -0.997 -6.581 -10.922 1.00 0.00 S ATOM 575 CE MET A 36 -2.089 -6.423 -9.491 1.00 0.00 C ATOM 0 H MET A 36 -2.316 -6.087 -14.885 1.00 0.00 H new ATOM 0 HA MET A 36 -1.458 -8.120 -13.099 1.00 0.00 H new ATOM 0 HB2 MET A 36 -3.886 -6.268 -13.209 1.00 0.00 H new ATOM 0 HB3 MET A 36 -3.575 -7.313 -11.837 1.00 0.00 H new ATOM 0 HG2 MET A 36 -1.498 -5.355 -12.938 1.00 0.00 H new ATOM 0 HG3 MET A 36 -2.607 -4.937 -11.646 1.00 0.00 H new ATOM 0 HE1 MET A 36 -1.833 -7.182 -8.752 1.00 0.00 H new ATOM 0 HE2 MET A 36 -1.970 -5.433 -9.050 1.00 0.00 H new ATOM 0 HE3 MET A 36 -3.124 -6.558 -9.806 1.00 0.00 H new ATOM 585 N GLN A 37 -4.237 -8.846 -14.708 1.00 0.00 N ATOM 586 CA GLN A 37 -5.123 -10.007 -15.002 1.00 0.00 C ATOM 587 C GLN A 37 -4.313 -11.118 -15.670 1.00 0.00 C ATOM 588 O GLN A 37 -4.546 -12.290 -15.451 1.00 0.00 O ATOM 589 CB GLN A 37 -6.259 -9.570 -15.927 1.00 0.00 C ATOM 590 CG GLN A 37 -7.182 -8.617 -15.168 1.00 0.00 C ATOM 591 CD GLN A 37 -8.333 -8.187 -16.076 1.00 0.00 C ATOM 592 OE1 GLN A 37 -8.176 -8.100 -17.278 1.00 0.00 O ATOM 593 NE2 GLN A 37 -9.495 -7.919 -15.548 1.00 0.00 N ATOM 0 H GLN A 37 -4.454 -7.990 -15.218 1.00 0.00 H new ATOM 0 HA GLN A 37 -5.544 -10.381 -14.069 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -5.855 -9.078 -16.812 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -6.818 -10.439 -16.273 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -7.573 -9.106 -14.276 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -6.623 -7.743 -14.833 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -9.626 -7.992 -14.539 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -10.273 -7.636 -16.144 1.00 0.00 H new ATOM 602 N LYS A 38 -3.361 -10.759 -16.487 1.00 0.00 N ATOM 603 CA LYS A 38 -2.538 -11.796 -17.169 1.00 0.00 C ATOM 604 C LYS A 38 -1.841 -12.671 -16.125 1.00 0.00 C ATOM 605 O LYS A 38 -1.914 -13.883 -16.163 1.00 0.00 O ATOM 606 CB LYS A 38 -1.481 -11.101 -18.037 1.00 0.00 C ATOM 607 CG LYS A 38 -0.593 -12.153 -18.708 1.00 0.00 C ATOM 608 CD LYS A 38 0.560 -11.467 -19.444 1.00 0.00 C ATOM 609 CE LYS A 38 0.024 -10.706 -20.658 1.00 0.00 C ATOM 610 NZ LYS A 38 1.145 -10.430 -21.602 1.00 0.00 N ATOM 0 H LYS A 38 -3.118 -9.794 -16.711 1.00 0.00 H new ATOM 0 HA LYS A 38 -3.179 -12.421 -17.791 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -1.966 -10.484 -18.794 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -0.873 -10.435 -17.424 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -0.200 -12.841 -17.959 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -1.182 -12.746 -19.408 1.00 0.00 H new ATOM 0 HD2 LYS A 38 1.075 -10.780 -18.772 1.00 0.00 H new ATOM 0 HD3 LYS A 38 1.292 -12.209 -19.763 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -0.750 -11.291 -21.155 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -0.438 -9.771 -20.341 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 0.783 -9.913 -22.429 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 1.868 -9.856 -21.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 1.566 -11.329 -21.913 1.00 0.00 H new ATOM 624 N ARG A 39 -1.136 -12.061 -15.219 1.00 0.00 N ATOM 625 CA ARG A 39 -0.387 -12.836 -14.192 1.00 0.00 C ATOM 626 C ARG A 39 -1.328 -13.614 -13.278 1.00 0.00 C ATOM 627 O ARG A 39 -0.910 -14.529 -12.595 1.00 0.00 O ATOM 628 CB ARG A 39 0.429 -11.872 -13.337 1.00 0.00 C ATOM 629 CG ARG A 39 1.432 -11.150 -14.217 1.00 0.00 C ATOM 630 CD ARG A 39 2.589 -10.660 -13.355 1.00 0.00 C ATOM 631 NE ARG A 39 3.355 -11.830 -12.839 1.00 0.00 N ATOM 632 CZ ARG A 39 4.584 -11.682 -12.428 1.00 0.00 C ATOM 633 NH1 ARG A 39 5.199 -10.543 -12.589 1.00 0.00 N ATOM 634 NH2 ARG A 39 5.213 -12.690 -11.889 1.00 0.00 N ATOM 0 H ARG A 39 -1.045 -11.048 -15.144 1.00 0.00 H new ATOM 0 HA ARG A 39 0.258 -13.545 -14.711 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -0.229 -11.153 -12.850 1.00 0.00 H new ATOM 0 HB3 ARG A 39 0.946 -12.416 -12.547 1.00 0.00 H new ATOM 0 HG2 ARG A 39 1.800 -11.819 -14.995 1.00 0.00 H new ATOM 0 HG3 ARG A 39 0.955 -10.309 -14.719 1.00 0.00 H new ATOM 0 HD2 ARG A 39 3.243 -10.013 -13.939 1.00 0.00 H new ATOM 0 HD3 ARG A 39 2.211 -10.064 -12.524 1.00 0.00 H new ATOM 0 HE ARG A 39 2.916 -12.750 -12.807 1.00 0.00 H new ATOM 0 HH11 ARG A 39 4.719 -9.763 -13.038 1.00 0.00 H new ATOM 0 HH12 ARG A 39 6.160 -10.432 -12.266 1.00 0.00 H new ATOM 0 HH21 ARG A 39 4.744 -13.590 -11.790 1.00 0.00 H new ATOM 0 HH22 ARG A 39 6.174 -12.578 -11.566 1.00 0.00 H new ATOM 648 N GLY A 40 -2.579 -13.268 -13.232 1.00 0.00 N ATOM 649 CA GLY A 40 -3.497 -14.008 -12.332 1.00 0.00 C ATOM 650 C GLY A 40 -3.596 -13.233 -11.030 1.00 0.00 C ATOM 651 O GLY A 40 -4.225 -13.665 -10.083 1.00 0.00 O ATOM 0 H GLY A 40 -3.002 -12.513 -13.772 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -4.480 -14.111 -12.791 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -3.123 -15.015 -12.149 1.00 0.00 H new ATOM 655 N THR A 41 -2.983 -12.076 -10.980 1.00 0.00 N ATOM 656 CA THR A 41 -3.056 -11.250 -9.738 1.00 0.00 C ATOM 657 C THR A 41 -3.798 -9.956 -10.063 1.00 0.00 C ATOM 658 O THR A 41 -3.191 -8.940 -10.323 1.00 0.00 O ATOM 659 CB THR A 41 -1.640 -10.894 -9.268 1.00 0.00 C ATOM 660 OG1 THR A 41 -0.876 -10.445 -10.379 1.00 0.00 O ATOM 661 CG2 THR A 41 -0.961 -12.117 -8.650 1.00 0.00 C ATOM 0 H THR A 41 -2.439 -11.671 -11.741 1.00 0.00 H new ATOM 0 HA THR A 41 -3.571 -11.808 -8.956 1.00 0.00 H new ATOM 0 HB THR A 41 -1.704 -10.107 -8.516 1.00 0.00 H new ATOM 0 HG1 THR A 41 -1.303 -9.655 -10.771 1.00 0.00 H new ATOM 0 HG21 THR A 41 0.043 -11.848 -8.321 1.00 0.00 H new ATOM 0 HG22 THR A 41 -1.542 -12.463 -7.795 1.00 0.00 H new ATOM 0 HG23 THR A 41 -0.899 -12.913 -9.392 1.00 0.00 H new ATOM 669 N PRO A 42 -5.104 -9.990 -10.034 1.00 0.00 N ATOM 670 CA PRO A 42 -5.947 -8.804 -10.319 1.00 0.00 C ATOM 671 C PRO A 42 -6.182 -7.974 -9.057 1.00 0.00 C ATOM 672 O PRO A 42 -6.260 -8.503 -7.965 1.00 0.00 O ATOM 673 CB PRO A 42 -7.239 -9.440 -10.811 1.00 0.00 C ATOM 674 CG PRO A 42 -7.368 -10.683 -9.998 1.00 0.00 C ATOM 675 CD PRO A 42 -5.938 -11.169 -9.735 1.00 0.00 C ATOM 0 HA PRO A 42 -5.501 -8.111 -11.032 1.00 0.00 H new ATOM 0 HB2 PRO A 42 -8.091 -8.777 -10.662 1.00 0.00 H new ATOM 0 HB3 PRO A 42 -7.192 -9.664 -11.877 1.00 0.00 H new ATOM 0 HG2 PRO A 42 -7.890 -10.484 -9.062 1.00 0.00 H new ATOM 0 HG3 PRO A 42 -7.945 -11.439 -10.531 1.00 0.00 H new ATOM 0 HD2 PRO A 42 -5.811 -11.498 -8.704 1.00 0.00 H new ATOM 0 HD3 PRO A 42 -5.679 -12.014 -10.373 1.00 0.00 H new ATOM 683 N ILE A 43 -6.282 -6.682 -9.182 1.00 0.00 N ATOM 684 CA ILE A 43 -6.493 -5.849 -7.969 1.00 0.00 C ATOM 685 C ILE A 43 -7.971 -5.879 -7.591 1.00 0.00 C ATOM 686 O ILE A 43 -8.779 -5.166 -8.152 1.00 0.00 O ATOM 687 CB ILE A 43 -6.066 -4.407 -8.252 1.00 0.00 C ATOM 688 CG1 ILE A 43 -4.718 -4.410 -8.986 1.00 0.00 C ATOM 689 CG2 ILE A 43 -5.921 -3.660 -6.924 1.00 0.00 C ATOM 690 CD1 ILE A 43 -4.266 -2.973 -9.289 1.00 0.00 C ATOM 0 H ILE A 43 -6.227 -6.171 -10.063 1.00 0.00 H new ATOM 0 HA ILE A 43 -5.896 -6.244 -7.147 1.00 0.00 H new ATOM 0 HB ILE A 43 -6.815 -3.915 -8.872 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -3.967 -4.913 -8.377 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -4.804 -4.974 -9.915 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -5.617 -2.631 -7.117 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -6.876 -3.664 -6.398 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -5.167 -4.152 -6.310 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -3.309 -2.995 -9.810 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -5.010 -2.483 -9.917 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -4.159 -2.421 -8.355 1.00 0.00 H new ATOM 702 N ASN A 44 -8.336 -6.694 -6.639 1.00 0.00 N ATOM 703 CA ASN A 44 -9.765 -6.759 -6.233 1.00 0.00 C ATOM 704 C ASN A 44 -10.176 -5.413 -5.627 1.00 0.00 C ATOM 705 O ASN A 44 -11.171 -4.828 -6.005 1.00 0.00 O ATOM 706 CB ASN A 44 -9.951 -7.879 -5.204 1.00 0.00 C ATOM 707 CG ASN A 44 -9.682 -9.232 -5.870 1.00 0.00 C ATOM 708 OD1 ASN A 44 -9.873 -9.385 -7.059 1.00 0.00 O ATOM 709 ND2 ASN A 44 -9.242 -10.228 -5.148 1.00 0.00 N ATOM 0 H ASN A 44 -7.708 -7.314 -6.128 1.00 0.00 H new ATOM 0 HA ASN A 44 -10.390 -6.968 -7.101 1.00 0.00 H new ATOM 0 HB2 ASN A 44 -9.271 -7.733 -4.364 1.00 0.00 H new ATOM 0 HB3 ASN A 44 -10.964 -7.854 -4.802 1.00 0.00 H new ATOM 0 HD21 ASN A 44 -9.060 -11.132 -5.584 1.00 0.00 H new ATOM 0 HD22 ASN A 44 -9.081 -10.101 -4.149 1.00 0.00 H new ATOM 716 N ARG A 45 -9.406 -4.912 -4.702 1.00 0.00 N ATOM 717 CA ARG A 45 -9.731 -3.599 -4.079 1.00 0.00 C ATOM 718 C ARG A 45 -8.453 -2.767 -3.987 1.00 0.00 C ATOM 719 O ARG A 45 -7.404 -3.271 -3.636 1.00 0.00 O ATOM 720 CB ARG A 45 -10.297 -3.839 -2.684 1.00 0.00 C ATOM 721 CG ARG A 45 -11.707 -4.450 -2.802 1.00 0.00 C ATOM 722 CD ARG A 45 -11.843 -5.633 -1.845 1.00 0.00 C ATOM 723 NE ARG A 45 -11.229 -6.838 -2.471 1.00 0.00 N ATOM 724 CZ ARG A 45 -11.003 -7.906 -1.756 1.00 0.00 C ATOM 725 NH1 ARG A 45 -11.347 -7.937 -0.499 1.00 0.00 N ATOM 726 NH2 ARG A 45 -10.434 -8.948 -2.303 1.00 0.00 N ATOM 0 H ARG A 45 -8.560 -5.359 -4.349 1.00 0.00 H new ATOM 0 HA ARG A 45 -10.468 -3.066 -4.680 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -9.644 -4.509 -2.125 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -10.340 -2.901 -2.131 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -12.460 -3.696 -2.572 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -11.887 -4.777 -3.826 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -11.352 -5.409 -0.898 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -12.894 -5.818 -1.623 1.00 0.00 H new ATOM 0 HE ARG A 45 -10.985 -6.828 -3.461 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -11.794 -7.125 -0.072 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -11.169 -8.773 0.058 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -10.167 -8.925 -3.287 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -10.257 -9.784 -1.746 1.00 0.00 H new ATOM 740 N LEU A 46 -8.518 -1.503 -4.300 1.00 0.00 N ATOM 741 CA LEU A 46 -7.283 -0.673 -4.220 1.00 0.00 C ATOM 742 C LEU A 46 -6.922 -0.441 -2.752 1.00 0.00 C ATOM 743 O LEU A 46 -7.789 -0.215 -1.932 1.00 0.00 O ATOM 744 CB LEU A 46 -7.515 0.696 -4.862 1.00 0.00 C ATOM 745 CG LEU A 46 -8.144 0.547 -6.242 1.00 0.00 C ATOM 746 CD1 LEU A 46 -8.671 1.909 -6.684 1.00 0.00 C ATOM 747 CD2 LEU A 46 -7.094 0.071 -7.245 1.00 0.00 C ATOM 0 H LEU A 46 -9.360 -1.014 -4.604 1.00 0.00 H new ATOM 0 HA LEU A 46 -6.484 -1.199 -4.742 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -8.164 1.296 -4.224 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -6.568 1.229 -4.945 1.00 0.00 H new ATOM 0 HG LEU A 46 -8.954 -0.182 -6.199 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -9.125 1.821 -7.671 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -9.418 2.259 -5.971 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -7.847 2.622 -6.726 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -7.551 -0.033 -8.229 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -6.284 0.799 -7.297 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -6.697 -0.893 -6.926 1.00 0.00 H new ATOM 759 N PRO A 47 -5.658 -0.449 -2.417 1.00 0.00 N ATOM 760 CA PRO A 47 -5.224 -0.181 -1.024 1.00 0.00 C ATOM 761 C PRO A 47 -5.433 1.297 -0.692 1.00 0.00 C ATOM 762 O PRO A 47 -4.739 2.157 -1.196 1.00 0.00 O ATOM 763 CB PRO A 47 -3.736 -0.542 -1.017 1.00 0.00 C ATOM 764 CG PRO A 47 -3.290 -0.433 -2.439 1.00 0.00 C ATOM 765 CD PRO A 47 -4.516 -0.713 -3.311 1.00 0.00 C ATOM 0 HA PRO A 47 -5.785 -0.750 -0.282 1.00 0.00 H new ATOM 0 HB2 PRO A 47 -3.171 0.135 -0.376 1.00 0.00 H new ATOM 0 HB3 PRO A 47 -3.579 -1.550 -0.633 1.00 0.00 H new ATOM 0 HG2 PRO A 47 -2.889 0.560 -2.643 1.00 0.00 H new ATOM 0 HG3 PRO A 47 -2.494 -1.147 -2.650 1.00 0.00 H new ATOM 0 HD2 PRO A 47 -4.538 -0.066 -4.188 1.00 0.00 H new ATOM 0 HD3 PRO A 47 -4.522 -1.741 -3.673 1.00 0.00 H new ATOM 773 N ILE A 48 -6.397 1.606 0.128 1.00 0.00 N ATOM 774 CA ILE A 48 -6.651 3.036 0.450 1.00 0.00 C ATOM 775 C ILE A 48 -5.615 3.546 1.440 1.00 0.00 C ATOM 776 O ILE A 48 -5.179 2.847 2.326 1.00 0.00 O ATOM 777 CB ILE A 48 -8.069 3.198 1.015 1.00 0.00 C ATOM 778 CG1 ILE A 48 -9.063 3.042 -0.147 1.00 0.00 C ATOM 779 CG2 ILE A 48 -8.237 4.578 1.686 1.00 0.00 C ATOM 780 CD1 ILE A 48 -10.501 3.119 0.367 1.00 0.00 C ATOM 0 H ILE A 48 -7.015 0.936 0.586 1.00 0.00 H new ATOM 0 HA ILE A 48 -6.569 3.627 -0.462 1.00 0.00 H new ATOM 0 HB ILE A 48 -8.255 2.440 1.776 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -8.892 3.824 -0.887 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -8.900 2.088 -0.648 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -9.249 4.671 2.079 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -7.521 4.676 2.502 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -8.060 5.364 0.952 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -11.192 3.007 -0.468 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -10.672 2.321 1.090 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -10.665 4.084 0.846 1.00 0.00 H new ATOM 792 N MET A 49 -5.221 4.771 1.271 1.00 0.00 N ATOM 793 CA MET A 49 -4.214 5.382 2.174 1.00 0.00 C ATOM 794 C MET A 49 -4.665 6.797 2.496 1.00 0.00 C ATOM 795 O MET A 49 -4.934 7.593 1.619 1.00 0.00 O ATOM 796 CB MET A 49 -2.859 5.397 1.474 1.00 0.00 C ATOM 797 CG MET A 49 -2.178 4.048 1.693 1.00 0.00 C ATOM 798 SD MET A 49 -1.316 4.054 3.283 1.00 0.00 S ATOM 799 CE MET A 49 0.193 4.873 2.717 1.00 0.00 C ATOM 0 H MET A 49 -5.560 5.387 0.532 1.00 0.00 H new ATOM 0 HA MET A 49 -4.120 4.811 3.097 1.00 0.00 H new ATOM 0 HB2 MET A 49 -2.987 5.587 0.408 1.00 0.00 H new ATOM 0 HB3 MET A 49 -2.239 6.202 1.869 1.00 0.00 H new ATOM 0 HG2 MET A 49 -2.918 3.248 1.672 1.00 0.00 H new ATOM 0 HG3 MET A 49 -1.472 3.850 0.886 1.00 0.00 H new ATOM 0 HE1 MET A 49 0.556 5.544 3.495 1.00 0.00 H new ATOM 0 HE2 MET A 49 0.954 4.124 2.500 1.00 0.00 H new ATOM 0 HE3 MET A 49 -0.020 5.446 1.814 1.00 0.00 H new ATOM 809 N ALA A 50 -4.786 7.103 3.748 1.00 0.00 N ATOM 810 CA ALA A 50 -5.266 8.458 4.128 1.00 0.00 C ATOM 811 C ALA A 50 -6.696 8.614 3.595 1.00 0.00 C ATOM 812 O ALA A 50 -7.082 9.646 3.087 1.00 0.00 O ATOM 813 CB ALA A 50 -4.353 9.522 3.514 1.00 0.00 C ATOM 0 H ALA A 50 -4.575 6.479 4.527 1.00 0.00 H new ATOM 0 HA ALA A 50 -5.252 8.581 5.211 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -4.709 10.513 3.795 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -3.336 9.384 3.881 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -4.363 9.428 2.428 1.00 0.00 H new ATOM 819 N LYS A 51 -7.469 7.569 3.723 1.00 0.00 N ATOM 820 CA LYS A 51 -8.891 7.576 3.253 1.00 0.00 C ATOM 821 C LYS A 51 -8.969 7.835 1.747 1.00 0.00 C ATOM 822 O LYS A 51 -9.979 8.276 1.238 1.00 0.00 O ATOM 823 CB LYS A 51 -9.673 8.657 3.997 1.00 0.00 C ATOM 824 CG LYS A 51 -9.663 8.340 5.490 1.00 0.00 C ATOM 825 CD LYS A 51 -10.508 9.374 6.226 1.00 0.00 C ATOM 826 CE LYS A 51 -10.445 9.110 7.731 1.00 0.00 C ATOM 827 NZ LYS A 51 -9.119 9.544 8.255 1.00 0.00 N ATOM 0 H LYS A 51 -7.170 6.689 4.143 1.00 0.00 H new ATOM 0 HA LYS A 51 -9.325 6.597 3.459 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -9.227 9.635 3.817 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -10.698 8.701 3.628 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -10.058 7.339 5.664 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -8.641 8.350 5.870 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -10.145 10.378 6.007 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -11.541 9.327 5.881 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -11.244 9.650 8.240 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -10.598 8.050 7.932 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -9.154 9.590 9.293 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -8.390 8.862 7.963 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -8.886 10.484 7.875 1.00 0.00 H new ATOM 841 N SER A 52 -7.919 7.558 1.028 1.00 0.00 N ATOM 842 CA SER A 52 -7.942 7.779 -0.451 1.00 0.00 C ATOM 843 C SER A 52 -7.301 6.580 -1.160 1.00 0.00 C ATOM 844 O SER A 52 -6.461 5.899 -0.608 1.00 0.00 O ATOM 845 CB SER A 52 -7.163 9.050 -0.791 1.00 0.00 C ATOM 846 OG SER A 52 -7.746 10.152 -0.109 1.00 0.00 O ATOM 0 H SER A 52 -7.043 7.188 1.397 1.00 0.00 H new ATOM 0 HA SER A 52 -8.974 7.887 -0.784 1.00 0.00 H new ATOM 0 HB2 SER A 52 -6.118 8.939 -0.501 1.00 0.00 H new ATOM 0 HB3 SER A 52 -7.178 9.223 -1.867 1.00 0.00 H new ATOM 0 HG SER A 52 -7.572 10.071 0.852 1.00 0.00 H new ATOM 852 N VAL A 53 -7.687 6.320 -2.381 1.00 0.00 N ATOM 853 CA VAL A 53 -7.091 5.164 -3.113 1.00 0.00 C ATOM 854 C VAL A 53 -5.607 5.443 -3.355 1.00 0.00 C ATOM 855 O VAL A 53 -5.209 6.567 -3.586 1.00 0.00 O ATOM 856 CB VAL A 53 -7.829 4.954 -4.450 1.00 0.00 C ATOM 857 CG1 VAL A 53 -9.306 5.303 -4.271 1.00 0.00 C ATOM 858 CG2 VAL A 53 -7.235 5.846 -5.551 1.00 0.00 C ATOM 0 H VAL A 53 -8.384 6.854 -2.900 1.00 0.00 H new ATOM 0 HA VAL A 53 -7.193 4.255 -2.520 1.00 0.00 H new ATOM 0 HB VAL A 53 -7.717 3.911 -4.746 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -9.832 5.156 -5.215 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -9.742 4.658 -3.508 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -9.399 6.344 -3.963 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -7.773 5.679 -6.484 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -7.328 6.893 -5.261 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -6.182 5.600 -5.690 1.00 0.00 H new ATOM 868 N LEU A 54 -4.779 4.436 -3.285 1.00 0.00 N ATOM 869 CA LEU A 54 -3.323 4.662 -3.494 1.00 0.00 C ATOM 870 C LEU A 54 -3.047 4.873 -4.980 1.00 0.00 C ATOM 871 O LEU A 54 -3.358 4.038 -5.805 1.00 0.00 O ATOM 872 CB LEU A 54 -2.549 3.436 -3.008 1.00 0.00 C ATOM 873 CG LEU A 54 -1.041 3.710 -3.082 1.00 0.00 C ATOM 874 CD1 LEU A 54 -0.648 4.761 -2.030 1.00 0.00 C ATOM 875 CD2 LEU A 54 -0.261 2.399 -2.841 1.00 0.00 C ATOM 0 H LEU A 54 -5.048 3.471 -3.093 1.00 0.00 H new ATOM 0 HA LEU A 54 -3.008 5.544 -2.936 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -2.835 3.197 -1.984 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -2.801 2.570 -3.620 1.00 0.00 H new ATOM 0 HG LEU A 54 -0.793 4.093 -4.072 1.00 0.00 H new ATOM 0 HD11 LEU A 54 0.424 4.951 -2.088 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -1.191 5.687 -2.220 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -0.898 4.391 -1.035 1.00 0.00 H new ATOM 0 HD21 LEU A 54 0.809 2.597 -2.894 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -0.508 2.004 -1.855 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -0.533 1.669 -3.603 1.00 0.00 H new ATOM 887 N ASP A 55 -2.466 5.989 -5.327 1.00 0.00 N ATOM 888 CA ASP A 55 -2.172 6.263 -6.760 1.00 0.00 C ATOM 889 C ASP A 55 -1.199 5.199 -7.283 1.00 0.00 C ATOM 890 O ASP A 55 -0.003 5.294 -7.087 1.00 0.00 O ATOM 891 CB ASP A 55 -1.524 7.642 -6.874 1.00 0.00 C ATOM 892 CG ASP A 55 -2.437 8.687 -6.231 1.00 0.00 C ATOM 893 OD1 ASP A 55 -3.524 8.319 -5.817 1.00 0.00 O ATOM 894 OD2 ASP A 55 -2.029 9.833 -6.149 1.00 0.00 O ATOM 0 H ASP A 55 -2.182 6.723 -4.678 1.00 0.00 H new ATOM 0 HA ASP A 55 -3.092 6.237 -7.345 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -0.551 7.641 -6.382 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -1.351 7.889 -7.921 1.00 0.00 H new ATOM 899 N LEU A 56 -1.703 4.179 -7.929 1.00 0.00 N ATOM 900 CA LEU A 56 -0.803 3.110 -8.436 1.00 0.00 C ATOM 901 C LEU A 56 0.216 3.724 -9.384 1.00 0.00 C ATOM 902 O LEU A 56 1.307 3.217 -9.552 1.00 0.00 O ATOM 903 CB LEU A 56 -1.624 2.062 -9.187 1.00 0.00 C ATOM 904 CG LEU A 56 -2.763 1.569 -8.296 1.00 0.00 C ATOM 905 CD1 LEU A 56 -3.511 0.438 -9.002 1.00 0.00 C ATOM 906 CD2 LEU A 56 -2.194 1.053 -6.971 1.00 0.00 C ATOM 0 H LEU A 56 -2.695 4.044 -8.125 1.00 0.00 H new ATOM 0 HA LEU A 56 -0.291 2.637 -7.598 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -2.026 2.490 -10.105 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -0.988 1.226 -9.477 1.00 0.00 H new ATOM 0 HG LEU A 56 -3.449 2.393 -8.099 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -4.323 0.087 -8.366 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -3.920 0.804 -9.944 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -2.824 -0.384 -9.200 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -3.008 0.702 -6.337 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -1.506 0.231 -7.166 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -1.662 1.859 -6.465 1.00 0.00 H new ATOM 918 N TYR A 57 -0.139 4.798 -10.023 1.00 0.00 N ATOM 919 CA TYR A 57 0.802 5.424 -10.979 1.00 0.00 C ATOM 920 C TYR A 57 1.850 6.281 -10.268 1.00 0.00 C ATOM 921 O TYR A 57 3.033 6.020 -10.367 1.00 0.00 O ATOM 922 CB TYR A 57 0.019 6.297 -11.946 1.00 0.00 C ATOM 923 CG TYR A 57 0.983 6.991 -12.867 1.00 0.00 C ATOM 924 CD1 TYR A 57 1.825 6.235 -13.676 1.00 0.00 C ATOM 925 CD2 TYR A 57 1.023 8.383 -12.924 1.00 0.00 C ATOM 926 CE1 TYR A 57 2.715 6.854 -14.543 1.00 0.00 C ATOM 927 CE2 TYR A 57 1.917 9.019 -13.790 1.00 0.00 C ATOM 928 CZ TYR A 57 2.766 8.253 -14.606 1.00 0.00 C ATOM 929 OH TYR A 57 3.648 8.876 -15.465 1.00 0.00 O ATOM 0 H TYR A 57 -1.039 5.268 -9.924 1.00 0.00 H new ATOM 0 HA TYR A 57 1.323 4.627 -11.510 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -0.680 5.689 -12.521 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -0.572 7.030 -11.397 1.00 0.00 H new ATOM 0 HD1 TYR A 57 1.786 5.157 -13.629 1.00 0.00 H new ATOM 0 HD2 TYR A 57 0.364 8.969 -12.300 1.00 0.00 H new ATOM 0 HE1 TYR A 57 3.366 6.259 -15.167 1.00 0.00 H new ATOM 0 HE2 TYR A 57 1.955 10.098 -13.832 1.00 0.00 H new ATOM 0 HH TYR A 57 3.553 9.848 -15.384 1.00 0.00 H new ATOM 939 N GLU A 58 1.451 7.315 -9.577 1.00 0.00 N ATOM 940 CA GLU A 58 2.465 8.177 -8.908 1.00 0.00 C ATOM 941 C GLU A 58 3.348 7.333 -7.992 1.00 0.00 C ATOM 942 O GLU A 58 4.541 7.551 -7.908 1.00 0.00 O ATOM 943 CB GLU A 58 1.759 9.268 -8.105 1.00 0.00 C ATOM 944 CG GLU A 58 1.150 10.293 -9.069 1.00 0.00 C ATOM 945 CD GLU A 58 2.272 11.056 -9.777 1.00 0.00 C ATOM 946 OE1 GLU A 58 3.388 11.024 -9.283 1.00 0.00 O ATOM 947 OE2 GLU A 58 1.996 11.661 -10.800 1.00 0.00 O ATOM 0 H GLU A 58 0.479 7.597 -9.448 1.00 0.00 H new ATOM 0 HA GLU A 58 3.096 8.644 -9.664 1.00 0.00 H new ATOM 0 HB2 GLU A 58 0.979 8.830 -7.482 1.00 0.00 H new ATOM 0 HB3 GLU A 58 2.466 9.757 -7.435 1.00 0.00 H new ATOM 0 HG2 GLU A 58 0.519 9.789 -9.802 1.00 0.00 H new ATOM 0 HG3 GLU A 58 0.512 10.987 -8.523 1.00 0.00 H new ATOM 954 N LEU A 59 2.804 6.348 -7.328 1.00 0.00 N ATOM 955 CA LEU A 59 3.675 5.502 -6.470 1.00 0.00 C ATOM 956 C LEU A 59 4.679 4.809 -7.383 1.00 0.00 C ATOM 957 O LEU A 59 5.863 4.776 -7.123 1.00 0.00 O ATOM 958 CB LEU A 59 2.838 4.451 -5.740 1.00 0.00 C ATOM 959 CG LEU A 59 3.770 3.459 -5.034 1.00 0.00 C ATOM 960 CD1 LEU A 59 4.785 4.220 -4.181 1.00 0.00 C ATOM 961 CD2 LEU A 59 2.942 2.541 -4.135 1.00 0.00 C ATOM 0 H LEU A 59 1.815 6.098 -7.342 1.00 0.00 H new ATOM 0 HA LEU A 59 4.182 6.114 -5.724 1.00 0.00 H new ATOM 0 HB2 LEU A 59 2.183 4.932 -5.013 1.00 0.00 H new ATOM 0 HB3 LEU A 59 2.197 3.925 -6.447 1.00 0.00 H new ATOM 0 HG LEU A 59 4.299 2.866 -5.781 1.00 0.00 H new ATOM 0 HD11 LEU A 59 5.445 3.511 -3.681 1.00 0.00 H new ATOM 0 HD12 LEU A 59 5.375 4.878 -4.819 1.00 0.00 H new ATOM 0 HD13 LEU A 59 4.259 4.815 -3.434 1.00 0.00 H new ATOM 0 HD21 LEU A 59 3.601 1.834 -3.631 1.00 0.00 H new ATOM 0 HD22 LEU A 59 2.415 3.139 -3.392 1.00 0.00 H new ATOM 0 HD23 LEU A 59 2.219 1.995 -4.740 1.00 0.00 H new ATOM 973 N TYR A 60 4.198 4.286 -8.474 1.00 0.00 N ATOM 974 CA TYR A 60 5.084 3.613 -9.453 1.00 0.00 C ATOM 975 C TYR A 60 6.084 4.635 -9.994 1.00 0.00 C ATOM 976 O TYR A 60 7.273 4.545 -9.757 1.00 0.00 O ATOM 977 CB TYR A 60 4.203 3.109 -10.590 1.00 0.00 C ATOM 978 CG TYR A 60 5.014 2.301 -11.558 1.00 0.00 C ATOM 979 CD1 TYR A 60 5.184 0.938 -11.338 1.00 0.00 C ATOM 980 CD2 TYR A 60 5.582 2.911 -12.681 1.00 0.00 C ATOM 981 CE1 TYR A 60 5.924 0.174 -12.241 1.00 0.00 C ATOM 982 CE2 TYR A 60 6.326 2.148 -13.586 1.00 0.00 C ATOM 983 CZ TYR A 60 6.498 0.777 -13.367 1.00 0.00 C ATOM 984 OH TYR A 60 7.230 0.020 -14.261 1.00 0.00 O ATOM 0 H TYR A 60 3.211 4.298 -8.730 1.00 0.00 H new ATOM 0 HA TYR A 60 5.628 2.787 -8.995 1.00 0.00 H new ATOM 0 HB2 TYR A 60 3.392 2.501 -10.189 1.00 0.00 H new ATOM 0 HB3 TYR A 60 3.744 3.953 -11.105 1.00 0.00 H new ATOM 0 HD1 TYR A 60 4.744 0.472 -10.469 1.00 0.00 H new ATOM 0 HD2 TYR A 60 5.446 3.969 -12.849 1.00 0.00 H new ATOM 0 HE1 TYR A 60 6.054 -0.885 -12.071 1.00 0.00 H new ATOM 0 HE2 TYR A 60 6.767 2.616 -14.453 1.00 0.00 H new ATOM 0 HH TYR A 60 7.556 0.594 -14.985 1.00 0.00 H new ATOM 994 N ASN A 61 5.604 5.604 -10.720 1.00 0.00 N ATOM 995 CA ASN A 61 6.512 6.637 -11.290 1.00 0.00 C ATOM 996 C ASN A 61 7.538 7.047 -10.235 1.00 0.00 C ATOM 997 O ASN A 61 8.695 7.264 -10.535 1.00 0.00 O ATOM 998 CB ASN A 61 5.691 7.859 -11.711 1.00 0.00 C ATOM 999 CG ASN A 61 6.552 8.791 -12.566 1.00 0.00 C ATOM 1000 OD1 ASN A 61 7.717 8.530 -12.784 1.00 0.00 O ATOM 1001 ND2 ASN A 61 6.020 9.874 -13.064 1.00 0.00 N ATOM 0 H ASN A 61 4.616 5.726 -10.944 1.00 0.00 H new ATOM 0 HA ASN A 61 7.029 6.231 -12.160 1.00 0.00 H new ATOM 0 HB2 ASN A 61 4.813 7.542 -12.273 1.00 0.00 H new ATOM 0 HB3 ASN A 61 5.331 8.388 -10.829 1.00 0.00 H new ATOM 0 HD21 ASN A 61 6.584 10.502 -13.637 1.00 0.00 H new ATOM 0 HD22 ASN A 61 5.041 10.092 -12.880 1.00 0.00 H new ATOM 1008 N LEU A 62 7.136 7.132 -8.997 1.00 0.00 N ATOM 1009 CA LEU A 62 8.115 7.502 -7.940 1.00 0.00 C ATOM 1010 C LEU A 62 9.076 6.329 -7.753 1.00 0.00 C ATOM 1011 O LEU A 62 10.276 6.489 -7.730 1.00 0.00 O ATOM 1012 CB LEU A 62 7.392 7.797 -6.618 1.00 0.00 C ATOM 1013 CG LEU A 62 6.914 9.254 -6.584 1.00 0.00 C ATOM 1014 CD1 LEU A 62 5.771 9.404 -5.568 1.00 0.00 C ATOM 1015 CD2 LEU A 62 8.077 10.179 -6.191 1.00 0.00 C ATOM 0 H LEU A 62 6.183 6.963 -8.675 1.00 0.00 H new ATOM 0 HA LEU A 62 8.659 8.399 -8.237 1.00 0.00 H new ATOM 0 HB2 LEU A 62 6.541 7.126 -6.504 1.00 0.00 H new ATOM 0 HB3 LEU A 62 8.062 7.608 -5.779 1.00 0.00 H new ATOM 0 HG LEU A 62 6.555 9.531 -7.575 1.00 0.00 H new ATOM 0 HD11 LEU A 62 5.436 10.441 -5.548 1.00 0.00 H new ATOM 0 HD12 LEU A 62 4.941 8.759 -5.857 1.00 0.00 H new ATOM 0 HD13 LEU A 62 6.125 9.118 -4.577 1.00 0.00 H new ATOM 0 HD21 LEU A 62 7.729 11.212 -6.169 1.00 0.00 H new ATOM 0 HD22 LEU A 62 8.447 9.900 -5.204 1.00 0.00 H new ATOM 0 HD23 LEU A 62 8.881 10.082 -6.920 1.00 0.00 H new ATOM 1027 N VAL A 63 8.550 5.147 -7.618 1.00 0.00 N ATOM 1028 CA VAL A 63 9.424 3.959 -7.430 1.00 0.00 C ATOM 1029 C VAL A 63 10.434 3.863 -8.578 1.00 0.00 C ATOM 1030 O VAL A 63 11.597 3.585 -8.360 1.00 0.00 O ATOM 1031 CB VAL A 63 8.556 2.692 -7.380 1.00 0.00 C ATOM 1032 CG1 VAL A 63 9.435 1.461 -7.564 1.00 0.00 C ATOM 1033 CG2 VAL A 63 7.838 2.603 -6.018 1.00 0.00 C ATOM 0 H VAL A 63 7.549 4.951 -7.630 1.00 0.00 H new ATOM 0 HA VAL A 63 9.972 4.057 -6.493 1.00 0.00 H new ATOM 0 HB VAL A 63 7.816 2.737 -8.179 1.00 0.00 H new ATOM 0 HG11 VAL A 63 8.817 0.564 -7.528 1.00 0.00 H new ATOM 0 HG12 VAL A 63 9.940 1.515 -8.528 1.00 0.00 H new ATOM 0 HG13 VAL A 63 10.178 1.422 -6.767 1.00 0.00 H new ATOM 0 HG21 VAL A 63 7.224 1.703 -5.988 1.00 0.00 H new ATOM 0 HG22 VAL A 63 8.578 2.564 -5.219 1.00 0.00 H new ATOM 0 HG23 VAL A 63 7.204 3.479 -5.883 1.00 0.00 H new ATOM 1043 N ILE A 64 10.020 4.098 -9.792 1.00 0.00 N ATOM 1044 CA ILE A 64 10.998 4.024 -10.914 1.00 0.00 C ATOM 1045 C ILE A 64 11.933 5.228 -10.802 1.00 0.00 C ATOM 1046 O ILE A 64 13.097 5.161 -11.141 1.00 0.00 O ATOM 1047 CB ILE A 64 10.278 4.064 -12.265 1.00 0.00 C ATOM 1048 CG1 ILE A 64 9.023 3.189 -12.225 1.00 0.00 C ATOM 1049 CG2 ILE A 64 11.217 3.531 -13.356 1.00 0.00 C ATOM 1050 CD1 ILE A 64 9.384 1.765 -11.804 1.00 0.00 C ATOM 0 H ILE A 64 9.063 4.334 -10.054 1.00 0.00 H new ATOM 0 HA ILE A 64 11.555 3.089 -10.853 1.00 0.00 H new ATOM 0 HB ILE A 64 9.993 5.094 -12.480 1.00 0.00 H new ATOM 0 HG12 ILE A 64 8.300 3.610 -11.527 1.00 0.00 H new ATOM 0 HG13 ILE A 64 8.548 3.176 -13.206 1.00 0.00 H new ATOM 0 HG21 ILE A 64 10.708 3.558 -14.319 1.00 0.00 H new ATOM 0 HG22 ILE A 64 12.112 4.152 -13.401 1.00 0.00 H new ATOM 0 HG23 ILE A 64 11.499 2.504 -13.123 1.00 0.00 H new ATOM 0 HD11 ILE A 64 8.482 1.153 -11.780 1.00 0.00 H new ATOM 0 HD12 ILE A 64 10.090 1.342 -12.519 1.00 0.00 H new ATOM 0 HD13 ILE A 64 9.837 1.782 -10.813 1.00 0.00 H new ATOM 1062 N ALA A 65 11.419 6.339 -10.338 1.00 0.00 N ATOM 1063 CA ALA A 65 12.271 7.554 -10.220 1.00 0.00 C ATOM 1064 C ALA A 65 13.477 7.249 -9.332 1.00 0.00 C ATOM 1065 O ALA A 65 14.478 7.937 -9.383 1.00 0.00 O ATOM 1066 CB ALA A 65 11.466 8.712 -9.622 1.00 0.00 C ATOM 0 H ALA A 65 10.451 6.454 -10.038 1.00 0.00 H new ATOM 0 HA ALA A 65 12.615 7.843 -11.213 1.00 0.00 H new ATOM 0 HB1 ALA A 65 12.102 9.594 -9.542 1.00 0.00 H new ATOM 0 HB2 ALA A 65 10.616 8.935 -10.267 1.00 0.00 H new ATOM 0 HB3 ALA A 65 11.107 8.432 -8.632 1.00 0.00 H new ATOM 1072 N ARG A 66 13.415 6.217 -8.530 1.00 0.00 N ATOM 1073 CA ARG A 66 14.583 5.882 -7.671 1.00 0.00 C ATOM 1074 C ARG A 66 15.402 4.794 -8.376 1.00 0.00 C ATOM 1075 O ARG A 66 16.463 4.402 -7.933 1.00 0.00 O ATOM 1076 CB ARG A 66 14.084 5.365 -6.321 1.00 0.00 C ATOM 1077 CG ARG A 66 12.973 6.276 -5.798 1.00 0.00 C ATOM 1078 CD ARG A 66 13.533 7.673 -5.533 1.00 0.00 C ATOM 1079 NE ARG A 66 12.547 8.466 -4.740 1.00 0.00 N ATOM 1080 CZ ARG A 66 11.328 8.653 -5.168 1.00 0.00 C ATOM 1081 NH1 ARG A 66 10.996 8.285 -6.373 1.00 0.00 N ATOM 1082 NH2 ARG A 66 10.453 9.257 -4.411 1.00 0.00 N ATOM 0 H ARG A 66 12.610 5.597 -8.435 1.00 0.00 H new ATOM 0 HA ARG A 66 15.202 6.764 -7.506 1.00 0.00 H new ATOM 0 HB2 ARG A 66 13.712 4.346 -6.426 1.00 0.00 H new ATOM 0 HB3 ARG A 66 14.907 5.332 -5.607 1.00 0.00 H new ATOM 0 HG2 ARG A 66 12.162 6.331 -6.525 1.00 0.00 H new ATOM 0 HG3 ARG A 66 12.552 5.863 -4.881 1.00 0.00 H new ATOM 0 HD2 ARG A 66 14.476 7.601 -4.992 1.00 0.00 H new ATOM 0 HD3 ARG A 66 13.745 8.176 -6.477 1.00 0.00 H new ATOM 0 HE ARG A 66 12.831 8.869 -3.847 1.00 0.00 H new ATOM 0 HH11 ARG A 66 11.689 7.850 -6.983 1.00 0.00 H new ATOM 0 HH12 ARG A 66 10.043 8.431 -6.707 1.00 0.00 H new ATOM 0 HH21 ARG A 66 10.721 9.584 -3.483 1.00 0.00 H new ATOM 0 HH22 ARG A 66 9.501 9.402 -4.748 1.00 0.00 H new ATOM 1096 N GLY A 67 14.916 4.340 -9.499 1.00 0.00 N ATOM 1097 CA GLY A 67 15.653 3.310 -10.286 1.00 0.00 C ATOM 1098 C GLY A 67 15.346 1.884 -9.801 1.00 0.00 C ATOM 1099 O GLY A 67 16.021 0.951 -10.187 1.00 0.00 O ATOM 0 H GLY A 67 14.032 4.641 -9.909 1.00 0.00 H new ATOM 0 HA2 GLY A 67 15.387 3.400 -11.339 1.00 0.00 H new ATOM 0 HA3 GLY A 67 16.725 3.495 -10.211 1.00 0.00 H new ATOM 1103 N GLY A 68 14.336 1.679 -8.989 1.00 0.00 N ATOM 1104 CA GLY A 68 14.035 0.276 -8.551 1.00 0.00 C ATOM 1105 C GLY A 68 13.544 0.228 -7.100 1.00 0.00 C ATOM 1106 O GLY A 68 14.129 0.811 -6.208 1.00 0.00 O ATOM 0 H GLY A 68 13.720 2.402 -8.617 1.00 0.00 H new ATOM 0 HA2 GLY A 68 13.278 -0.155 -9.206 1.00 0.00 H new ATOM 0 HA3 GLY A 68 14.931 -0.337 -8.653 1.00 0.00 H new ATOM 1110 N LEU A 69 12.459 -0.470 -6.868 1.00 0.00 N ATOM 1111 CA LEU A 69 11.890 -0.582 -5.492 1.00 0.00 C ATOM 1112 C LEU A 69 12.988 -0.989 -4.502 1.00 0.00 C ATOM 1113 O LEU A 69 13.053 -0.488 -3.397 1.00 0.00 O ATOM 1114 CB LEU A 69 10.806 -1.669 -5.509 1.00 0.00 C ATOM 1115 CG LEU A 69 9.916 -1.562 -4.258 1.00 0.00 C ATOM 1116 CD1 LEU A 69 8.777 -0.558 -4.494 1.00 0.00 C ATOM 1117 CD2 LEU A 69 9.315 -2.936 -3.939 1.00 0.00 C ATOM 0 H LEU A 69 11.937 -0.973 -7.586 1.00 0.00 H new ATOM 0 HA LEU A 69 11.473 0.377 -5.186 1.00 0.00 H new ATOM 0 HB2 LEU A 69 10.196 -1.568 -6.406 1.00 0.00 H new ATOM 0 HB3 LEU A 69 11.271 -2.654 -5.549 1.00 0.00 H new ATOM 0 HG LEU A 69 10.527 -1.218 -3.423 1.00 0.00 H new ATOM 0 HD11 LEU A 69 8.157 -0.494 -3.600 1.00 0.00 H new ATOM 0 HD12 LEU A 69 9.197 0.423 -4.715 1.00 0.00 H new ATOM 0 HD13 LEU A 69 8.168 -0.890 -5.335 1.00 0.00 H new ATOM 0 HD21 LEU A 69 8.685 -2.861 -3.053 1.00 0.00 H new ATOM 0 HD22 LEU A 69 8.715 -3.276 -4.783 1.00 0.00 H new ATOM 0 HD23 LEU A 69 10.117 -3.650 -3.754 1.00 0.00 H new ATOM 1129 N VAL A 70 13.845 -1.900 -4.883 1.00 0.00 N ATOM 1130 CA VAL A 70 14.925 -2.338 -3.950 1.00 0.00 C ATOM 1131 C VAL A 70 15.824 -1.148 -3.605 1.00 0.00 C ATOM 1132 O VAL A 70 16.189 -0.952 -2.463 1.00 0.00 O ATOM 1133 CB VAL A 70 15.752 -3.455 -4.605 1.00 0.00 C ATOM 1134 CG1 VAL A 70 16.955 -3.822 -3.709 1.00 0.00 C ATOM 1135 CG2 VAL A 70 14.855 -4.687 -4.816 1.00 0.00 C ATOM 0 H VAL A 70 13.844 -2.357 -5.795 1.00 0.00 H new ATOM 0 HA VAL A 70 14.478 -2.720 -3.032 1.00 0.00 H new ATOM 0 HB VAL A 70 16.131 -3.110 -5.567 1.00 0.00 H new ATOM 0 HG11 VAL A 70 17.534 -4.615 -4.183 1.00 0.00 H new ATOM 0 HG12 VAL A 70 17.587 -2.945 -3.571 1.00 0.00 H new ATOM 0 HG13 VAL A 70 16.595 -4.166 -2.740 1.00 0.00 H new ATOM 0 HG21 VAL A 70 15.435 -5.484 -5.281 1.00 0.00 H new ATOM 0 HG22 VAL A 70 14.474 -5.029 -3.854 1.00 0.00 H new ATOM 0 HG23 VAL A 70 14.019 -4.422 -5.463 1.00 0.00 H new ATOM 1145 N ASP A 71 16.178 -0.345 -4.570 1.00 0.00 N ATOM 1146 CA ASP A 71 17.045 0.831 -4.270 1.00 0.00 C ATOM 1147 C ASP A 71 16.379 1.671 -3.175 1.00 0.00 C ATOM 1148 O ASP A 71 17.027 2.189 -2.287 1.00 0.00 O ATOM 1149 CB ASP A 71 17.214 1.677 -5.535 1.00 0.00 C ATOM 1150 CG ASP A 71 18.093 0.926 -6.541 1.00 0.00 C ATOM 1151 OD1 ASP A 71 18.744 -0.023 -6.136 1.00 0.00 O ATOM 1152 OD2 ASP A 71 18.101 1.316 -7.696 1.00 0.00 O ATOM 0 H ASP A 71 15.907 -0.450 -5.548 1.00 0.00 H new ATOM 0 HA ASP A 71 18.025 0.493 -3.932 1.00 0.00 H new ATOM 0 HB2 ASP A 71 16.240 1.890 -5.975 1.00 0.00 H new ATOM 0 HB3 ASP A 71 17.667 2.636 -5.285 1.00 0.00 H new ATOM 1157 N VAL A 72 15.084 1.794 -3.237 1.00 0.00 N ATOM 1158 CA VAL A 72 14.338 2.581 -2.216 1.00 0.00 C ATOM 1159 C VAL A 72 14.483 1.916 -0.852 1.00 0.00 C ATOM 1160 O VAL A 72 14.673 2.574 0.138 1.00 0.00 O ATOM 1161 CB VAL A 72 12.862 2.618 -2.628 1.00 0.00 C ATOM 1162 CG1 VAL A 72 12.046 3.480 -1.662 1.00 0.00 C ATOM 1163 CG2 VAL A 72 12.753 3.185 -4.046 1.00 0.00 C ATOM 0 H VAL A 72 14.501 1.376 -3.963 1.00 0.00 H new ATOM 0 HA VAL A 72 14.733 3.595 -2.152 1.00 0.00 H new ATOM 0 HB VAL A 72 12.462 1.604 -2.599 1.00 0.00 H new ATOM 0 HG11 VAL A 72 11.002 3.490 -1.976 1.00 0.00 H new ATOM 0 HG12 VAL A 72 12.118 3.067 -0.656 1.00 0.00 H new ATOM 0 HG13 VAL A 72 12.436 4.498 -1.665 1.00 0.00 H new ATOM 0 HG21 VAL A 72 11.706 3.215 -4.347 1.00 0.00 H new ATOM 0 HG22 VAL A 72 13.165 4.194 -4.067 1.00 0.00 H new ATOM 0 HG23 VAL A 72 13.310 2.551 -4.735 1.00 0.00 H new ATOM 1173 N ILE A 73 14.384 0.624 -0.788 1.00 0.00 N ATOM 1174 CA ILE A 73 14.508 -0.061 0.529 1.00 0.00 C ATOM 1175 C ILE A 73 15.922 0.111 1.098 1.00 0.00 C ATOM 1176 O ILE A 73 16.105 0.635 2.178 1.00 0.00 O ATOM 1177 CB ILE A 73 14.194 -1.547 0.341 1.00 0.00 C ATOM 1178 CG1 ILE A 73 12.753 -1.679 -0.157 1.00 0.00 C ATOM 1179 CG2 ILE A 73 14.344 -2.285 1.673 1.00 0.00 C ATOM 1180 CD1 ILE A 73 12.460 -3.127 -0.546 1.00 0.00 C ATOM 0 H ILE A 73 14.223 0.010 -1.586 1.00 0.00 H new ATOM 0 HA ILE A 73 13.805 0.382 1.235 1.00 0.00 H new ATOM 0 HB ILE A 73 14.884 -1.982 -0.381 1.00 0.00 H new ATOM 0 HG12 ILE A 73 12.061 -1.356 0.621 1.00 0.00 H new ATOM 0 HG13 ILE A 73 12.596 -1.025 -1.015 1.00 0.00 H new ATOM 0 HG21 ILE A 73 14.119 -3.342 1.531 1.00 0.00 H new ATOM 0 HG22 ILE A 73 15.366 -2.177 2.035 1.00 0.00 H new ATOM 0 HG23 ILE A 73 13.654 -1.862 2.403 1.00 0.00 H new ATOM 0 HD11 ILE A 73 11.432 -3.208 -0.899 1.00 0.00 H new ATOM 0 HD12 ILE A 73 13.141 -3.436 -1.339 1.00 0.00 H new ATOM 0 HD13 ILE A 73 12.598 -3.772 0.322 1.00 0.00 H new ATOM 1192 N ASN A 74 16.921 -0.334 0.387 1.00 0.00 N ATOM 1193 CA ASN A 74 18.314 -0.208 0.887 1.00 0.00 C ATOM 1194 C ASN A 74 18.655 1.255 1.147 1.00 0.00 C ATOM 1195 O ASN A 74 19.302 1.587 2.120 1.00 0.00 O ATOM 1196 CB ASN A 74 19.280 -0.774 -0.157 1.00 0.00 C ATOM 1197 CG ASN A 74 18.988 -2.262 -0.372 1.00 0.00 C ATOM 1198 OD1 ASN A 74 18.560 -2.948 0.535 1.00 0.00 O ATOM 1199 ND2 ASN A 74 19.205 -2.795 -1.545 1.00 0.00 N ATOM 0 H ASN A 74 16.829 -0.782 -0.525 1.00 0.00 H new ATOM 0 HA ASN A 74 18.405 -0.764 1.820 1.00 0.00 H new ATOM 0 HB2 ASN A 74 19.174 -0.232 -1.097 1.00 0.00 H new ATOM 0 HB3 ASN A 74 20.310 -0.639 0.174 1.00 0.00 H new ATOM 0 HD21 ASN A 74 19.015 -3.785 -1.698 1.00 0.00 H new ATOM 0 HD22 ASN A 74 19.564 -2.221 -2.308 1.00 0.00 H new ATOM 1206 N LYS A 75 18.232 2.137 0.283 1.00 0.00 N ATOM 1207 CA LYS A 75 18.545 3.576 0.486 1.00 0.00 C ATOM 1208 C LYS A 75 17.415 4.278 1.245 1.00 0.00 C ATOM 1209 O LYS A 75 17.557 5.405 1.676 1.00 0.00 O ATOM 1210 CB LYS A 75 18.745 4.252 -0.870 1.00 0.00 C ATOM 1211 CG LYS A 75 19.743 3.441 -1.698 1.00 0.00 C ATOM 1212 CD LYS A 75 21.019 3.215 -0.886 1.00 0.00 C ATOM 1213 CE LYS A 75 22.166 2.839 -1.823 1.00 0.00 C ATOM 1214 NZ LYS A 75 23.223 2.127 -1.052 1.00 0.00 N ATOM 0 H LYS A 75 17.685 1.923 -0.551 1.00 0.00 H new ATOM 0 HA LYS A 75 19.458 3.651 1.076 1.00 0.00 H new ATOM 0 HB2 LYS A 75 17.793 4.325 -1.396 1.00 0.00 H new ATOM 0 HB3 LYS A 75 19.112 5.269 -0.731 1.00 0.00 H new ATOM 0 HG2 LYS A 75 19.304 2.484 -1.979 1.00 0.00 H new ATOM 0 HG3 LYS A 75 19.977 3.968 -2.623 1.00 0.00 H new ATOM 0 HD2 LYS A 75 21.272 4.117 -0.330 1.00 0.00 H new ATOM 0 HD3 LYS A 75 20.860 2.423 -0.154 1.00 0.00 H new ATOM 0 HE2 LYS A 75 21.798 2.204 -2.629 1.00 0.00 H new ATOM 0 HE3 LYS A 75 22.580 3.735 -2.287 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 24.004 1.871 -1.689 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 23.580 2.748 -0.298 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 22.823 1.265 -0.630 1.00 0.00 H new ATOM 1228 N LYS A 76 16.288 3.639 1.382 1.00 0.00 N ATOM 1229 CA LYS A 76 15.135 4.281 2.083 1.00 0.00 C ATOM 1230 C LYS A 76 14.733 5.568 1.363 1.00 0.00 C ATOM 1231 O LYS A 76 14.790 6.646 1.922 1.00 0.00 O ATOM 1232 CB LYS A 76 15.487 4.603 3.546 1.00 0.00 C ATOM 1233 CG LYS A 76 15.160 3.414 4.460 1.00 0.00 C ATOM 1234 CD LYS A 76 14.941 3.930 5.885 1.00 0.00 C ATOM 1235 CE LYS A 76 16.247 4.511 6.435 1.00 0.00 C ATOM 1236 NZ LYS A 76 16.316 4.271 7.904 1.00 0.00 N ATOM 0 H LYS A 76 16.112 2.695 1.038 1.00 0.00 H new ATOM 0 HA LYS A 76 14.302 3.578 2.071 1.00 0.00 H new ATOM 0 HB2 LYS A 76 16.546 4.847 3.625 1.00 0.00 H new ATOM 0 HB3 LYS A 76 14.932 5.482 3.873 1.00 0.00 H new ATOM 0 HG2 LYS A 76 14.268 2.899 4.104 1.00 0.00 H new ATOM 0 HG3 LYS A 76 15.974 2.690 4.442 1.00 0.00 H new ATOM 0 HD2 LYS A 76 14.163 4.693 5.889 1.00 0.00 H new ATOM 0 HD3 LYS A 76 14.595 3.119 6.526 1.00 0.00 H new ATOM 0 HE2 LYS A 76 17.101 4.049 5.939 1.00 0.00 H new ATOM 0 HE3 LYS A 76 16.298 5.580 6.227 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 17.202 4.665 8.279 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 15.508 4.732 8.369 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 16.286 3.248 8.090 1.00 0.00 H new ATOM 1250 N LEU A 77 14.306 5.468 0.137 1.00 0.00 N ATOM 1251 CA LEU A 77 13.879 6.692 -0.594 1.00 0.00 C ATOM 1252 C LEU A 77 12.356 6.828 -0.474 1.00 0.00 C ATOM 1253 O LEU A 77 11.732 7.599 -1.178 1.00 0.00 O ATOM 1254 CB LEU A 77 14.311 6.590 -2.063 1.00 0.00 C ATOM 1255 CG LEU A 77 15.849 6.599 -2.133 1.00 0.00 C ATOM 1256 CD1 LEU A 77 16.346 5.884 -3.398 1.00 0.00 C ATOM 1257 CD2 LEU A 77 16.348 8.049 -2.145 1.00 0.00 C ATOM 0 H LEU A 77 14.234 4.597 -0.389 1.00 0.00 H new ATOM 0 HA LEU A 77 14.349 7.577 -0.165 1.00 0.00 H new ATOM 0 HB2 LEU A 77 13.919 5.676 -2.508 1.00 0.00 H new ATOM 0 HB3 LEU A 77 13.903 7.424 -2.635 1.00 0.00 H new ATOM 0 HG LEU A 77 16.237 6.073 -1.261 1.00 0.00 H new ATOM 0 HD11 LEU A 77 17.436 5.904 -3.423 1.00 0.00 H new ATOM 0 HD12 LEU A 77 16.003 4.850 -3.390 1.00 0.00 H new ATOM 0 HD13 LEU A 77 15.953 6.390 -4.280 1.00 0.00 H new ATOM 0 HD21 LEU A 77 17.437 8.059 -2.195 1.00 0.00 H new ATOM 0 HD22 LEU A 77 15.941 8.567 -3.013 1.00 0.00 H new ATOM 0 HD23 LEU A 77 16.022 8.554 -1.236 1.00 0.00 H new ATOM 1269 N TRP A 78 11.753 6.089 0.431 1.00 0.00 N ATOM 1270 CA TRP A 78 10.273 6.181 0.614 1.00 0.00 C ATOM 1271 C TRP A 78 9.908 7.587 1.081 1.00 0.00 C ATOM 1272 O TRP A 78 8.921 8.147 0.654 1.00 0.00 O ATOM 1273 CB TRP A 78 9.807 5.173 1.666 1.00 0.00 C ATOM 1274 CG TRP A 78 10.210 3.801 1.244 1.00 0.00 C ATOM 1275 CD1 TRP A 78 11.331 3.173 1.654 1.00 0.00 C ATOM 1276 CD2 TRP A 78 9.527 2.880 0.346 1.00 0.00 C ATOM 1277 NE1 TRP A 78 11.388 1.926 1.067 1.00 0.00 N ATOM 1278 CE2 TRP A 78 10.301 1.697 0.251 1.00 0.00 C ATOM 1279 CE3 TRP A 78 8.329 2.950 -0.391 1.00 0.00 C ATOM 1280 CZ2 TRP A 78 9.901 0.626 -0.542 1.00 0.00 C ATOM 1281 CZ3 TRP A 78 7.931 1.867 -1.190 1.00 0.00 C ATOM 1282 CH2 TRP A 78 8.715 0.712 -1.264 1.00 0.00 C ATOM 0 H TRP A 78 12.225 5.428 1.048 1.00 0.00 H new ATOM 0 HA TRP A 78 9.786 5.962 -0.336 1.00 0.00 H new ATOM 0 HB2 TRP A 78 10.246 5.412 2.635 1.00 0.00 H new ATOM 0 HB3 TRP A 78 8.725 5.227 1.784 1.00 0.00 H new ATOM 0 HD1 TRP A 78 12.066 3.581 2.333 1.00 0.00 H new ATOM 0 HE1 TRP A 78 12.142 1.256 1.218 1.00 0.00 H new ATOM 0 HE3 TRP A 78 7.716 3.838 -0.341 1.00 0.00 H new ATOM 0 HZ2 TRP A 78 10.507 -0.266 -0.597 1.00 0.00 H new ATOM 0 HZ3 TRP A 78 7.011 1.926 -1.753 1.00 0.00 H new ATOM 0 HH2 TRP A 78 8.399 -0.115 -1.883 1.00 0.00 H new ATOM 1293 N GLN A 79 10.692 8.182 1.945 1.00 0.00 N ATOM 1294 CA GLN A 79 10.345 9.557 2.399 1.00 0.00 C ATOM 1295 C GLN A 79 10.058 10.408 1.169 1.00 0.00 C ATOM 1296 O GLN A 79 9.153 11.220 1.158 1.00 0.00 O ATOM 1297 CB GLN A 79 11.517 10.151 3.186 1.00 0.00 C ATOM 1298 CG GLN A 79 11.703 9.365 4.483 1.00 0.00 C ATOM 1299 CD GLN A 79 10.476 9.568 5.376 1.00 0.00 C ATOM 1300 OE1 GLN A 79 10.267 10.642 5.904 1.00 0.00 O ATOM 1301 NE2 GLN A 79 9.646 8.578 5.560 1.00 0.00 N ATOM 0 H GLN A 79 11.540 7.783 2.347 1.00 0.00 H new ATOM 0 HA GLN A 79 9.469 9.532 3.047 1.00 0.00 H new ATOM 0 HB2 GLN A 79 12.428 10.111 2.589 1.00 0.00 H new ATOM 0 HB3 GLN A 79 11.326 11.201 3.408 1.00 0.00 H new ATOM 0 HG2 GLN A 79 11.837 8.306 4.264 1.00 0.00 H new ATOM 0 HG3 GLN A 79 12.603 9.700 4.999 1.00 0.00 H new ATOM 0 HE21 GLN A 79 9.821 7.676 5.117 1.00 0.00 H new ATOM 0 HE22 GLN A 79 8.822 8.706 6.147 1.00 0.00 H new ATOM 1310 N GLU A 80 10.804 10.211 0.120 1.00 0.00 N ATOM 1311 CA GLU A 80 10.553 10.988 -1.122 1.00 0.00 C ATOM 1312 C GLU A 80 9.239 10.502 -1.745 1.00 0.00 C ATOM 1313 O GLU A 80 8.419 11.284 -2.181 1.00 0.00 O ATOM 1314 CB GLU A 80 11.714 10.774 -2.096 1.00 0.00 C ATOM 1315 CG GLU A 80 12.983 11.408 -1.522 1.00 0.00 C ATOM 1316 CD GLU A 80 12.785 12.918 -1.366 1.00 0.00 C ATOM 1317 OE1 GLU A 80 11.886 13.447 -2.000 1.00 0.00 O ATOM 1318 OE2 GLU A 80 13.537 13.520 -0.617 1.00 0.00 O ATOM 0 H GLU A 80 11.576 9.546 0.069 1.00 0.00 H new ATOM 0 HA GLU A 80 10.476 12.052 -0.897 1.00 0.00 H new ATOM 0 HB2 GLU A 80 11.871 9.708 -2.264 1.00 0.00 H new ATOM 0 HB3 GLU A 80 11.478 11.218 -3.063 1.00 0.00 H new ATOM 0 HG2 GLU A 80 13.218 10.961 -0.556 1.00 0.00 H new ATOM 0 HG3 GLU A 80 13.829 11.209 -2.180 1.00 0.00 H new ATOM 1325 N ILE A 81 9.026 9.211 -1.759 1.00 0.00 N ATOM 1326 CA ILE A 81 7.755 8.661 -2.322 1.00 0.00 C ATOM 1327 C ILE A 81 6.599 9.083 -1.411 1.00 0.00 C ATOM 1328 O ILE A 81 5.626 9.662 -1.845 1.00 0.00 O ATOM 1329 CB ILE A 81 7.828 7.130 -2.341 1.00 0.00 C ATOM 1330 CG1 ILE A 81 9.085 6.694 -3.104 1.00 0.00 C ATOM 1331 CG2 ILE A 81 6.578 6.561 -3.022 1.00 0.00 C ATOM 1332 CD1 ILE A 81 8.927 5.256 -3.605 1.00 0.00 C ATOM 0 H ILE A 81 9.679 8.512 -1.404 1.00 0.00 H new ATOM 0 HA ILE A 81 7.604 9.036 -3.334 1.00 0.00 H new ATOM 0 HB ILE A 81 7.876 6.753 -1.320 1.00 0.00 H new ATOM 0 HG12 ILE A 81 9.258 7.363 -3.947 1.00 0.00 H new ATOM 0 HG13 ILE A 81 9.957 6.767 -2.454 1.00 0.00 H new ATOM 0 HG21 ILE A 81 6.634 5.472 -3.034 1.00 0.00 H new ATOM 0 HG22 ILE A 81 5.690 6.873 -2.472 1.00 0.00 H new ATOM 0 HG23 ILE A 81 6.520 6.932 -4.045 1.00 0.00 H new ATOM 0 HD11 ILE A 81 9.826 4.958 -4.145 1.00 0.00 H new ATOM 0 HD12 ILE A 81 8.776 4.589 -2.756 1.00 0.00 H new ATOM 0 HD13 ILE A 81 8.066 5.195 -4.271 1.00 0.00 H new ATOM 1344 N ILE A 82 6.704 8.775 -0.145 1.00 0.00 N ATOM 1345 CA ILE A 82 5.623 9.122 0.819 1.00 0.00 C ATOM 1346 C ILE A 82 5.299 10.615 0.726 1.00 0.00 C ATOM 1347 O ILE A 82 4.161 11.001 0.537 1.00 0.00 O ATOM 1348 CB ILE A 82 6.103 8.790 2.237 1.00 0.00 C ATOM 1349 CG1 ILE A 82 6.510 7.322 2.311 1.00 0.00 C ATOM 1350 CG2 ILE A 82 4.974 9.016 3.238 1.00 0.00 C ATOM 1351 CD1 ILE A 82 7.321 7.087 3.586 1.00 0.00 C ATOM 0 H ILE A 82 7.503 8.292 0.265 1.00 0.00 H new ATOM 0 HA ILE A 82 4.725 8.551 0.584 1.00 0.00 H new ATOM 0 HB ILE A 82 6.950 9.434 2.474 1.00 0.00 H new ATOM 0 HG12 ILE A 82 5.624 6.686 2.307 1.00 0.00 H new ATOM 0 HG13 ILE A 82 7.100 7.052 1.436 1.00 0.00 H new ATOM 0 HG21 ILE A 82 5.325 8.777 4.242 1.00 0.00 H new ATOM 0 HG22 ILE A 82 4.659 10.059 3.202 1.00 0.00 H new ATOM 0 HG23 ILE A 82 4.130 8.373 2.986 1.00 0.00 H new ATOM 0 HD11 ILE A 82 7.614 6.039 3.643 1.00 0.00 H new ATOM 0 HD12 ILE A 82 8.213 7.713 3.570 1.00 0.00 H new ATOM 0 HD13 ILE A 82 6.715 7.342 4.455 1.00 0.00 H new ATOM 1363 N LYS A 83 6.283 11.461 0.853 1.00 0.00 N ATOM 1364 CA LYS A 83 6.021 12.925 0.764 1.00 0.00 C ATOM 1365 C LYS A 83 5.560 13.280 -0.653 1.00 0.00 C ATOM 1366 O LYS A 83 4.661 14.074 -0.844 1.00 0.00 O ATOM 1367 CB LYS A 83 7.307 13.688 1.084 1.00 0.00 C ATOM 1368 CG LYS A 83 7.733 13.406 2.526 1.00 0.00 C ATOM 1369 CD LYS A 83 9.104 14.036 2.786 1.00 0.00 C ATOM 1370 CE LYS A 83 9.004 15.560 2.667 1.00 0.00 C ATOM 1371 NZ LYS A 83 10.071 16.195 3.492 1.00 0.00 N ATOM 0 H LYS A 83 7.256 11.203 1.014 1.00 0.00 H new ATOM 0 HA LYS A 83 5.243 13.199 1.477 1.00 0.00 H new ATOM 0 HB2 LYS A 83 8.098 13.389 0.397 1.00 0.00 H new ATOM 0 HB3 LYS A 83 7.150 14.758 0.944 1.00 0.00 H new ATOM 0 HG2 LYS A 83 6.997 13.812 3.220 1.00 0.00 H new ATOM 0 HG3 LYS A 83 7.776 12.331 2.700 1.00 0.00 H new ATOM 0 HD2 LYS A 83 9.458 13.762 3.780 1.00 0.00 H new ATOM 0 HD3 LYS A 83 9.832 13.653 2.071 1.00 0.00 H new ATOM 0 HE2 LYS A 83 9.108 15.861 1.625 1.00 0.00 H new ATOM 0 HE3 LYS A 83 8.023 15.898 3.000 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 10.003 17.230 3.411 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 9.952 15.917 4.487 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 11.003 15.882 3.154 1.00 0.00 H new ATOM 1385 N GLY A 84 6.177 12.699 -1.647 1.00 0.00 N ATOM 1386 CA GLY A 84 5.780 13.007 -3.052 1.00 0.00 C ATOM 1387 C GLY A 84 4.277 12.789 -3.214 1.00 0.00 C ATOM 1388 O GLY A 84 3.615 13.472 -3.969 1.00 0.00 O ATOM 0 H GLY A 84 6.937 12.026 -1.548 1.00 0.00 H new ATOM 0 HA2 GLY A 84 6.038 14.037 -3.297 1.00 0.00 H new ATOM 0 HA3 GLY A 84 6.328 12.368 -3.745 1.00 0.00 H new ATOM 1392 N LEU A 85 3.733 11.845 -2.500 1.00 0.00 N ATOM 1393 CA LEU A 85 2.274 11.580 -2.596 1.00 0.00 C ATOM 1394 C LEU A 85 1.541 12.457 -1.580 1.00 0.00 C ATOM 1395 O LEU A 85 0.330 12.538 -1.571 1.00 0.00 O ATOM 1396 CB LEU A 85 2.020 10.109 -2.288 1.00 0.00 C ATOM 1397 CG LEU A 85 2.840 9.242 -3.249 1.00 0.00 C ATOM 1398 CD1 LEU A 85 2.814 7.784 -2.787 1.00 0.00 C ATOM 1399 CD2 LEU A 85 2.249 9.335 -4.660 1.00 0.00 C ATOM 0 H LEU A 85 4.240 11.243 -1.851 1.00 0.00 H new ATOM 0 HA LEU A 85 1.912 11.810 -3.598 1.00 0.00 H new ATOM 0 HB2 LEU A 85 2.295 9.889 -1.257 1.00 0.00 H new ATOM 0 HB3 LEU A 85 0.959 9.882 -2.390 1.00 0.00 H new ATOM 0 HG LEU A 85 3.869 9.600 -3.258 1.00 0.00 H new ATOM 0 HD11 LEU A 85 3.399 7.174 -3.475 1.00 0.00 H new ATOM 0 HD12 LEU A 85 3.240 7.712 -1.786 1.00 0.00 H new ATOM 0 HD13 LEU A 85 1.785 7.426 -2.770 1.00 0.00 H new ATOM 0 HD21 LEU A 85 2.834 8.717 -5.341 1.00 0.00 H new ATOM 0 HD22 LEU A 85 1.218 8.983 -4.646 1.00 0.00 H new ATOM 0 HD23 LEU A 85 2.274 10.371 -4.997 1.00 0.00 H new ATOM 1411 N HIS A 86 2.278 13.116 -0.728 1.00 0.00 N ATOM 1412 CA HIS A 86 1.652 14.005 0.296 1.00 0.00 C ATOM 1413 C HIS A 86 0.824 13.170 1.276 1.00 0.00 C ATOM 1414 O HIS A 86 -0.248 13.564 1.689 1.00 0.00 O ATOM 1415 CB HIS A 86 0.752 15.031 -0.393 1.00 0.00 C ATOM 1416 CG HIS A 86 1.441 15.563 -1.620 1.00 0.00 C ATOM 1417 ND1 HIS A 86 2.331 16.624 -1.566 1.00 0.00 N ATOM 1418 CD2 HIS A 86 1.385 15.188 -2.941 1.00 0.00 C ATOM 1419 CE1 HIS A 86 2.771 16.850 -2.818 1.00 0.00 C ATOM 1420 NE2 HIS A 86 2.225 16.002 -3.695 1.00 0.00 N ATOM 0 H HIS A 86 3.297 13.077 -0.696 1.00 0.00 H new ATOM 0 HA HIS A 86 2.438 14.524 0.845 1.00 0.00 H new ATOM 0 HB2 HIS A 86 -0.197 14.571 -0.667 1.00 0.00 H new ATOM 0 HB3 HIS A 86 0.524 15.848 0.292 1.00 0.00 H new ATOM 0 HD2 HIS A 86 0.781 14.384 -3.334 1.00 0.00 H new ATOM 0 HE1 HIS A 86 3.479 17.622 -3.082 1.00 0.00 H new ATOM 0 HE2 HIS A 86 2.389 15.960 -4.701 1.00 0.00 H new ATOM 1428 N LEU A 87 1.325 12.032 1.668 1.00 0.00 N ATOM 1429 CA LEU A 87 0.580 11.188 2.645 1.00 0.00 C ATOM 1430 C LEU A 87 0.667 11.827 4.043 1.00 0.00 C ATOM 1431 O LEU A 87 1.749 11.975 4.577 1.00 0.00 O ATOM 1432 CB LEU A 87 1.196 9.788 2.682 1.00 0.00 C ATOM 1433 CG LEU A 87 0.703 8.985 1.475 1.00 0.00 C ATOM 1434 CD1 LEU A 87 1.732 7.912 1.117 1.00 0.00 C ATOM 1435 CD2 LEU A 87 -0.630 8.315 1.813 1.00 0.00 C ATOM 0 H LEU A 87 2.217 11.650 1.355 1.00 0.00 H new ATOM 0 HA LEU A 87 -0.465 11.116 2.343 1.00 0.00 H new ATOM 0 HB2 LEU A 87 2.284 9.857 2.668 1.00 0.00 H new ATOM 0 HB3 LEU A 87 0.921 9.282 3.607 1.00 0.00 H new ATOM 0 HG LEU A 87 0.568 9.657 0.628 1.00 0.00 H new ATOM 0 HD11 LEU A 87 1.379 7.342 0.258 1.00 0.00 H new ATOM 0 HD12 LEU A 87 2.682 8.386 0.872 1.00 0.00 H new ATOM 0 HD13 LEU A 87 1.869 7.242 1.966 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -0.979 7.744 0.952 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -0.496 7.645 2.662 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -1.367 9.078 2.065 1.00 0.00 H new ATOM 1447 N PRO A 88 -0.441 12.196 4.648 1.00 0.00 N ATOM 1448 CA PRO A 88 -0.425 12.813 6.008 1.00 0.00 C ATOM 1449 C PRO A 88 0.439 12.018 6.996 1.00 0.00 C ATOM 1450 O PRO A 88 0.471 10.804 6.972 1.00 0.00 O ATOM 1451 CB PRO A 88 -1.893 12.788 6.441 1.00 0.00 C ATOM 1452 CG PRO A 88 -2.683 12.769 5.176 1.00 0.00 C ATOM 1453 CD PRO A 88 -1.814 12.084 4.118 1.00 0.00 C ATOM 0 HA PRO A 88 0.005 13.815 5.991 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -2.107 11.910 7.050 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -2.139 13.662 7.044 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -3.620 12.229 5.314 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -2.941 13.782 4.867 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -2.103 11.042 3.979 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -1.908 12.573 3.148 1.00 0.00 H new ATOM 1461 N SER A 89 1.148 12.699 7.858 1.00 0.00 N ATOM 1462 CA SER A 89 2.024 11.997 8.843 1.00 0.00 C ATOM 1463 C SER A 89 1.184 11.066 9.722 1.00 0.00 C ATOM 1464 O SER A 89 1.697 10.397 10.598 1.00 0.00 O ATOM 1465 CB SER A 89 2.727 13.032 9.721 1.00 0.00 C ATOM 1466 OG SER A 89 1.806 13.542 10.677 1.00 0.00 O ATOM 0 H SER A 89 1.158 13.717 7.922 1.00 0.00 H new ATOM 0 HA SER A 89 2.765 11.405 8.306 1.00 0.00 H new ATOM 0 HB2 SER A 89 3.579 12.578 10.227 1.00 0.00 H new ATOM 0 HB3 SER A 89 3.116 13.843 9.106 1.00 0.00 H new ATOM 0 HG SER A 89 2.255 14.205 11.242 1.00 0.00 H new ATOM 1472 N SER A 90 -0.102 11.044 9.522 1.00 0.00 N ATOM 1473 CA SER A 90 -0.969 10.185 10.377 1.00 0.00 C ATOM 1474 C SER A 90 -0.664 8.704 10.120 1.00 0.00 C ATOM 1475 O SER A 90 -0.908 7.864 10.964 1.00 0.00 O ATOM 1476 CB SER A 90 -2.436 10.469 10.057 1.00 0.00 C ATOM 1477 OG SER A 90 -2.735 9.994 8.750 1.00 0.00 O ATOM 0 H SER A 90 -0.591 11.581 8.806 1.00 0.00 H new ATOM 0 HA SER A 90 -0.771 10.409 11.425 1.00 0.00 H new ATOM 0 HB2 SER A 90 -3.080 9.982 10.789 1.00 0.00 H new ATOM 0 HB3 SER A 90 -2.633 11.539 10.121 1.00 0.00 H new ATOM 0 HG SER A 90 -3.676 10.174 8.544 1.00 0.00 H new ATOM 1483 N ILE A 91 -0.116 8.369 8.980 1.00 0.00 N ATOM 1484 CA ILE A 91 0.213 6.935 8.714 1.00 0.00 C ATOM 1485 C ILE A 91 1.694 6.687 9.015 1.00 0.00 C ATOM 1486 O ILE A 91 2.566 7.097 8.275 1.00 0.00 O ATOM 1487 CB ILE A 91 -0.069 6.595 7.247 1.00 0.00 C ATOM 1488 CG1 ILE A 91 -1.562 6.795 6.962 1.00 0.00 C ATOM 1489 CG2 ILE A 91 0.319 5.137 6.971 1.00 0.00 C ATOM 1490 CD1 ILE A 91 -1.870 6.494 5.490 1.00 0.00 C ATOM 0 H ILE A 91 0.116 9.018 8.228 1.00 0.00 H new ATOM 0 HA ILE A 91 -0.404 6.304 9.353 1.00 0.00 H new ATOM 0 HB ILE A 91 0.517 7.248 6.601 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -2.152 6.142 7.605 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -1.850 7.819 7.198 1.00 0.00 H new ATOM 0 HG21 ILE A 91 0.117 4.898 5.927 1.00 0.00 H new ATOM 0 HG22 ILE A 91 1.380 4.998 7.177 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -0.264 4.477 7.613 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -2.934 6.641 5.304 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -1.294 7.165 4.853 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -1.601 5.462 5.266 1.00 0.00 H new ATOM 1502 N THR A 92 1.985 6.003 10.089 1.00 0.00 N ATOM 1503 CA THR A 92 3.410 5.714 10.423 1.00 0.00 C ATOM 1504 C THR A 92 3.885 4.559 9.545 1.00 0.00 C ATOM 1505 O THR A 92 5.051 4.436 9.224 1.00 0.00 O ATOM 1506 CB THR A 92 3.521 5.311 11.896 1.00 0.00 C ATOM 1507 OG1 THR A 92 2.875 4.061 12.092 1.00 0.00 O ATOM 1508 CG2 THR A 92 2.852 6.373 12.770 1.00 0.00 C ATOM 0 H THR A 92 1.300 5.633 10.748 1.00 0.00 H new ATOM 0 HA THR A 92 4.022 6.599 10.248 1.00 0.00 H new ATOM 0 HB THR A 92 4.572 5.226 12.171 1.00 0.00 H new ATOM 0 HG1 THR A 92 2.946 3.800 13.034 1.00 0.00 H new ATOM 0 HG21 THR A 92 2.932 6.085 13.818 1.00 0.00 H new ATOM 0 HG22 THR A 92 3.346 7.333 12.619 1.00 0.00 H new ATOM 0 HG23 THR A 92 1.800 6.460 12.497 1.00 0.00 H new ATOM 1516 N SER A 93 2.975 3.712 9.155 1.00 0.00 N ATOM 1517 CA SER A 93 3.334 2.554 8.295 1.00 0.00 C ATOM 1518 C SER A 93 3.249 2.967 6.830 1.00 0.00 C ATOM 1519 O SER A 93 2.971 2.161 5.966 1.00 0.00 O ATOM 1520 CB SER A 93 2.357 1.407 8.557 1.00 0.00 C ATOM 1521 OG SER A 93 2.546 0.919 9.878 1.00 0.00 O ATOM 0 H SER A 93 1.987 3.775 9.399 1.00 0.00 H new ATOM 0 HA SER A 93 4.349 2.229 8.524 1.00 0.00 H new ATOM 0 HB2 SER A 93 1.331 1.752 8.428 1.00 0.00 H new ATOM 0 HB3 SER A 93 2.517 0.606 7.835 1.00 0.00 H new ATOM 0 HG SER A 93 1.919 0.185 10.048 1.00 0.00 H new ATOM 1527 N ALA A 94 3.485 4.215 6.535 1.00 0.00 N ATOM 1528 CA ALA A 94 3.411 4.651 5.116 1.00 0.00 C ATOM 1529 C ALA A 94 4.413 3.826 4.311 1.00 0.00 C ATOM 1530 O ALA A 94 4.048 3.024 3.476 1.00 0.00 O ATOM 1531 CB ALA A 94 3.774 6.134 5.023 1.00 0.00 C ATOM 0 H ALA A 94 3.723 4.944 7.208 1.00 0.00 H new ATOM 0 HA ALA A 94 2.404 4.506 4.724 1.00 0.00 H new ATOM 0 HB1 ALA A 94 3.721 6.457 3.983 1.00 0.00 H new ATOM 0 HB2 ALA A 94 3.074 6.718 5.621 1.00 0.00 H new ATOM 0 HB3 ALA A 94 4.786 6.285 5.398 1.00 0.00 H new ATOM 1537 N ALA A 95 5.678 4.014 4.567 1.00 0.00 N ATOM 1538 CA ALA A 95 6.716 3.236 3.823 1.00 0.00 C ATOM 1539 C ALA A 95 6.374 1.737 3.881 1.00 0.00 C ATOM 1540 O ALA A 95 6.293 1.077 2.863 1.00 0.00 O ATOM 1541 CB ALA A 95 8.090 3.489 4.464 1.00 0.00 C ATOM 0 H ALA A 95 6.040 4.671 5.258 1.00 0.00 H new ATOM 0 HA ALA A 95 6.741 3.553 2.780 1.00 0.00 H new ATOM 0 HB1 ALA A 95 8.852 2.925 3.926 1.00 0.00 H new ATOM 0 HB2 ALA A 95 8.324 4.552 4.415 1.00 0.00 H new ATOM 0 HB3 ALA A 95 8.070 3.170 5.506 1.00 0.00 H new ATOM 1547 N LEU A 96 6.173 1.191 5.053 1.00 0.00 N ATOM 1548 CA LEU A 96 5.841 -0.263 5.146 1.00 0.00 C ATOM 1549 C LEU A 96 4.587 -0.541 4.323 1.00 0.00 C ATOM 1550 O LEU A 96 4.532 -1.492 3.567 1.00 0.00 O ATOM 1551 CB LEU A 96 5.580 -0.625 6.614 1.00 0.00 C ATOM 1552 CG LEU A 96 5.123 -2.090 6.751 1.00 0.00 C ATOM 1553 CD1 LEU A 96 6.324 -3.045 6.699 1.00 0.00 C ATOM 1554 CD2 LEU A 96 4.413 -2.246 8.089 1.00 0.00 C ATOM 0 H LEU A 96 6.224 1.685 5.944 1.00 0.00 H new ATOM 0 HA LEU A 96 6.669 -0.860 4.764 1.00 0.00 H new ATOM 0 HB2 LEU A 96 6.487 -0.468 7.197 1.00 0.00 H new ATOM 0 HB3 LEU A 96 4.818 0.037 7.025 1.00 0.00 H new ATOM 0 HG LEU A 96 4.455 -2.337 5.926 1.00 0.00 H new ATOM 0 HD11 LEU A 96 5.976 -4.073 6.798 1.00 0.00 H new ATOM 0 HD12 LEU A 96 6.842 -2.927 5.747 1.00 0.00 H new ATOM 0 HD13 LEU A 96 7.008 -2.814 7.515 1.00 0.00 H new ATOM 0 HD21 LEU A 96 4.081 -3.277 8.206 1.00 0.00 H new ATOM 0 HD22 LEU A 96 5.099 -1.992 8.897 1.00 0.00 H new ATOM 0 HD23 LEU A 96 3.550 -1.581 8.123 1.00 0.00 H new ATOM 1566 N THR A 97 3.583 0.277 4.450 1.00 0.00 N ATOM 1567 CA THR A 97 2.349 0.049 3.659 1.00 0.00 C ATOM 1568 C THR A 97 2.700 0.102 2.179 1.00 0.00 C ATOM 1569 O THR A 97 2.210 -0.672 1.380 1.00 0.00 O ATOM 1570 CB THR A 97 1.332 1.143 3.993 1.00 0.00 C ATOM 1571 OG1 THR A 97 0.920 1.011 5.346 1.00 0.00 O ATOM 1572 CG2 THR A 97 0.121 1.027 3.070 1.00 0.00 C ATOM 0 H THR A 97 3.565 1.090 5.065 1.00 0.00 H new ATOM 0 HA THR A 97 1.920 -0.924 3.897 1.00 0.00 H new ATOM 0 HB THR A 97 1.795 2.119 3.850 1.00 0.00 H new ATOM 0 HG1 THR A 97 1.454 1.608 5.910 1.00 0.00 H new ATOM 0 HG21 THR A 97 -0.598 1.809 3.314 1.00 0.00 H new ATOM 0 HG22 THR A 97 0.441 1.139 2.034 1.00 0.00 H new ATOM 0 HG23 THR A 97 -0.345 0.051 3.203 1.00 0.00 H new ATOM 1580 N LEU A 98 3.550 1.017 1.807 1.00 0.00 N ATOM 1581 CA LEU A 98 3.942 1.136 0.389 1.00 0.00 C ATOM 1582 C LEU A 98 4.821 -0.049 -0.012 1.00 0.00 C ATOM 1583 O LEU A 98 4.620 -0.653 -1.042 1.00 0.00 O ATOM 1584 CB LEU A 98 4.736 2.433 0.220 1.00 0.00 C ATOM 1585 CG LEU A 98 3.819 3.643 0.428 1.00 0.00 C ATOM 1586 CD1 LEU A 98 4.626 4.814 0.979 1.00 0.00 C ATOM 1587 CD2 LEU A 98 3.227 4.060 -0.911 1.00 0.00 C ATOM 0 H LEU A 98 3.990 1.690 2.435 1.00 0.00 H new ATOM 0 HA LEU A 98 3.053 1.145 -0.242 1.00 0.00 H new ATOM 0 HB2 LEU A 98 5.557 2.462 0.936 1.00 0.00 H new ATOM 0 HB3 LEU A 98 5.180 2.470 -0.775 1.00 0.00 H new ATOM 0 HG LEU A 98 3.028 3.373 1.128 1.00 0.00 H new ATOM 0 HD11 LEU A 98 3.969 5.672 1.125 1.00 0.00 H new ATOM 0 HD12 LEU A 98 5.072 4.532 1.933 1.00 0.00 H new ATOM 0 HD13 LEU A 98 5.414 5.077 0.274 1.00 0.00 H new ATOM 0 HD21 LEU A 98 2.574 4.921 -0.768 1.00 0.00 H new ATOM 0 HD22 LEU A 98 4.031 4.325 -1.598 1.00 0.00 H new ATOM 0 HD23 LEU A 98 2.652 3.233 -1.328 1.00 0.00 H new ATOM 1599 N ARG A 99 5.805 -0.379 0.780 1.00 0.00 N ATOM 1600 CA ARG A 99 6.706 -1.510 0.418 1.00 0.00 C ATOM 1601 C ARG A 99 5.939 -2.832 0.351 1.00 0.00 C ATOM 1602 O ARG A 99 6.026 -3.561 -0.617 1.00 0.00 O ATOM 1603 CB ARG A 99 7.812 -1.617 1.471 1.00 0.00 C ATOM 1604 CG ARG A 99 8.847 -2.650 1.027 1.00 0.00 C ATOM 1605 CD ARG A 99 9.879 -2.849 2.139 1.00 0.00 C ATOM 1606 NE ARG A 99 10.576 -1.556 2.402 1.00 0.00 N ATOM 1607 CZ ARG A 99 11.305 -1.407 3.476 1.00 0.00 C ATOM 1608 NH1 ARG A 99 11.424 -2.391 4.326 1.00 0.00 N ATOM 1609 NH2 ARG A 99 11.919 -0.274 3.699 1.00 0.00 N ATOM 0 H ARG A 99 6.024 0.085 1.661 1.00 0.00 H new ATOM 0 HA ARG A 99 7.131 -1.315 -0.566 1.00 0.00 H new ATOM 0 HB2 ARG A 99 8.289 -0.647 1.611 1.00 0.00 H new ATOM 0 HB3 ARG A 99 7.386 -1.905 2.432 1.00 0.00 H new ATOM 0 HG2 ARG A 99 8.357 -3.596 0.798 1.00 0.00 H new ATOM 0 HG3 ARG A 99 9.340 -2.317 0.114 1.00 0.00 H new ATOM 0 HD2 ARG A 99 9.389 -3.202 3.046 1.00 0.00 H new ATOM 0 HD3 ARG A 99 10.601 -3.612 1.848 1.00 0.00 H new ATOM 0 HE ARG A 99 10.483 -0.785 1.740 1.00 0.00 H new ATOM 0 HH11 ARG A 99 10.948 -3.276 4.152 1.00 0.00 H new ATOM 0 HH12 ARG A 99 11.993 -2.275 5.164 1.00 0.00 H new ATOM 0 HH21 ARG A 99 11.829 0.494 3.034 1.00 0.00 H new ATOM 0 HH22 ARG A 99 12.488 -0.159 4.538 1.00 0.00 H new ATOM 1623 N THR A 100 5.208 -3.160 1.373 1.00 0.00 N ATOM 1624 CA THR A 100 4.462 -4.448 1.374 1.00 0.00 C ATOM 1625 C THR A 100 3.531 -4.532 0.156 1.00 0.00 C ATOM 1626 O THR A 100 3.576 -5.477 -0.614 1.00 0.00 O ATOM 1627 CB THR A 100 3.633 -4.519 2.661 1.00 0.00 C ATOM 1628 OG1 THR A 100 4.467 -4.199 3.766 1.00 0.00 O ATOM 1629 CG2 THR A 100 3.061 -5.925 2.856 1.00 0.00 C ATOM 0 H THR A 100 5.093 -2.591 2.212 1.00 0.00 H new ATOM 0 HA THR A 100 5.165 -5.280 1.324 1.00 0.00 H new ATOM 0 HB THR A 100 2.808 -3.811 2.590 1.00 0.00 H new ATOM 0 HG1 THR A 100 4.467 -3.229 3.906 1.00 0.00 H new ATOM 0 HG21 THR A 100 2.476 -5.955 3.775 1.00 0.00 H new ATOM 0 HG22 THR A 100 2.422 -6.178 2.010 1.00 0.00 H new ATOM 0 HG23 THR A 100 3.878 -6.644 2.922 1.00 0.00 H new ATOM 1637 N GLN A 101 2.681 -3.560 -0.013 1.00 0.00 N ATOM 1638 CA GLN A 101 1.733 -3.586 -1.161 1.00 0.00 C ATOM 1639 C GLN A 101 2.480 -3.554 -2.500 1.00 0.00 C ATOM 1640 O GLN A 101 2.125 -4.250 -3.428 1.00 0.00 O ATOM 1641 CB GLN A 101 0.804 -2.377 -1.063 1.00 0.00 C ATOM 1642 CG GLN A 101 -0.028 -2.485 0.217 1.00 0.00 C ATOM 1643 CD GLN A 101 -0.916 -1.250 0.370 1.00 0.00 C ATOM 1644 OE1 GLN A 101 -0.793 -0.300 -0.376 1.00 0.00 O ATOM 1645 NE2 GLN A 101 -1.812 -1.225 1.319 1.00 0.00 N ATOM 0 H GLN A 101 2.601 -2.746 0.596 1.00 0.00 H new ATOM 0 HA GLN A 101 1.158 -4.511 -1.119 1.00 0.00 H new ATOM 0 HB2 GLN A 101 1.386 -1.455 -1.056 1.00 0.00 H new ATOM 0 HB3 GLN A 101 0.150 -2.334 -1.934 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -0.644 -3.384 0.185 1.00 0.00 H new ATOM 0 HG3 GLN A 101 0.630 -2.579 1.081 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -1.914 -2.024 1.945 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -2.410 -0.407 1.434 1.00 0.00 H new ATOM 1654 N TYR A 102 3.502 -2.754 -2.624 1.00 0.00 N ATOM 1655 CA TYR A 102 4.230 -2.701 -3.918 1.00 0.00 C ATOM 1656 C TYR A 102 4.744 -4.093 -4.271 1.00 0.00 C ATOM 1657 O TYR A 102 4.724 -4.504 -5.414 1.00 0.00 O ATOM 1658 CB TYR A 102 5.410 -1.743 -3.804 1.00 0.00 C ATOM 1659 CG TYR A 102 5.803 -1.264 -5.174 1.00 0.00 C ATOM 1660 CD1 TYR A 102 6.506 -2.103 -6.045 1.00 0.00 C ATOM 1661 CD2 TYR A 102 5.454 0.030 -5.570 1.00 0.00 C ATOM 1662 CE1 TYR A 102 6.862 -1.641 -7.319 1.00 0.00 C ATOM 1663 CE2 TYR A 102 5.808 0.491 -6.841 1.00 0.00 C ATOM 1664 CZ TYR A 102 6.513 -0.343 -7.718 1.00 0.00 C ATOM 1665 OH TYR A 102 6.863 0.113 -8.972 1.00 0.00 O ATOM 0 H TYR A 102 3.861 -2.141 -1.892 1.00 0.00 H new ATOM 0 HA TYR A 102 3.552 -2.352 -4.697 1.00 0.00 H new ATOM 0 HB2 TYR A 102 5.144 -0.895 -3.173 1.00 0.00 H new ATOM 0 HB3 TYR A 102 6.253 -2.243 -3.327 1.00 0.00 H new ATOM 0 HD1 TYR A 102 6.773 -3.103 -5.737 1.00 0.00 H new ATOM 0 HD2 TYR A 102 4.911 0.674 -4.894 1.00 0.00 H new ATOM 0 HE1 TYR A 102 7.406 -2.285 -7.994 1.00 0.00 H new ATOM 0 HE2 TYR A 102 5.538 1.491 -7.147 1.00 0.00 H new ATOM 0 HH TYR A 102 6.059 0.408 -9.449 1.00 0.00 H new ATOM 1675 N MET A 103 5.234 -4.811 -3.299 1.00 0.00 N ATOM 1676 CA MET A 103 5.782 -6.158 -3.577 1.00 0.00 C ATOM 1677 C MET A 103 4.764 -7.020 -4.338 1.00 0.00 C ATOM 1678 O MET A 103 5.066 -7.583 -5.372 1.00 0.00 O ATOM 1679 CB MET A 103 6.119 -6.842 -2.249 1.00 0.00 C ATOM 1680 CG MET A 103 7.238 -7.868 -2.460 1.00 0.00 C ATOM 1681 SD MET A 103 6.903 -9.336 -1.459 1.00 0.00 S ATOM 1682 CE MET A 103 8.013 -8.909 -0.103 1.00 0.00 C ATOM 0 H MET A 103 5.276 -4.518 -2.323 1.00 0.00 H new ATOM 0 HA MET A 103 6.676 -6.050 -4.192 1.00 0.00 H new ATOM 0 HB2 MET A 103 6.429 -6.098 -1.515 1.00 0.00 H new ATOM 0 HB3 MET A 103 5.233 -7.334 -1.848 1.00 0.00 H new ATOM 0 HG2 MET A 103 7.303 -8.140 -3.514 1.00 0.00 H new ATOM 0 HG3 MET A 103 8.199 -7.436 -2.182 1.00 0.00 H new ATOM 0 HE1 MET A 103 8.071 -9.743 0.596 1.00 0.00 H new ATOM 0 HE2 MET A 103 9.006 -8.698 -0.499 1.00 0.00 H new ATOM 0 HE3 MET A 103 7.633 -8.028 0.414 1.00 0.00 H new ATOM 1692 N LYS A 104 3.580 -7.178 -3.810 1.00 0.00 N ATOM 1693 CA LYS A 104 2.581 -8.066 -4.490 1.00 0.00 C ATOM 1694 C LYS A 104 1.994 -7.439 -5.764 1.00 0.00 C ATOM 1695 O LYS A 104 1.929 -8.073 -6.799 1.00 0.00 O ATOM 1696 CB LYS A 104 1.409 -8.353 -3.549 1.00 0.00 C ATOM 1697 CG LYS A 104 1.915 -8.603 -2.130 1.00 0.00 C ATOM 1698 CD LYS A 104 0.733 -8.989 -1.237 1.00 0.00 C ATOM 1699 CE LYS A 104 1.180 -9.008 0.224 1.00 0.00 C ATOM 1700 NZ LYS A 104 0.283 -9.908 1.006 1.00 0.00 N ATOM 0 H LYS A 104 3.260 -6.738 -2.947 1.00 0.00 H new ATOM 0 HA LYS A 104 3.120 -8.975 -4.758 1.00 0.00 H new ATOM 0 HB2 LYS A 104 0.717 -7.511 -3.552 1.00 0.00 H new ATOM 0 HB3 LYS A 104 0.855 -9.222 -3.903 1.00 0.00 H new ATOM 0 HG2 LYS A 104 2.661 -9.398 -2.131 1.00 0.00 H new ATOM 0 HG3 LYS A 104 2.403 -7.709 -1.742 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -0.083 -8.278 -1.369 1.00 0.00 H new ATOM 0 HD3 LYS A 104 0.352 -9.969 -1.524 1.00 0.00 H new ATOM 0 HE2 LYS A 104 2.211 -9.353 0.296 1.00 0.00 H new ATOM 0 HE3 LYS A 104 1.152 -8.000 0.637 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 0.586 -9.922 2.001 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -0.695 -9.560 0.947 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 0.332 -10.871 0.616 1.00 0.00 H new ATOM 1714 N TYR A 105 1.467 -6.247 -5.675 1.00 0.00 N ATOM 1715 CA TYR A 105 0.773 -5.648 -6.856 1.00 0.00 C ATOM 1716 C TYR A 105 1.696 -4.932 -7.863 1.00 0.00 C ATOM 1717 O TYR A 105 1.530 -5.099 -9.056 1.00 0.00 O ATOM 1718 CB TYR A 105 -0.274 -4.656 -6.339 1.00 0.00 C ATOM 1719 CG TYR A 105 -1.204 -5.363 -5.376 1.00 0.00 C ATOM 1720 CD1 TYR A 105 -0.898 -5.408 -4.011 1.00 0.00 C ATOM 1721 CD2 TYR A 105 -2.369 -5.979 -5.848 1.00 0.00 C ATOM 1722 CE1 TYR A 105 -1.754 -6.069 -3.119 1.00 0.00 C ATOM 1723 CE2 TYR A 105 -3.225 -6.637 -4.958 1.00 0.00 C ATOM 1724 CZ TYR A 105 -2.917 -6.683 -3.594 1.00 0.00 C ATOM 1725 OH TYR A 105 -3.762 -7.334 -2.717 1.00 0.00 O ATOM 0 H TYR A 105 1.486 -5.663 -4.839 1.00 0.00 H new ATOM 0 HA TYR A 105 0.331 -6.477 -7.409 1.00 0.00 H new ATOM 0 HB2 TYR A 105 0.216 -3.820 -5.841 1.00 0.00 H new ATOM 0 HB3 TYR A 105 -0.842 -4.242 -7.172 1.00 0.00 H new ATOM 0 HD1 TYR A 105 -0.000 -4.932 -3.644 1.00 0.00 H new ATOM 0 HD2 TYR A 105 -2.608 -5.946 -6.901 1.00 0.00 H new ATOM 0 HE1 TYR A 105 -1.515 -6.104 -2.066 1.00 0.00 H new ATOM 0 HE2 TYR A 105 -4.124 -7.110 -5.324 1.00 0.00 H new ATOM 0 HH TYR A 105 -4.524 -7.704 -3.210 1.00 0.00 H new ATOM 1735 N LEU A 106 2.607 -4.090 -7.436 1.00 0.00 N ATOM 1736 CA LEU A 106 3.434 -3.338 -8.445 1.00 0.00 C ATOM 1737 C LEU A 106 4.807 -3.961 -8.723 1.00 0.00 C ATOM 1738 O LEU A 106 5.486 -3.541 -9.639 1.00 0.00 O ATOM 1739 CB LEU A 106 3.631 -1.901 -7.972 1.00 0.00 C ATOM 1740 CG LEU A 106 2.330 -1.122 -8.167 1.00 0.00 C ATOM 1741 CD1 LEU A 106 1.270 -1.622 -7.182 1.00 0.00 C ATOM 1742 CD2 LEU A 106 2.590 0.366 -7.921 1.00 0.00 C ATOM 0 H LEU A 106 2.814 -3.891 -6.457 1.00 0.00 H new ATOM 0 HA LEU A 106 2.877 -3.380 -9.381 1.00 0.00 H new ATOM 0 HB2 LEU A 106 3.922 -1.888 -6.922 1.00 0.00 H new ATOM 0 HB3 LEU A 106 4.438 -1.429 -8.532 1.00 0.00 H new ATOM 0 HG LEU A 106 1.971 -1.271 -9.185 1.00 0.00 H new ATOM 0 HD11 LEU A 106 0.346 -1.062 -7.327 1.00 0.00 H new ATOM 0 HD12 LEU A 106 1.083 -2.682 -7.355 1.00 0.00 H new ATOM 0 HD13 LEU A 106 1.625 -1.478 -6.162 1.00 0.00 H new ATOM 0 HD21 LEU A 106 1.664 0.925 -8.059 1.00 0.00 H new ATOM 0 HD22 LEU A 106 2.951 0.509 -6.903 1.00 0.00 H new ATOM 0 HD23 LEU A 106 3.340 0.726 -8.626 1.00 0.00 H new ATOM 1754 N TYR A 107 5.245 -4.946 -7.994 1.00 0.00 N ATOM 1755 CA TYR A 107 6.584 -5.510 -8.332 1.00 0.00 C ATOM 1756 C TYR A 107 6.552 -6.054 -9.765 1.00 0.00 C ATOM 1757 O TYR A 107 7.510 -5.920 -10.501 1.00 0.00 O ATOM 1758 CB TYR A 107 6.995 -6.618 -7.358 1.00 0.00 C ATOM 1759 CG TYR A 107 8.495 -6.793 -7.422 1.00 0.00 C ATOM 1760 CD1 TYR A 107 9.342 -5.752 -7.017 1.00 0.00 C ATOM 1761 CD2 TYR A 107 9.041 -7.993 -7.893 1.00 0.00 C ATOM 1762 CE1 TYR A 107 10.732 -5.912 -7.085 1.00 0.00 C ATOM 1763 CE2 TYR A 107 10.431 -8.153 -7.958 1.00 0.00 C ATOM 1764 CZ TYR A 107 11.277 -7.114 -7.555 1.00 0.00 C ATOM 1765 OH TYR A 107 12.645 -7.271 -7.621 1.00 0.00 O ATOM 0 H TYR A 107 4.758 -5.374 -7.207 1.00 0.00 H new ATOM 0 HA TYR A 107 7.324 -4.713 -8.250 1.00 0.00 H new ATOM 0 HB2 TYR A 107 6.688 -6.362 -6.344 1.00 0.00 H new ATOM 0 HB3 TYR A 107 6.495 -7.552 -7.616 1.00 0.00 H new ATOM 0 HD1 TYR A 107 8.923 -4.826 -6.652 1.00 0.00 H new ATOM 0 HD2 TYR A 107 8.390 -8.796 -8.206 1.00 0.00 H new ATOM 0 HE1 TYR A 107 11.384 -5.109 -6.775 1.00 0.00 H new ATOM 0 HE2 TYR A 107 10.851 -9.080 -8.320 1.00 0.00 H new ATOM 0 HH TYR A 107 13.070 -6.735 -6.919 1.00 0.00 H new ATOM 1775 N PRO A 108 5.461 -6.663 -10.168 1.00 0.00 N ATOM 1776 CA PRO A 108 5.315 -7.227 -11.548 1.00 0.00 C ATOM 1777 C PRO A 108 5.489 -6.167 -12.646 1.00 0.00 C ATOM 1778 O PRO A 108 6.354 -6.265 -13.493 1.00 0.00 O ATOM 1779 CB PRO A 108 3.880 -7.766 -11.558 1.00 0.00 C ATOM 1780 CG PRO A 108 3.551 -8.014 -10.129 1.00 0.00 C ATOM 1781 CD PRO A 108 4.238 -6.893 -9.371 1.00 0.00 C ATOM 0 HA PRO A 108 6.077 -7.978 -11.758 1.00 0.00 H new ATOM 0 HB2 PRO A 108 3.192 -7.047 -12.002 1.00 0.00 H new ATOM 0 HB3 PRO A 108 3.807 -8.682 -12.144 1.00 0.00 H new ATOM 0 HG2 PRO A 108 2.474 -8.001 -9.963 1.00 0.00 H new ATOM 0 HG3 PRO A 108 3.912 -8.990 -9.804 1.00 0.00 H new ATOM 0 HD2 PRO A 108 3.616 -6.000 -9.318 1.00 0.00 H new ATOM 0 HD3 PRO A 108 4.471 -7.181 -8.346 1.00 0.00 H new ATOM 1789 N TYR A 109 4.660 -5.163 -12.630 1.00 0.00 N ATOM 1790 CA TYR A 109 4.733 -4.081 -13.654 1.00 0.00 C ATOM 1791 C TYR A 109 6.116 -3.416 -13.600 1.00 0.00 C ATOM 1792 O TYR A 109 6.706 -3.104 -14.612 1.00 0.00 O ATOM 1793 CB TYR A 109 3.650 -3.046 -13.323 1.00 0.00 C ATOM 1794 CG TYR A 109 3.271 -2.244 -14.551 1.00 0.00 C ATOM 1795 CD1 TYR A 109 4.065 -1.170 -14.967 1.00 0.00 C ATOM 1796 CD2 TYR A 109 2.110 -2.570 -15.262 1.00 0.00 C ATOM 1797 CE1 TYR A 109 3.697 -0.423 -16.096 1.00 0.00 C ATOM 1798 CE2 TYR A 109 1.741 -1.824 -16.389 1.00 0.00 C ATOM 1799 CZ TYR A 109 2.535 -0.750 -16.805 1.00 0.00 C ATOM 1800 OH TYR A 109 2.176 -0.015 -17.915 1.00 0.00 O ATOM 0 H TYR A 109 3.920 -5.043 -11.938 1.00 0.00 H new ATOM 0 HA TYR A 109 4.578 -4.488 -14.653 1.00 0.00 H new ATOM 0 HB2 TYR A 109 2.768 -3.551 -12.928 1.00 0.00 H new ATOM 0 HB3 TYR A 109 4.010 -2.375 -12.543 1.00 0.00 H new ATOM 0 HD1 TYR A 109 4.961 -0.916 -14.419 1.00 0.00 H new ATOM 0 HD2 TYR A 109 1.497 -3.399 -14.941 1.00 0.00 H new ATOM 0 HE1 TYR A 109 4.311 0.405 -16.418 1.00 0.00 H new ATOM 0 HE2 TYR A 109 0.845 -2.078 -16.936 1.00 0.00 H new ATOM 0 HH TYR A 109 1.868 -0.620 -18.622 1.00 0.00 H new ATOM 1810 N GLU A 110 6.628 -3.199 -12.418 1.00 0.00 N ATOM 1811 CA GLU A 110 7.977 -2.549 -12.271 1.00 0.00 C ATOM 1812 C GLU A 110 9.078 -3.497 -12.738 1.00 0.00 C ATOM 1813 O GLU A 110 9.981 -3.110 -13.453 1.00 0.00 O ATOM 1814 CB GLU A 110 8.225 -2.212 -10.794 1.00 0.00 C ATOM 1815 CG GLU A 110 9.603 -1.535 -10.632 1.00 0.00 C ATOM 1816 CD GLU A 110 10.587 -2.482 -9.933 1.00 0.00 C ATOM 1817 OE1 GLU A 110 10.396 -3.684 -10.028 1.00 0.00 O ATOM 1818 OE2 GLU A 110 11.516 -1.986 -9.316 1.00 0.00 O ATOM 0 H GLU A 110 6.172 -3.443 -11.539 1.00 0.00 H new ATOM 0 HA GLU A 110 7.992 -1.643 -12.878 1.00 0.00 H new ATOM 0 HB2 GLU A 110 7.440 -1.551 -10.426 1.00 0.00 H new ATOM 0 HB3 GLU A 110 8.184 -3.120 -10.193 1.00 0.00 H new ATOM 0 HG2 GLU A 110 9.993 -1.252 -11.610 1.00 0.00 H new ATOM 0 HG3 GLU A 110 9.498 -0.617 -10.053 1.00 0.00 H new ATOM 1825 N CYS A 111 9.024 -4.731 -12.327 1.00 0.00 N ATOM 1826 CA CYS A 111 10.085 -5.691 -12.736 1.00 0.00 C ATOM 1827 C CYS A 111 9.855 -6.137 -14.179 1.00 0.00 C ATOM 1828 O CYS A 111 10.774 -6.208 -14.970 1.00 0.00 O ATOM 1829 CB CYS A 111 10.050 -6.915 -11.818 1.00 0.00 C ATOM 1830 SG CYS A 111 11.548 -7.900 -12.067 1.00 0.00 S ATOM 0 H CYS A 111 8.294 -5.116 -11.728 1.00 0.00 H new ATOM 0 HA CYS A 111 11.056 -5.202 -12.659 1.00 0.00 H new ATOM 0 HB2 CYS A 111 9.978 -6.600 -10.777 1.00 0.00 H new ATOM 0 HB3 CYS A 111 9.167 -7.517 -12.031 1.00 0.00 H new ATOM 0 HG CYS A 111 12.508 -7.423 -11.331 1.00 0.00 H new ATOM 1836 N GLU A 112 8.645 -6.471 -14.519 1.00 0.00 N ATOM 1837 CA GLU A 112 8.367 -6.950 -15.898 1.00 0.00 C ATOM 1838 C GLU A 112 8.585 -5.836 -16.928 1.00 0.00 C ATOM 1839 O GLU A 112 9.238 -6.033 -17.933 1.00 0.00 O ATOM 1840 CB GLU A 112 6.906 -7.415 -15.968 1.00 0.00 C ATOM 1841 CG GLU A 112 6.614 -7.981 -17.363 1.00 0.00 C ATOM 1842 CD GLU A 112 7.377 -9.293 -17.553 1.00 0.00 C ATOM 1843 OE1 GLU A 112 7.720 -9.907 -16.556 1.00 0.00 O ATOM 1844 OE2 GLU A 112 7.609 -9.658 -18.693 1.00 0.00 O ATOM 0 H GLU A 112 7.835 -6.433 -13.901 1.00 0.00 H new ATOM 0 HA GLU A 112 9.050 -7.768 -16.129 1.00 0.00 H new ATOM 0 HB2 GLU A 112 6.719 -8.175 -15.209 1.00 0.00 H new ATOM 0 HB3 GLU A 112 6.237 -6.581 -15.755 1.00 0.00 H new ATOM 0 HG2 GLU A 112 5.544 -8.150 -17.481 1.00 0.00 H new ATOM 0 HG3 GLU A 112 6.910 -7.262 -18.127 1.00 0.00 H new ATOM 1851 N LYS A 113 8.023 -4.683 -16.710 1.00 0.00 N ATOM 1852 CA LYS A 113 8.181 -3.583 -17.707 1.00 0.00 C ATOM 1853 C LYS A 113 9.586 -2.974 -17.655 1.00 0.00 C ATOM 1854 O LYS A 113 10.068 -2.457 -18.644 1.00 0.00 O ATOM 1855 CB LYS A 113 7.152 -2.485 -17.429 1.00 0.00 C ATOM 1856 CG LYS A 113 5.743 -3.087 -17.390 1.00 0.00 C ATOM 1857 CD LYS A 113 5.351 -3.598 -18.780 1.00 0.00 C ATOM 1858 CE LYS A 113 3.834 -3.802 -18.836 1.00 0.00 C ATOM 1859 NZ LYS A 113 3.356 -4.328 -17.526 1.00 0.00 N ATOM 0 H LYS A 113 7.463 -4.452 -15.890 1.00 0.00 H new ATOM 0 HA LYS A 113 8.025 -4.008 -18.699 1.00 0.00 H new ATOM 0 HB2 LYS A 113 7.375 -1.998 -16.480 1.00 0.00 H new ATOM 0 HB3 LYS A 113 7.208 -1.718 -18.202 1.00 0.00 H new ATOM 0 HG2 LYS A 113 5.708 -3.905 -16.670 1.00 0.00 H new ATOM 0 HG3 LYS A 113 5.027 -2.336 -17.055 1.00 0.00 H new ATOM 0 HD2 LYS A 113 5.662 -2.885 -19.543 1.00 0.00 H new ATOM 0 HD3 LYS A 113 5.864 -4.536 -18.993 1.00 0.00 H new ATOM 0 HE2 LYS A 113 3.337 -2.859 -19.065 1.00 0.00 H new ATOM 0 HE3 LYS A 113 3.579 -4.498 -19.635 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 2.497 -4.896 -17.672 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 4.095 -4.922 -17.100 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 3.142 -3.533 -16.890 1.00 0.00 H new ATOM 1873 N LYS A 114 10.237 -2.987 -16.517 1.00 0.00 N ATOM 1874 CA LYS A 114 11.592 -2.358 -16.430 1.00 0.00 C ATOM 1875 C LYS A 114 12.645 -3.346 -15.897 1.00 0.00 C ATOM 1876 O LYS A 114 13.810 -3.244 -16.223 1.00 0.00 O ATOM 1877 CB LYS A 114 11.500 -1.151 -15.498 1.00 0.00 C ATOM 1878 CG LYS A 114 12.744 -0.283 -15.659 1.00 0.00 C ATOM 1879 CD LYS A 114 12.564 0.666 -16.850 1.00 0.00 C ATOM 1880 CE LYS A 114 13.724 1.660 -16.892 1.00 0.00 C ATOM 1881 NZ LYS A 114 14.961 0.959 -17.337 1.00 0.00 N ATOM 0 H LYS A 114 9.892 -3.402 -15.651 1.00 0.00 H new ATOM 0 HA LYS A 114 11.905 -2.055 -17.429 1.00 0.00 H new ATOM 0 HB2 LYS A 114 10.607 -0.570 -15.727 1.00 0.00 H new ATOM 0 HB3 LYS A 114 11.408 -1.484 -14.464 1.00 0.00 H new ATOM 0 HG2 LYS A 114 12.919 0.290 -14.749 1.00 0.00 H new ATOM 0 HG3 LYS A 114 13.621 -0.912 -15.813 1.00 0.00 H new ATOM 0 HD2 LYS A 114 12.525 0.097 -17.779 1.00 0.00 H new ATOM 0 HD3 LYS A 114 11.617 1.199 -16.763 1.00 0.00 H new ATOM 0 HE2 LYS A 114 13.492 2.478 -17.573 1.00 0.00 H new ATOM 0 HE3 LYS A 114 13.877 2.100 -15.906 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 15.731 1.650 -17.448 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 15.232 0.249 -16.627 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 14.785 0.488 -18.247 1.00 0.00 H new ATOM 1895 N ASN A 115 12.258 -4.305 -15.099 1.00 0.00 N ATOM 1896 CA ASN A 115 13.265 -5.287 -14.581 1.00 0.00 C ATOM 1897 C ASN A 115 14.406 -4.559 -13.853 1.00 0.00 C ATOM 1898 O ASN A 115 15.570 -4.825 -14.084 1.00 0.00 O ATOM 1899 CB ASN A 115 13.842 -6.078 -15.754 1.00 0.00 C ATOM 1900 CG ASN A 115 14.619 -7.281 -15.222 1.00 0.00 C ATOM 1901 OD1 ASN A 115 14.101 -8.058 -14.444 1.00 0.00 O ATOM 1902 ND2 ASN A 115 15.850 -7.468 -15.610 1.00 0.00 N ATOM 0 H ASN A 115 11.299 -4.454 -14.784 1.00 0.00 H new ATOM 0 HA ASN A 115 12.772 -5.959 -13.878 1.00 0.00 H new ATOM 0 HB2 ASN A 115 13.039 -6.412 -16.412 1.00 0.00 H new ATOM 0 HB3 ASN A 115 14.498 -5.442 -16.348 1.00 0.00 H new ATOM 0 HD21 ASN A 115 16.379 -8.267 -15.261 1.00 0.00 H new ATOM 0 HD22 ASN A 115 16.284 -6.815 -16.263 1.00 0.00 H new ATOM 1909 N LEU A 116 14.083 -3.644 -12.984 1.00 0.00 N ATOM 1910 CA LEU A 116 15.141 -2.894 -12.240 1.00 0.00 C ATOM 1911 C LEU A 116 15.863 -3.808 -11.254 1.00 0.00 C ATOM 1912 O LEU A 116 17.018 -3.604 -10.940 1.00 0.00 O ATOM 1913 CB LEU A 116 14.485 -1.745 -11.484 1.00 0.00 C ATOM 1914 CG LEU A 116 13.847 -0.813 -12.508 1.00 0.00 C ATOM 1915 CD1 LEU A 116 12.905 0.165 -11.806 1.00 0.00 C ATOM 1916 CD2 LEU A 116 14.942 -0.036 -13.268 1.00 0.00 C ATOM 0 H LEU A 116 13.125 -3.379 -12.753 1.00 0.00 H new ATOM 0 HA LEU A 116 15.874 -2.512 -12.951 1.00 0.00 H new ATOM 0 HB2 LEU A 116 13.733 -2.124 -10.792 1.00 0.00 H new ATOM 0 HB3 LEU A 116 15.224 -1.209 -10.889 1.00 0.00 H new ATOM 0 HG LEU A 116 13.275 -1.407 -13.221 1.00 0.00 H new ATOM 0 HD11 LEU A 116 12.453 0.828 -12.544 1.00 0.00 H new ATOM 0 HD12 LEU A 116 12.122 -0.391 -11.290 1.00 0.00 H new ATOM 0 HD13 LEU A 116 13.467 0.756 -11.083 1.00 0.00 H new ATOM 0 HD21 LEU A 116 14.478 0.627 -13.998 1.00 0.00 H new ATOM 0 HD22 LEU A 116 15.526 0.554 -12.562 1.00 0.00 H new ATOM 0 HD23 LEU A 116 15.597 -0.739 -13.782 1.00 0.00 H new ATOM 1928 N SER A 117 15.192 -4.798 -10.738 1.00 0.00 N ATOM 1929 CA SER A 117 15.861 -5.693 -9.743 1.00 0.00 C ATOM 1930 C SER A 117 15.218 -7.085 -9.733 1.00 0.00 C ATOM 1931 O SER A 117 14.480 -7.449 -10.627 1.00 0.00 O ATOM 1932 CB SER A 117 15.735 -5.075 -8.352 1.00 0.00 C ATOM 1933 OG SER A 117 16.646 -5.715 -7.469 1.00 0.00 O ATOM 0 H SER A 117 14.222 -5.028 -10.955 1.00 0.00 H new ATOM 0 HA SER A 117 16.910 -5.798 -10.022 1.00 0.00 H new ATOM 0 HB2 SER A 117 15.944 -4.006 -8.396 1.00 0.00 H new ATOM 0 HB3 SER A 117 14.715 -5.186 -7.983 1.00 0.00 H new ATOM 0 HG SER A 117 17.387 -6.098 -7.984 1.00 0.00 H new ATOM 1939 N THR A 118 15.513 -7.870 -8.723 1.00 0.00 N ATOM 1940 CA THR A 118 14.943 -9.251 -8.642 1.00 0.00 C ATOM 1941 C THR A 118 14.337 -9.480 -7.252 1.00 0.00 C ATOM 1942 O THR A 118 14.737 -8.849 -6.294 1.00 0.00 O ATOM 1943 CB THR A 118 16.064 -10.270 -8.859 1.00 0.00 C ATOM 1944 OG1 THR A 118 17.004 -10.161 -7.802 1.00 0.00 O ATOM 1945 CG2 THR A 118 16.756 -9.994 -10.192 1.00 0.00 C ATOM 0 H THR A 118 16.126 -7.612 -7.950 1.00 0.00 H new ATOM 0 HA THR A 118 14.172 -9.367 -9.404 1.00 0.00 H new ATOM 0 HB THR A 118 15.646 -11.277 -8.874 1.00 0.00 H new ATOM 0 HG1 THR A 118 17.723 -10.813 -7.936 1.00 0.00 H new ATOM 0 HG21 THR A 118 17.554 -10.721 -10.345 1.00 0.00 H new ATOM 0 HG22 THR A 118 16.031 -10.075 -11.002 1.00 0.00 H new ATOM 0 HG23 THR A 118 17.178 -8.989 -10.182 1.00 0.00 H new ATOM 1953 N PRO A 119 13.390 -10.385 -7.125 1.00 0.00 N ATOM 1954 CA PRO A 119 12.758 -10.684 -5.807 1.00 0.00 C ATOM 1955 C PRO A 119 13.792 -10.975 -4.712 1.00 0.00 C ATOM 1956 O PRO A 119 13.640 -10.556 -3.584 1.00 0.00 O ATOM 1957 CB PRO A 119 11.912 -11.932 -6.073 1.00 0.00 C ATOM 1958 CG PRO A 119 11.632 -11.922 -7.536 1.00 0.00 C ATOM 1959 CD PRO A 119 12.807 -11.208 -8.206 1.00 0.00 C ATOM 0 HA PRO A 119 12.181 -9.833 -5.444 1.00 0.00 H new ATOM 0 HB2 PRO A 119 12.446 -12.837 -5.782 1.00 0.00 H new ATOM 0 HB3 PRO A 119 10.987 -11.909 -5.497 1.00 0.00 H new ATOM 0 HG2 PRO A 119 11.529 -12.938 -7.917 1.00 0.00 H new ATOM 0 HG3 PRO A 119 10.695 -11.406 -7.747 1.00 0.00 H new ATOM 0 HD2 PRO A 119 13.532 -11.919 -8.602 1.00 0.00 H new ATOM 0 HD3 PRO A 119 12.475 -10.592 -9.042 1.00 0.00 H new ATOM 1967 N ALA A 120 14.839 -11.691 -5.025 1.00 0.00 N ATOM 1968 CA ALA A 120 15.860 -11.996 -3.979 1.00 0.00 C ATOM 1969 C ALA A 120 16.492 -10.699 -3.497 1.00 0.00 C ATOM 1970 O ALA A 120 16.751 -10.526 -2.324 1.00 0.00 O ATOM 1971 CB ALA A 120 16.938 -12.910 -4.565 1.00 0.00 C ATOM 0 H ALA A 120 15.031 -12.075 -5.950 1.00 0.00 H new ATOM 0 HA ALA A 120 15.382 -12.500 -3.139 1.00 0.00 H new ATOM 0 HB1 ALA A 120 17.682 -13.132 -3.800 1.00 0.00 H new ATOM 0 HB2 ALA A 120 16.481 -13.839 -4.907 1.00 0.00 H new ATOM 0 HB3 ALA A 120 17.420 -12.412 -5.406 1.00 0.00 H new ATOM 1977 N GLU A 121 16.716 -9.770 -4.378 1.00 0.00 N ATOM 1978 CA GLU A 121 17.298 -8.486 -3.928 1.00 0.00 C ATOM 1979 C GLU A 121 16.260 -7.807 -3.041 1.00 0.00 C ATOM 1980 O GLU A 121 16.569 -7.268 -1.996 1.00 0.00 O ATOM 1981 CB GLU A 121 17.619 -7.612 -5.141 1.00 0.00 C ATOM 1982 CG GLU A 121 18.749 -8.265 -5.943 1.00 0.00 C ATOM 1983 CD GLU A 121 19.100 -7.389 -7.145 1.00 0.00 C ATOM 1984 OE1 GLU A 121 18.413 -7.489 -8.149 1.00 0.00 O ATOM 1985 OE2 GLU A 121 20.052 -6.632 -7.044 1.00 0.00 O ATOM 0 H GLU A 121 16.524 -9.844 -5.377 1.00 0.00 H new ATOM 0 HA GLU A 121 18.224 -8.646 -3.375 1.00 0.00 H new ATOM 0 HB2 GLU A 121 16.733 -7.495 -5.765 1.00 0.00 H new ATOM 0 HB3 GLU A 121 17.915 -6.614 -4.818 1.00 0.00 H new ATOM 0 HG2 GLU A 121 19.626 -8.400 -5.310 1.00 0.00 H new ATOM 0 HG3 GLU A 121 18.444 -9.256 -6.280 1.00 0.00 H new ATOM 1992 N LEU A 122 15.022 -7.844 -3.450 1.00 0.00 N ATOM 1993 CA LEU A 122 13.934 -7.224 -2.650 1.00 0.00 C ATOM 1994 C LEU A 122 13.714 -8.012 -1.356 1.00 0.00 C ATOM 1995 O LEU A 122 13.728 -7.454 -0.276 1.00 0.00 O ATOM 1996 CB LEU A 122 12.668 -7.245 -3.513 1.00 0.00 C ATOM 1997 CG LEU A 122 11.436 -6.861 -2.691 1.00 0.00 C ATOM 1998 CD1 LEU A 122 11.690 -5.557 -1.941 1.00 0.00 C ATOM 1999 CD2 LEU A 122 10.237 -6.678 -3.633 1.00 0.00 C ATOM 0 H LEU A 122 14.716 -8.285 -4.318 1.00 0.00 H new ATOM 0 HA LEU A 122 14.191 -6.202 -2.373 1.00 0.00 H new ATOM 0 HB2 LEU A 122 12.782 -6.554 -4.348 1.00 0.00 H new ATOM 0 HB3 LEU A 122 12.530 -8.239 -3.938 1.00 0.00 H new ATOM 0 HG LEU A 122 11.227 -7.652 -1.970 1.00 0.00 H new ATOM 0 HD11 LEU A 122 10.806 -5.294 -1.360 1.00 0.00 H new ATOM 0 HD12 LEU A 122 12.541 -5.682 -1.271 1.00 0.00 H new ATOM 0 HD13 LEU A 122 11.904 -4.762 -2.655 1.00 0.00 H new ATOM 0 HD21 LEU A 122 9.356 -6.404 -3.052 1.00 0.00 H new ATOM 0 HD22 LEU A 122 10.457 -5.889 -4.353 1.00 0.00 H new ATOM 0 HD23 LEU A 122 10.046 -7.611 -4.164 1.00 0.00 H new ATOM 2011 N GLN A 123 13.543 -9.303 -1.442 1.00 0.00 N ATOM 2012 CA GLN A 123 13.361 -10.106 -0.200 1.00 0.00 C ATOM 2013 C GLN A 123 14.582 -9.927 0.703 1.00 0.00 C ATOM 2014 O GLN A 123 14.463 -9.740 1.897 1.00 0.00 O ATOM 2015 CB GLN A 123 13.209 -11.589 -0.559 1.00 0.00 C ATOM 2016 CG GLN A 123 11.933 -11.797 -1.379 1.00 0.00 C ATOM 2017 CD GLN A 123 10.708 -11.591 -0.486 1.00 0.00 C ATOM 2018 OE1 GLN A 123 9.709 -11.058 -0.922 1.00 0.00 O ATOM 2019 NE2 GLN A 123 10.743 -11.995 0.755 1.00 0.00 N ATOM 0 H GLN A 123 13.521 -9.834 -2.313 1.00 0.00 H new ATOM 0 HA GLN A 123 12.465 -9.767 0.320 1.00 0.00 H new ATOM 0 HB2 GLN A 123 14.076 -11.926 -1.127 1.00 0.00 H new ATOM 0 HB3 GLN A 123 13.170 -12.190 0.349 1.00 0.00 H new ATOM 0 HG2 GLN A 123 11.908 -11.097 -2.215 1.00 0.00 H new ATOM 0 HG3 GLN A 123 11.921 -12.801 -1.803 1.00 0.00 H new ATOM 0 HE21 GLN A 123 11.583 -12.443 1.122 1.00 0.00 H new ATOM 0 HE22 GLN A 123 9.931 -11.863 1.358 1.00 0.00 H new ATOM 2028 N ALA A 124 15.762 -9.997 0.144 1.00 0.00 N ATOM 2029 CA ALA A 124 16.989 -9.842 0.983 1.00 0.00 C ATOM 2030 C ALA A 124 17.016 -8.455 1.636 1.00 0.00 C ATOM 2031 O ALA A 124 17.350 -8.309 2.795 1.00 0.00 O ATOM 2032 CB ALA A 124 18.228 -10.013 0.102 1.00 0.00 C ATOM 0 H ALA A 124 15.930 -10.154 -0.850 1.00 0.00 H new ATOM 0 HA ALA A 124 16.982 -10.600 1.766 1.00 0.00 H new ATOM 0 HB1 ALA A 124 19.125 -9.901 0.710 1.00 0.00 H new ATOM 0 HB2 ALA A 124 18.218 -11.004 -0.351 1.00 0.00 H new ATOM 0 HB3 ALA A 124 18.224 -9.256 -0.682 1.00 0.00 H new ATOM 2038 N ALA A 125 16.671 -7.437 0.898 1.00 0.00 N ATOM 2039 CA ALA A 125 16.679 -6.057 1.468 1.00 0.00 C ATOM 2040 C ALA A 125 15.585 -5.955 2.510 1.00 0.00 C ATOM 2041 O ALA A 125 15.697 -5.256 3.497 1.00 0.00 O ATOM 2042 CB ALA A 125 16.409 -5.050 0.356 1.00 0.00 C ATOM 0 H ALA A 125 16.383 -7.500 -0.078 1.00 0.00 H new ATOM 0 HA ALA A 125 17.648 -5.847 1.921 1.00 0.00 H new ATOM 0 HB1 ALA A 125 16.414 -4.041 0.769 1.00 0.00 H new ATOM 0 HB2 ALA A 125 17.183 -5.134 -0.407 1.00 0.00 H new ATOM 0 HB3 ALA A 125 15.436 -5.254 -0.091 1.00 0.00 H new ATOM 2048 N ILE A 126 14.532 -6.670 2.296 1.00 0.00 N ATOM 2049 CA ILE A 126 13.417 -6.660 3.257 1.00 0.00 C ATOM 2050 C ILE A 126 13.900 -7.251 4.581 1.00 0.00 C ATOM 2051 O ILE A 126 13.740 -6.669 5.635 1.00 0.00 O ATOM 2052 CB ILE A 126 12.293 -7.498 2.660 1.00 0.00 C ATOM 2053 CG1 ILE A 126 11.412 -6.597 1.800 1.00 0.00 C ATOM 2054 CG2 ILE A 126 11.449 -8.138 3.762 1.00 0.00 C ATOM 2055 CD1 ILE A 126 10.453 -7.459 1.001 1.00 0.00 C ATOM 0 H ILE A 126 14.395 -7.270 1.483 1.00 0.00 H new ATOM 0 HA ILE A 126 13.057 -5.649 3.448 1.00 0.00 H new ATOM 0 HB ILE A 126 12.725 -8.294 2.054 1.00 0.00 H new ATOM 0 HG12 ILE A 126 10.857 -5.901 2.430 1.00 0.00 H new ATOM 0 HG13 ILE A 126 12.028 -5.998 1.129 1.00 0.00 H new ATOM 0 HG21 ILE A 126 10.653 -8.731 3.312 1.00 0.00 H new ATOM 0 HG22 ILE A 126 12.079 -8.782 4.375 1.00 0.00 H new ATOM 0 HG23 ILE A 126 11.012 -7.358 4.385 1.00 0.00 H new ATOM 0 HD11 ILE A 126 9.820 -6.822 0.384 1.00 0.00 H new ATOM 0 HD12 ILE A 126 11.019 -8.137 0.362 1.00 0.00 H new ATOM 0 HD13 ILE A 126 9.830 -8.038 1.683 1.00 0.00 H new ATOM 2067 N ASP A 127 14.496 -8.406 4.527 1.00 0.00 N ATOM 2068 CA ASP A 127 14.997 -9.046 5.777 1.00 0.00 C ATOM 2069 C ASP A 127 16.093 -8.172 6.391 1.00 0.00 C ATOM 2070 O ASP A 127 16.184 -8.020 7.593 1.00 0.00 O ATOM 2071 CB ASP A 127 15.565 -10.426 5.443 1.00 0.00 C ATOM 2072 CG ASP A 127 14.444 -11.321 4.910 1.00 0.00 C ATOM 2073 OD1 ASP A 127 13.291 -10.971 5.103 1.00 0.00 O ATOM 2074 OD2 ASP A 127 14.757 -12.339 4.317 1.00 0.00 O ATOM 0 H ASP A 127 14.659 -8.937 3.672 1.00 0.00 H new ATOM 0 HA ASP A 127 14.180 -9.153 6.490 1.00 0.00 H new ATOM 0 HB2 ASP A 127 16.357 -10.335 4.700 1.00 0.00 H new ATOM 0 HB3 ASP A 127 16.011 -10.873 6.332 1.00 0.00 H new ATOM 2079 N GLY A 128 16.927 -7.597 5.567 1.00 0.00 N ATOM 2080 CA GLY A 128 18.023 -6.732 6.088 1.00 0.00 C ATOM 2081 C GLY A 128 17.432 -5.561 6.878 1.00 0.00 C ATOM 2082 O GLY A 128 18.010 -5.096 7.841 1.00 0.00 O ATOM 0 H GLY A 128 16.896 -7.690 4.552 1.00 0.00 H new ATOM 0 HA2 GLY A 128 18.686 -7.315 6.727 1.00 0.00 H new ATOM 0 HA3 GLY A 128 18.626 -6.357 5.261 1.00 0.00 H new ATOM 2086 N ASN A 129 16.291 -5.069 6.472 1.00 0.00 N ATOM 2087 CA ASN A 129 15.686 -3.915 7.206 1.00 0.00 C ATOM 2088 C ASN A 129 14.706 -4.422 8.269 1.00 0.00 C ATOM 2089 O ASN A 129 14.599 -3.859 9.340 1.00 0.00 O ATOM 2090 CB ASN A 129 14.965 -2.987 6.221 1.00 0.00 C ATOM 2091 CG ASN A 129 13.629 -3.595 5.793 1.00 0.00 C ATOM 2092 OD1 ASN A 129 13.393 -3.789 4.621 1.00 0.00 O ATOM 2093 ND2 ASN A 129 12.732 -3.887 6.694 1.00 0.00 N ATOM 0 H ASN A 129 15.756 -5.410 5.674 1.00 0.00 H new ATOM 0 HA ASN A 129 16.480 -3.355 7.701 1.00 0.00 H new ATOM 0 HB2 ASN A 129 14.797 -2.015 6.684 1.00 0.00 H new ATOM 0 HB3 ASN A 129 15.592 -2.819 5.345 1.00 0.00 H new ATOM 0 HD21 ASN A 129 11.833 -4.278 6.411 1.00 0.00 H new ATOM 0 HD22 ASN A 129 12.929 -3.724 7.681 1.00 0.00 H new ATOM 2100 N ARG A 130 14.001 -5.485 7.997 1.00 0.00 N ATOM 2101 CA ARG A 130 13.050 -6.020 9.015 1.00 0.00 C ATOM 2102 C ARG A 130 13.829 -6.582 10.204 1.00 0.00 C ATOM 2103 O ARG A 130 14.956 -7.015 10.071 1.00 0.00 O ATOM 2104 CB ARG A 130 12.176 -7.104 8.392 1.00 0.00 C ATOM 2105 CG ARG A 130 11.209 -6.447 7.411 1.00 0.00 C ATOM 2106 CD ARG A 130 10.215 -7.486 6.893 1.00 0.00 C ATOM 2107 NE ARG A 130 9.298 -7.897 7.993 1.00 0.00 N ATOM 2108 CZ ARG A 130 8.198 -8.542 7.711 1.00 0.00 C ATOM 2109 NH1 ARG A 130 7.916 -8.839 6.473 1.00 0.00 N ATOM 2110 NH2 ARG A 130 7.383 -8.894 8.666 1.00 0.00 N ATOM 0 H ARG A 130 14.040 -6.005 7.120 1.00 0.00 H new ATOM 0 HA ARG A 130 12.407 -5.213 9.366 1.00 0.00 H new ATOM 0 HB2 ARG A 130 12.795 -7.839 7.878 1.00 0.00 H new ATOM 0 HB3 ARG A 130 11.625 -7.637 9.167 1.00 0.00 H new ATOM 0 HG2 ARG A 130 10.676 -5.633 7.901 1.00 0.00 H new ATOM 0 HG3 ARG A 130 11.761 -6.011 6.578 1.00 0.00 H new ATOM 0 HD2 ARG A 130 9.641 -7.072 6.064 1.00 0.00 H new ATOM 0 HD3 ARG A 130 10.750 -8.355 6.509 1.00 0.00 H new ATOM 0 HE ARG A 130 9.528 -7.676 8.962 1.00 0.00 H new ATOM 0 HH11 ARG A 130 8.554 -8.568 5.725 1.00 0.00 H new ATOM 0 HH12 ARG A 130 7.057 -9.343 6.252 1.00 0.00 H new ATOM 0 HH21 ARG A 130 7.604 -8.666 9.635 1.00 0.00 H new ATOM 0 HH22 ARG A 130 6.524 -9.398 8.444 1.00 0.00 H new