USER MOD reduce.3.24.130724 H: found=0, std=0, add=1032, rem=0, adj=28 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 107 TYR OH : rot 30:sc= -0.346 USER MOD Set 1.2: A 111 CYS SG : rot 175:sc= -6.24! USER MOD Set 2.1: A 92 THR OG1 : rot 180:sc=-2.7e-05 USER MOD Set 2.2: A 93 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 36 MET CE :methyl 150:sc= -2.31 (180deg=-5.76!) USER MOD Set 3.2: A 41 THR OG1 : rot 62:sc= 1.19 USER MOD Single : A 9 GLN : amide:sc= -4.96! C(o=-5!,f=-2.6!) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 GLN : amide:sc= -0.0261 K(o=-0.026,f=-1.7) USER MOD Single : A 15 GLN : amide:sc= -2.55! K(o=-2.6!,f=-0.14) USER MOD Single : A 17 TYR OH : rot -93:sc= -0.867! USER MOD Single : A 20 ASN : amide:sc= -0.714 K(o=-0.71,f=-5.6!) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ 158:sc= -0.132 (180deg=-0.695) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 37 GLN : amide:sc= -0.113 X(o=-0.11,f=-0.12) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 ASN : amide:sc=-0.00255 K(o=-0.0025,f=-1.4) USER MOD Single : A 49 MET CE :methyl 145:sc= -0.203 (180deg=-0.61) USER MOD Single : A 51 LYS NZ :NH3+ -164:sc= -0.0637 (180deg=-0.464) USER MOD Single : A 52 SER OG : rot 73:sc= 0.00228 USER MOD Single : A 57 TYR OH : rot 180:sc=-0.00215 USER MOD Single : A 60 TYR OH : rot 180:sc= -0.104 USER MOD Single : A 61 ASN : amide:sc= -0.0264 K(o=-0.026,f=-2.1!) USER MOD Single : A 74 ASN : amide:sc= -0.0958 K(o=-0.096,f=-5.2!) USER MOD Single : A 75 LYS NZ :NH3+ 155:sc= -2.97 (180deg=-4.19!) USER MOD Single : A 76 LYS NZ :NH3+ -163:sc=-0.00766 (180deg=-0.239) USER MOD Single : A 79 GLN : amide:sc= 0 K(o=0,f=-0.89) USER MOD Single : A 83 LYS NZ :NH3+ -121:sc= -0.24 (180deg=-1.21) USER MOD Single : A 86 HIS : no HD1:sc= -0.249 X(o=-0.25,f=-0.065) USER MOD Single : A 89 SER OG : rot -28:sc= 0.915 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot 76:sc= 1.22 USER MOD Single : A 100 THR OG1 : rot 93:sc= 0.695 USER MOD Single : A 101 GLN : amide:sc= -2.4 K(o=-2.4,f=-3.9!) USER MOD Single : A 102 TYR OH : rot 152:sc= 0.403 USER MOD Single : A 103 MET CE :methyl 142:sc= -6.21! (180deg=-14.7!) 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 109 TYR OH : rot 110:sc= 1.23 USER MOD Single : A 113 LYS NZ :NH3+ -127:sc= 0.18 (180deg=0) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 ASN : amide:sc= -0.0305 X(o=-0.031,f=-0.043) USER MOD Single : A 117 SER OG : rot 36:sc= 0.831 USER MOD Single : A 118 THR OG1 : rot -67:sc= -0.138 USER MOD Single : A 123 GLN : amide:sc= -0.251 K(o=-0.25,f=-1) USER MOD Single : A 129 ASN : amide:sc= -9.91! C(o=-9.9!,f=-8.4!) USER MOD ----------------------------------------------------------------- ATOM 93 N GLN A 9 -15.562 -2.379 -7.710 1.00 0.00 N ATOM 94 CA GLN A 9 -14.288 -2.191 -8.465 1.00 0.00 C ATOM 95 C GLN A 9 -14.403 -0.981 -9.395 1.00 0.00 C ATOM 96 O GLN A 9 -13.491 -0.192 -9.504 1.00 0.00 O ATOM 97 CB GLN A 9 -13.994 -3.449 -9.289 1.00 0.00 C ATOM 98 CG GLN A 9 -13.214 -4.452 -8.437 1.00 0.00 C ATOM 99 CD GLN A 9 -11.721 -4.120 -8.511 1.00 0.00 C ATOM 100 OE1 GLN A 9 -11.121 -4.210 -9.564 1.00 0.00 O ATOM 101 NE2 GLN A 9 -11.094 -3.731 -7.437 1.00 0.00 N ATOM 0 HA GLN A 9 -13.475 -2.019 -7.759 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -14.927 -3.897 -9.633 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -13.419 -3.188 -10.178 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -13.557 -4.413 -7.403 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -13.392 -5.466 -8.794 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -11.596 -3.655 -6.553 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -10.101 -3.502 -7.481 1.00 0.00 H new ATOM 110 N PHE A 10 -15.515 -0.832 -10.069 1.00 0.00 N ATOM 111 CA PHE A 10 -15.674 0.328 -10.998 1.00 0.00 C ATOM 112 C PHE A 10 -15.492 1.637 -10.229 1.00 0.00 C ATOM 113 O PHE A 10 -14.786 2.529 -10.654 1.00 0.00 O ATOM 114 CB PHE A 10 -17.070 0.294 -11.622 1.00 0.00 C ATOM 115 CG PHE A 10 -17.192 1.397 -12.644 1.00 0.00 C ATOM 116 CD1 PHE A 10 -16.789 1.175 -13.966 1.00 0.00 C ATOM 117 CD2 PHE A 10 -17.710 2.642 -12.268 1.00 0.00 C ATOM 118 CE1 PHE A 10 -16.904 2.199 -14.913 1.00 0.00 C ATOM 119 CE2 PHE A 10 -17.824 3.667 -13.216 1.00 0.00 C ATOM 120 CZ PHE A 10 -17.421 3.446 -14.538 1.00 0.00 C ATOM 0 H PHE A 10 -16.317 -1.460 -10.017 1.00 0.00 H new ATOM 0 HA PHE A 10 -14.921 0.265 -11.783 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -17.246 -0.673 -12.093 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -17.829 0.415 -10.849 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -16.390 0.214 -14.255 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -18.021 2.812 -11.248 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -16.594 2.028 -15.933 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -18.223 4.628 -12.927 1.00 0.00 H new ATOM 0 HZ PHE A 10 -17.509 4.236 -15.269 1.00 0.00 H new ATOM 130 N LYS A 11 -16.119 1.761 -9.098 1.00 0.00 N ATOM 131 CA LYS A 11 -15.972 3.002 -8.301 1.00 0.00 C ATOM 132 C LYS A 11 -14.512 3.171 -7.883 1.00 0.00 C ATOM 133 O LYS A 11 -13.956 4.247 -7.939 1.00 0.00 O ATOM 134 CB LYS A 11 -16.836 2.861 -7.062 1.00 0.00 C ATOM 135 CG LYS A 11 -16.727 4.104 -6.187 1.00 0.00 C ATOM 136 CD LYS A 11 -17.488 3.845 -4.893 1.00 0.00 C ATOM 137 CE LYS A 11 -17.064 4.866 -3.841 1.00 0.00 C ATOM 138 NZ LYS A 11 -17.852 4.653 -2.594 1.00 0.00 N ATOM 0 H LYS A 11 -16.729 1.053 -8.690 1.00 0.00 H new ATOM 0 HA LYS A 11 -16.276 3.870 -8.886 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -17.875 2.704 -7.353 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -16.528 1.983 -6.495 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -15.682 4.329 -5.975 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -17.140 4.970 -6.704 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -18.561 3.913 -5.070 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -17.287 2.835 -4.536 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -15.999 4.767 -3.632 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -17.223 5.877 -4.216 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -17.563 5.349 -1.877 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -18.865 4.768 -2.800 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -17.679 3.693 -2.234 1.00 0.00 H new ATOM 152 N GLN A 12 -13.895 2.108 -7.447 1.00 0.00 N ATOM 153 CA GLN A 12 -12.479 2.188 -6.998 1.00 0.00 C ATOM 154 C GLN A 12 -11.546 2.523 -8.170 1.00 0.00 C ATOM 155 O GLN A 12 -10.736 3.422 -8.080 1.00 0.00 O ATOM 156 CB GLN A 12 -12.089 0.836 -6.395 1.00 0.00 C ATOM 157 CG GLN A 12 -12.815 0.652 -5.064 1.00 0.00 C ATOM 158 CD GLN A 12 -12.518 -0.739 -4.503 1.00 0.00 C ATOM 159 OE1 GLN A 12 -12.322 -1.678 -5.246 1.00 0.00 O ATOM 160 NE2 GLN A 12 -12.469 -0.909 -3.209 1.00 0.00 N ATOM 0 H GLN A 12 -14.315 1.181 -7.382 1.00 0.00 H new ATOM 0 HA GLN A 12 -12.380 2.981 -6.257 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -12.351 0.030 -7.080 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -11.010 0.789 -6.244 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -12.495 1.416 -4.356 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -13.889 0.777 -5.204 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -12.634 -0.120 -2.584 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -12.266 -1.831 -2.823 1.00 0.00 H new ATOM 169 N VAL A 13 -11.642 1.819 -9.266 1.00 0.00 N ATOM 170 CA VAL A 13 -10.742 2.126 -10.416 1.00 0.00 C ATOM 171 C VAL A 13 -11.111 3.492 -11.002 1.00 0.00 C ATOM 172 O VAL A 13 -10.254 4.269 -11.360 1.00 0.00 O ATOM 173 CB VAL A 13 -10.862 1.022 -11.480 1.00 0.00 C ATOM 174 CG1 VAL A 13 -12.345 0.693 -11.759 1.00 0.00 C ATOM 175 CG2 VAL A 13 -10.184 1.486 -12.774 1.00 0.00 C ATOM 0 H VAL A 13 -12.298 1.052 -9.415 1.00 0.00 H new ATOM 0 HA VAL A 13 -9.707 2.161 -10.075 1.00 0.00 H new ATOM 0 HB VAL A 13 -10.372 0.122 -11.109 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -12.408 -0.090 -12.514 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -12.821 0.350 -10.840 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -12.854 1.587 -12.120 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -10.268 0.705 -13.529 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -10.670 2.393 -13.134 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -9.131 1.691 -12.580 1.00 0.00 H new ATOM 185 N ARG A 14 -12.367 3.818 -11.084 1.00 0.00 N ATOM 186 CA ARG A 14 -12.717 5.161 -11.621 1.00 0.00 C ATOM 187 C ARG A 14 -12.104 6.208 -10.693 1.00 0.00 C ATOM 188 O ARG A 14 -11.591 7.216 -11.136 1.00 0.00 O ATOM 189 CB ARG A 14 -14.239 5.328 -11.687 1.00 0.00 C ATOM 190 CG ARG A 14 -14.602 6.691 -12.297 1.00 0.00 C ATOM 191 CD ARG A 14 -14.510 6.634 -13.827 1.00 0.00 C ATOM 192 NE ARG A 14 -14.819 7.983 -14.386 1.00 0.00 N ATOM 193 CZ ARG A 14 -14.562 8.251 -15.638 1.00 0.00 C ATOM 194 NH1 ARG A 14 -14.059 7.329 -16.413 1.00 0.00 N ATOM 195 NH2 ARG A 14 -14.817 9.440 -16.115 1.00 0.00 N ATOM 0 H ARG A 14 -13.153 3.228 -10.809 1.00 0.00 H new ATOM 0 HA ARG A 14 -12.327 5.279 -12.632 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -14.674 4.527 -12.285 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -14.664 5.245 -10.687 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -15.611 6.973 -11.997 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -13.929 7.459 -11.914 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -13.512 6.320 -14.132 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -15.210 5.896 -14.218 1.00 0.00 H new ATOM 0 HE ARG A 14 -15.232 8.698 -13.788 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -13.867 6.399 -16.041 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -13.858 7.538 -17.391 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -15.216 10.157 -15.510 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -14.617 9.651 -17.093 1.00 0.00 H new ATOM 209 N GLN A 15 -12.118 5.967 -9.405 1.00 0.00 N ATOM 210 CA GLN A 15 -11.493 6.950 -8.478 1.00 0.00 C ATOM 211 C GLN A 15 -10.041 7.152 -8.906 1.00 0.00 C ATOM 212 O GLN A 15 -9.485 8.219 -8.761 1.00 0.00 O ATOM 213 CB GLN A 15 -11.517 6.421 -7.036 1.00 0.00 C ATOM 214 CG GLN A 15 -12.921 6.558 -6.440 1.00 0.00 C ATOM 215 CD GLN A 15 -13.094 7.967 -5.868 1.00 0.00 C ATOM 216 OE1 GLN A 15 -13.903 8.183 -4.986 1.00 0.00 O ATOM 217 NE2 GLN A 15 -12.359 8.943 -6.329 1.00 0.00 N ATOM 0 H GLN A 15 -12.529 5.144 -8.964 1.00 0.00 H new ATOM 0 HA GLN A 15 -12.047 7.888 -8.516 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -11.209 5.376 -7.020 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -10.801 6.973 -6.427 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -13.673 6.369 -7.206 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -13.070 5.815 -5.657 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -11.680 8.764 -7.069 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -12.464 9.884 -5.949 1.00 0.00 H new ATOM 226 N LEU A 16 -9.421 6.129 -9.432 1.00 0.00 N ATOM 227 CA LEU A 16 -8.000 6.267 -9.860 1.00 0.00 C ATOM 228 C LEU A 16 -7.855 7.228 -11.048 1.00 0.00 C ATOM 229 O LEU A 16 -6.934 8.018 -11.088 1.00 0.00 O ATOM 230 CB LEU A 16 -7.416 4.891 -10.226 1.00 0.00 C ATOM 231 CG LEU A 16 -6.732 4.260 -9.012 1.00 0.00 C ATOM 232 CD1 LEU A 16 -6.593 2.758 -9.249 1.00 0.00 C ATOM 233 CD2 LEU A 16 -5.337 4.876 -8.824 1.00 0.00 C ATOM 0 H LEU A 16 -9.835 5.209 -9.583 1.00 0.00 H new ATOM 0 HA LEU A 16 -7.444 6.685 -9.020 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -8.210 4.236 -10.585 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -6.699 4.998 -11.040 1.00 0.00 H new ATOM 0 HG LEU A 16 -7.329 4.444 -8.118 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -6.106 2.298 -8.389 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -7.581 2.318 -9.385 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -5.992 2.585 -10.142 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -4.853 4.424 -7.958 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -4.735 4.691 -9.714 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -5.432 5.950 -8.667 1.00 0.00 H new ATOM 245 N TYR A 17 -8.731 7.183 -12.020 1.00 0.00 N ATOM 246 CA TYR A 17 -8.572 8.117 -13.172 1.00 0.00 C ATOM 247 C TYR A 17 -9.005 9.523 -12.764 1.00 0.00 C ATOM 248 O TYR A 17 -8.447 10.505 -13.212 1.00 0.00 O ATOM 249 CB TYR A 17 -9.421 7.657 -14.360 1.00 0.00 C ATOM 250 CG TYR A 17 -8.905 6.341 -14.891 1.00 0.00 C ATOM 251 CD1 TYR A 17 -7.831 6.309 -15.795 1.00 0.00 C ATOM 252 CD2 TYR A 17 -9.512 5.152 -14.491 1.00 0.00 C ATOM 253 CE1 TYR A 17 -7.369 5.083 -16.291 1.00 0.00 C ATOM 254 CE2 TYR A 17 -9.049 3.929 -14.990 1.00 0.00 C ATOM 255 CZ TYR A 17 -7.979 3.895 -15.888 1.00 0.00 C ATOM 256 OH TYR A 17 -7.526 2.685 -16.378 1.00 0.00 O ATOM 0 H TYR A 17 -9.533 6.554 -12.066 1.00 0.00 H new ATOM 0 HA TYR A 17 -7.522 8.123 -13.465 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -10.462 7.551 -14.053 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -9.396 8.410 -15.148 1.00 0.00 H new ATOM 0 HD1 TYR A 17 -7.361 7.230 -16.108 1.00 0.00 H new ATOM 0 HD2 TYR A 17 -10.339 5.174 -13.797 1.00 0.00 H new ATOM 0 HE1 TYR A 17 -6.542 5.058 -16.985 1.00 0.00 H new ATOM 0 HE2 TYR A 17 -9.521 3.008 -14.680 1.00 0.00 H new ATOM 0 HH TYR A 17 -8.048 2.437 -17.170 1.00 0.00 H new ATOM 266 N GLU A 18 -10.021 9.637 -11.952 1.00 0.00 N ATOM 267 CA GLU A 18 -10.510 10.995 -11.564 1.00 0.00 C ATOM 268 C GLU A 18 -9.509 11.695 -10.646 1.00 0.00 C ATOM 269 O GLU A 18 -9.688 12.838 -10.275 1.00 0.00 O ATOM 270 CB GLU A 18 -11.853 10.869 -10.841 1.00 0.00 C ATOM 271 CG GLU A 18 -12.934 10.439 -11.836 1.00 0.00 C ATOM 272 CD GLU A 18 -14.284 10.348 -11.121 1.00 0.00 C ATOM 273 OE1 GLU A 18 -14.290 10.405 -9.902 1.00 0.00 O ATOM 274 OE2 GLU A 18 -15.287 10.219 -11.803 1.00 0.00 O ATOM 0 H GLU A 18 -10.532 8.855 -11.542 1.00 0.00 H new ATOM 0 HA GLU A 18 -10.627 11.589 -12.471 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -11.776 10.140 -10.034 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -12.123 11.822 -10.385 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -12.993 11.155 -12.656 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -12.677 9.474 -12.273 1.00 0.00 H new ATOM 281 N ILE A 19 -8.463 11.026 -10.279 1.00 0.00 N ATOM 282 CA ILE A 19 -7.464 11.665 -9.390 1.00 0.00 C ATOM 283 C ILE A 19 -6.955 12.957 -10.039 1.00 0.00 C ATOM 284 O ILE A 19 -6.788 13.964 -9.378 1.00 0.00 O ATOM 285 CB ILE A 19 -6.337 10.670 -9.126 1.00 0.00 C ATOM 286 CG1 ILE A 19 -6.758 9.776 -7.956 1.00 0.00 C ATOM 287 CG2 ILE A 19 -5.044 11.394 -8.769 1.00 0.00 C ATOM 288 CD1 ILE A 19 -5.939 8.498 -7.958 1.00 0.00 C ATOM 0 H ILE A 19 -8.255 10.066 -10.554 1.00 0.00 H new ATOM 0 HA ILE A 19 -7.910 11.935 -8.433 1.00 0.00 H new ATOM 0 HB ILE A 19 -6.157 10.079 -10.024 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -6.618 10.306 -7.014 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -7.819 9.538 -8.033 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -4.256 10.663 -8.586 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -4.751 12.044 -9.594 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -5.199 11.994 -7.872 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -6.245 7.868 -7.123 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -6.101 7.963 -8.894 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -4.882 8.743 -7.859 1.00 0.00 H new ATOM 300 N ASN A 20 -6.711 12.945 -11.322 1.00 0.00 N ATOM 301 CA ASN A 20 -6.214 14.187 -11.989 1.00 0.00 C ATOM 302 C ASN A 20 -6.191 14.004 -13.507 1.00 0.00 C ATOM 303 O ASN A 20 -6.326 12.911 -14.019 1.00 0.00 O ATOM 304 CB ASN A 20 -4.800 14.501 -11.506 1.00 0.00 C ATOM 305 CG ASN A 20 -3.828 13.441 -12.028 1.00 0.00 C ATOM 306 OD1 ASN A 20 -4.235 12.368 -12.426 1.00 0.00 O ATOM 307 ND2 ASN A 20 -2.549 13.703 -12.043 1.00 0.00 N ATOM 0 H ASN A 20 -6.832 12.138 -11.934 1.00 0.00 H new ATOM 0 HA ASN A 20 -6.885 15.008 -11.735 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -4.497 15.488 -11.855 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -4.775 14.526 -10.417 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -1.890 13.006 -12.389 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -2.209 14.605 -11.708 1.00 0.00 H new ATOM 314 N ASP A 21 -6.043 15.085 -14.227 1.00 0.00 N ATOM 315 CA ASP A 21 -6.038 15.001 -15.712 1.00 0.00 C ATOM 316 C ASP A 21 -4.621 14.767 -16.239 1.00 0.00 C ATOM 317 O ASP A 21 -4.049 15.604 -16.909 1.00 0.00 O ATOM 318 CB ASP A 21 -6.591 16.303 -16.292 1.00 0.00 C ATOM 319 CG ASP A 21 -5.704 17.472 -15.865 1.00 0.00 C ATOM 320 OD1 ASP A 21 -4.618 17.218 -15.373 1.00 0.00 O ATOM 321 OD2 ASP A 21 -6.127 18.604 -16.034 1.00 0.00 O ATOM 0 H ASP A 21 -5.925 16.024 -13.847 1.00 0.00 H new ATOM 0 HA ASP A 21 -6.662 14.161 -16.017 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -6.630 16.241 -17.380 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -7.612 16.463 -15.945 1.00 0.00 H new ATOM 326 N ASP A 22 -4.069 13.621 -15.964 1.00 0.00 N ATOM 327 CA ASP A 22 -2.703 13.297 -16.471 1.00 0.00 C ATOM 328 C ASP A 22 -2.835 12.172 -17.507 1.00 0.00 C ATOM 329 O ASP A 22 -2.898 11.011 -17.157 1.00 0.00 O ATOM 330 CB ASP A 22 -1.820 12.830 -15.309 1.00 0.00 C ATOM 331 CG ASP A 22 -0.442 12.434 -15.843 1.00 0.00 C ATOM 332 OD1 ASP A 22 -0.394 11.742 -16.845 1.00 0.00 O ATOM 333 OD2 ASP A 22 0.541 12.835 -15.243 1.00 0.00 O ATOM 0 H ASP A 22 -4.506 12.888 -15.406 1.00 0.00 H new ATOM 0 HA ASP A 22 -2.247 14.177 -16.925 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -1.721 13.626 -14.571 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -2.283 11.983 -14.804 1.00 0.00 H new ATOM 338 N PRO A 23 -2.904 12.509 -18.775 1.00 0.00 N ATOM 339 CA PRO A 23 -3.063 11.496 -19.860 1.00 0.00 C ATOM 340 C PRO A 23 -2.087 10.326 -19.726 1.00 0.00 C ATOM 341 O PRO A 23 -2.452 9.183 -19.917 1.00 0.00 O ATOM 342 CB PRO A 23 -2.785 12.287 -21.138 1.00 0.00 C ATOM 343 CG PRO A 23 -3.133 13.698 -20.808 1.00 0.00 C ATOM 344 CD PRO A 23 -2.839 13.879 -19.318 1.00 0.00 C ATOM 0 HA PRO A 23 -4.051 11.036 -19.837 1.00 0.00 H new ATOM 0 HB2 PRO A 23 -1.740 12.199 -21.436 1.00 0.00 H new ATOM 0 HB3 PRO A 23 -3.386 11.917 -21.969 1.00 0.00 H new ATOM 0 HG2 PRO A 23 -2.545 14.393 -21.407 1.00 0.00 H new ATOM 0 HG3 PRO A 23 -4.182 13.900 -21.024 1.00 0.00 H new ATOM 0 HD2 PRO A 23 -1.859 14.327 -19.156 1.00 0.00 H new ATOM 0 HD3 PRO A 23 -3.571 14.532 -18.843 1.00 0.00 H new ATOM 352 N LYS A 24 -0.856 10.588 -19.390 1.00 0.00 N ATOM 353 CA LYS A 24 0.114 9.469 -19.237 1.00 0.00 C ATOM 354 C LYS A 24 -0.361 8.558 -18.104 1.00 0.00 C ATOM 355 O LYS A 24 -0.279 7.348 -18.186 1.00 0.00 O ATOM 356 CB LYS A 24 1.499 10.029 -18.896 1.00 0.00 C ATOM 357 CG LYS A 24 2.530 8.893 -18.888 1.00 0.00 C ATOM 358 CD LYS A 24 3.117 8.715 -20.294 1.00 0.00 C ATOM 359 CE LYS A 24 4.004 9.916 -20.658 1.00 0.00 C ATOM 360 NZ LYS A 24 5.242 9.429 -21.329 1.00 0.00 N ATOM 0 H LYS A 24 -0.481 11.521 -19.216 1.00 0.00 H new ATOM 0 HA LYS A 24 0.177 8.905 -20.168 1.00 0.00 H new ATOM 0 HB2 LYS A 24 1.785 10.787 -19.625 1.00 0.00 H new ATOM 0 HB3 LYS A 24 1.474 10.517 -17.922 1.00 0.00 H new ATOM 0 HG2 LYS A 24 3.326 9.117 -18.177 1.00 0.00 H new ATOM 0 HG3 LYS A 24 2.061 7.966 -18.560 1.00 0.00 H new ATOM 0 HD2 LYS A 24 3.702 7.796 -20.338 1.00 0.00 H new ATOM 0 HD3 LYS A 24 2.312 8.615 -21.022 1.00 0.00 H new ATOM 0 HE2 LYS A 24 3.463 10.596 -21.316 1.00 0.00 H new ATOM 0 HE3 LYS A 24 4.260 10.479 -19.760 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 5.845 10.240 -21.577 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 5.760 8.797 -20.686 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 4.987 8.910 -22.194 1.00 0.00 H new ATOM 374 N ARG A 25 -0.860 9.136 -17.047 1.00 0.00 N ATOM 375 CA ARG A 25 -1.347 8.321 -15.899 1.00 0.00 C ATOM 376 C ARG A 25 -2.465 7.385 -16.356 1.00 0.00 C ATOM 377 O ARG A 25 -2.585 6.272 -15.886 1.00 0.00 O ATOM 378 CB ARG A 25 -1.888 9.246 -14.812 1.00 0.00 C ATOM 379 CG ARG A 25 -2.332 8.407 -13.615 1.00 0.00 C ATOM 380 CD ARG A 25 -2.694 9.327 -12.448 1.00 0.00 C ATOM 381 NE ARG A 25 -2.926 8.508 -11.226 1.00 0.00 N ATOM 382 CZ ARG A 25 -2.934 9.075 -10.053 1.00 0.00 C ATOM 383 NH1 ARG A 25 -2.732 10.362 -9.946 1.00 0.00 N ATOM 384 NH2 ARG A 25 -3.136 8.354 -8.986 1.00 0.00 N ATOM 0 H ARG A 25 -0.952 10.145 -16.928 1.00 0.00 H new ATOM 0 HA ARG A 25 -0.518 7.731 -15.509 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -1.120 9.958 -14.508 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -2.727 9.827 -15.196 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -3.191 7.793 -13.887 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -1.534 7.726 -13.320 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -1.891 10.043 -12.272 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -3.588 9.903 -12.688 1.00 0.00 H new ATOM 0 HE ARG A 25 -3.079 7.503 -11.307 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -2.568 10.924 -10.781 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -2.739 10.805 -9.027 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -3.287 7.349 -9.071 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -3.143 8.795 -8.066 1.00 0.00 H new ATOM 398 N LYS A 26 -3.290 7.833 -17.259 1.00 0.00 N ATOM 399 CA LYS A 26 -4.412 6.978 -17.731 1.00 0.00 C ATOM 400 C LYS A 26 -3.847 5.695 -18.351 1.00 0.00 C ATOM 401 O LYS A 26 -4.227 4.598 -17.994 1.00 0.00 O ATOM 402 CB LYS A 26 -5.208 7.762 -18.780 1.00 0.00 C ATOM 403 CG LYS A 26 -6.436 6.967 -19.222 1.00 0.00 C ATOM 404 CD LYS A 26 -7.196 7.769 -20.280 1.00 0.00 C ATOM 405 CE LYS A 26 -8.454 7.007 -20.703 1.00 0.00 C ATOM 406 NZ LYS A 26 -9.338 6.811 -19.520 1.00 0.00 N ATOM 0 H LYS A 26 -3.235 8.755 -17.691 1.00 0.00 H new ATOM 0 HA LYS A 26 -5.063 6.709 -16.899 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -5.518 8.722 -18.368 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -4.575 7.975 -19.642 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -6.133 6.002 -19.627 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -7.081 6.765 -18.367 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -7.468 8.747 -19.882 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -6.557 7.944 -21.146 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -8.984 7.560 -21.478 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -8.181 6.042 -21.130 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -10.314 6.646 -19.839 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -9.009 5.990 -18.973 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -9.309 7.660 -18.921 1.00 0.00 H new ATOM 420 N GLU A 27 -2.947 5.833 -19.282 1.00 0.00 N ATOM 421 CA GLU A 27 -2.352 4.635 -19.938 1.00 0.00 C ATOM 422 C GLU A 27 -1.813 3.669 -18.875 1.00 0.00 C ATOM 423 O GLU A 27 -1.915 2.464 -19.006 1.00 0.00 O ATOM 424 CB GLU A 27 -1.210 5.079 -20.855 1.00 0.00 C ATOM 425 CG GLU A 27 -0.752 3.898 -21.710 1.00 0.00 C ATOM 426 CD GLU A 27 -1.822 3.576 -22.755 1.00 0.00 C ATOM 427 OE1 GLU A 27 -2.621 4.451 -23.045 1.00 0.00 O ATOM 428 OE2 GLU A 27 -1.820 2.462 -23.250 1.00 0.00 O ATOM 0 H GLU A 27 -2.595 6.729 -19.619 1.00 0.00 H new ATOM 0 HA GLU A 27 -3.117 4.126 -20.523 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -1.541 5.898 -21.494 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -0.378 5.455 -20.260 1.00 0.00 H new ATOM 0 HG2 GLU A 27 0.191 4.136 -22.202 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -0.572 3.028 -21.079 1.00 0.00 H new ATOM 435 N PHE A 28 -1.234 4.186 -17.826 1.00 0.00 N ATOM 436 CA PHE A 28 -0.680 3.307 -16.756 1.00 0.00 C ATOM 437 C PHE A 28 -1.793 2.521 -16.070 1.00 0.00 C ATOM 438 O PHE A 28 -1.795 1.306 -16.071 1.00 0.00 O ATOM 439 CB PHE A 28 -0.004 4.185 -15.718 1.00 0.00 C ATOM 440 CG PHE A 28 0.657 3.315 -14.690 1.00 0.00 C ATOM 441 CD1 PHE A 28 1.959 2.869 -14.911 1.00 0.00 C ATOM 442 CD2 PHE A 28 -0.014 2.978 -13.505 1.00 0.00 C ATOM 443 CE1 PHE A 28 2.600 2.084 -13.956 1.00 0.00 C ATOM 444 CE2 PHE A 28 0.626 2.185 -12.550 1.00 0.00 C ATOM 445 CZ PHE A 28 1.934 1.737 -12.773 1.00 0.00 C ATOM 0 H PHE A 28 -1.120 5.186 -17.663 1.00 0.00 H new ATOM 0 HA PHE A 28 0.025 2.606 -17.203 1.00 0.00 H new ATOM 0 HB2 PHE A 28 0.734 4.830 -16.195 1.00 0.00 H new ATOM 0 HB3 PHE A 28 -0.737 4.837 -15.243 1.00 0.00 H new ATOM 0 HD1 PHE A 28 2.471 3.133 -15.824 1.00 0.00 H new ATOM 0 HD2 PHE A 28 -1.020 3.330 -13.332 1.00 0.00 H new ATOM 0 HE1 PHE A 28 3.610 1.743 -14.127 1.00 0.00 H new ATOM 0 HE2 PHE A 28 0.112 1.917 -11.639 1.00 0.00 H new ATOM 0 HZ PHE A 28 2.429 1.125 -12.034 1.00 0.00 H new ATOM 455 N LEU A 29 -2.742 3.195 -15.480 1.00 0.00 N ATOM 456 CA LEU A 29 -3.845 2.469 -14.795 1.00 0.00 C ATOM 457 C LEU A 29 -4.455 1.473 -15.769 1.00 0.00 C ATOM 458 O LEU A 29 -4.646 0.315 -15.457 1.00 0.00 O ATOM 459 CB LEU A 29 -4.921 3.471 -14.373 1.00 0.00 C ATOM 460 CG LEU A 29 -4.301 4.564 -13.500 1.00 0.00 C ATOM 461 CD1 LEU A 29 -5.322 5.687 -13.278 1.00 0.00 C ATOM 462 CD2 LEU A 29 -3.903 3.970 -12.147 1.00 0.00 C ATOM 0 H LEU A 29 -2.800 4.213 -15.443 1.00 0.00 H new ATOM 0 HA LEU A 29 -3.459 1.950 -13.918 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -5.382 3.916 -15.255 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -5.711 2.959 -13.824 1.00 0.00 H new ATOM 0 HG LEU A 29 -3.419 4.967 -13.998 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -4.878 6.464 -12.656 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -5.610 6.112 -14.239 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -6.204 5.284 -12.781 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -3.461 4.748 -11.524 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -4.787 3.567 -11.652 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -3.177 3.171 -12.300 1.00 0.00 H new ATOM 474 N ASP A 30 -4.745 1.917 -16.954 1.00 0.00 N ATOM 475 CA ASP A 30 -5.331 0.998 -17.966 1.00 0.00 C ATOM 476 C ASP A 30 -4.341 -0.129 -18.263 1.00 0.00 C ATOM 477 O ASP A 30 -4.705 -1.285 -18.322 1.00 0.00 O ATOM 478 CB ASP A 30 -5.622 1.774 -19.250 1.00 0.00 C ATOM 479 CG ASP A 30 -6.842 2.672 -19.037 1.00 0.00 C ATOM 480 OD1 ASP A 30 -7.917 2.137 -18.826 1.00 0.00 O ATOM 481 OD2 ASP A 30 -6.678 3.879 -19.085 1.00 0.00 O ATOM 0 H ASP A 30 -4.602 2.877 -17.268 1.00 0.00 H new ATOM 0 HA ASP A 30 -6.258 0.574 -17.580 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -4.757 2.377 -19.527 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -5.805 1.082 -20.072 1.00 0.00 H new ATOM 486 N ASP A 31 -3.090 0.197 -18.448 1.00 0.00 N ATOM 487 CA ASP A 31 -2.087 -0.862 -18.735 1.00 0.00 C ATOM 488 C ASP A 31 -1.911 -1.757 -17.507 1.00 0.00 C ATOM 489 O ASP A 31 -1.891 -2.968 -17.609 1.00 0.00 O ATOM 490 CB ASP A 31 -0.747 -0.213 -19.094 1.00 0.00 C ATOM 491 CG ASP A 31 0.196 -1.275 -19.662 1.00 0.00 C ATOM 492 OD1 ASP A 31 -0.175 -2.438 -19.642 1.00 0.00 O ATOM 493 OD2 ASP A 31 1.267 -0.908 -20.116 1.00 0.00 O ATOM 0 H ASP A 31 -2.723 1.148 -18.413 1.00 0.00 H new ATOM 0 HA ASP A 31 -2.434 -1.468 -19.572 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -0.899 0.582 -19.824 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -0.305 0.247 -18.210 1.00 0.00 H new ATOM 498 N LEU A 32 -1.764 -1.173 -16.349 1.00 0.00 N ATOM 499 CA LEU A 32 -1.566 -1.996 -15.123 1.00 0.00 C ATOM 500 C LEU A 32 -2.727 -2.968 -14.946 1.00 0.00 C ATOM 501 O LEU A 32 -2.525 -4.141 -14.720 1.00 0.00 O ATOM 502 CB LEU A 32 -1.456 -1.081 -13.900 1.00 0.00 C ATOM 503 CG LEU A 32 -1.238 -1.915 -12.629 1.00 0.00 C ATOM 504 CD1 LEU A 32 0.134 -2.583 -12.666 1.00 0.00 C ATOM 505 CD2 LEU A 32 -1.292 -0.995 -11.417 1.00 0.00 C ATOM 0 H LEU A 32 -1.772 -0.164 -16.199 1.00 0.00 H new ATOM 0 HA LEU A 32 -0.645 -2.570 -15.226 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -0.629 -0.384 -14.032 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -2.363 -0.484 -13.801 1.00 0.00 H new ATOM 0 HG LEU A 32 -2.014 -2.678 -12.569 1.00 0.00 H new ATOM 0 HD11 LEU A 32 0.277 -3.171 -11.760 1.00 0.00 H new ATOM 0 HD12 LEU A 32 0.197 -3.236 -13.536 1.00 0.00 H new ATOM 0 HD13 LEU A 32 0.909 -1.819 -12.729 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -1.138 -1.579 -10.510 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -0.511 -0.239 -11.499 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -2.266 -0.507 -11.374 1.00 0.00 H new ATOM 517 N PHE A 33 -3.943 -2.517 -15.058 1.00 0.00 N ATOM 518 CA PHE A 33 -5.064 -3.476 -14.897 1.00 0.00 C ATOM 519 C PHE A 33 -4.939 -4.525 -16.000 1.00 0.00 C ATOM 520 O PHE A 33 -5.213 -5.692 -15.802 1.00 0.00 O ATOM 521 CB PHE A 33 -6.417 -2.772 -15.041 1.00 0.00 C ATOM 522 CG PHE A 33 -6.685 -1.844 -13.875 1.00 0.00 C ATOM 523 CD1 PHE A 33 -6.744 -2.341 -12.561 1.00 0.00 C ATOM 524 CD2 PHE A 33 -6.900 -0.480 -14.115 1.00 0.00 C ATOM 525 CE1 PHE A 33 -7.020 -1.470 -11.498 1.00 0.00 C ATOM 526 CE2 PHE A 33 -7.179 0.386 -13.050 1.00 0.00 C ATOM 527 CZ PHE A 33 -7.240 -0.108 -11.743 1.00 0.00 C ATOM 0 H PHE A 33 -4.205 -1.550 -15.249 1.00 0.00 H new ATOM 0 HA PHE A 33 -5.015 -3.925 -13.905 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -6.436 -2.204 -15.971 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -7.211 -3.516 -15.105 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -6.577 -3.391 -12.371 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -6.850 -0.096 -15.123 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -7.063 -1.850 -10.488 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -7.347 1.436 -13.238 1.00 0.00 H new ATOM 0 HZ PHE A 33 -7.457 0.560 -10.923 1.00 0.00 H new ATOM 537 N SER A 34 -4.519 -4.109 -17.166 1.00 0.00 N ATOM 538 CA SER A 34 -4.359 -5.066 -18.296 1.00 0.00 C ATOM 539 C SER A 34 -3.176 -5.996 -18.029 1.00 0.00 C ATOM 540 O SER A 34 -3.290 -7.203 -18.100 1.00 0.00 O ATOM 541 CB SER A 34 -4.106 -4.293 -19.591 1.00 0.00 C ATOM 542 OG SER A 34 -4.099 -5.200 -20.687 1.00 0.00 O ATOM 0 H SER A 34 -4.279 -3.142 -17.383 1.00 0.00 H new ATOM 0 HA SER A 34 -5.270 -5.657 -18.391 1.00 0.00 H new ATOM 0 HB2 SER A 34 -4.879 -3.538 -19.734 1.00 0.00 H new ATOM 0 HB3 SER A 34 -3.153 -3.767 -19.534 1.00 0.00 H new ATOM 0 HG SER A 34 -3.939 -4.707 -21.519 1.00 0.00 H new ATOM 548 N PHE A 35 -2.031 -5.437 -17.745 1.00 0.00 N ATOM 549 CA PHE A 35 -0.821 -6.261 -17.497 1.00 0.00 C ATOM 550 C PHE A 35 -1.036 -7.220 -16.322 1.00 0.00 C ATOM 551 O PHE A 35 -0.638 -8.366 -16.366 1.00 0.00 O ATOM 552 CB PHE A 35 0.324 -5.305 -17.184 1.00 0.00 C ATOM 553 CG PHE A 35 1.585 -6.079 -16.941 1.00 0.00 C ATOM 554 CD1 PHE A 35 2.206 -6.752 -17.994 1.00 0.00 C ATOM 555 CD2 PHE A 35 2.141 -6.105 -15.663 1.00 0.00 C ATOM 556 CE1 PHE A 35 3.391 -7.457 -17.765 1.00 0.00 C ATOM 557 CE2 PHE A 35 3.322 -6.808 -15.434 1.00 0.00 C ATOM 558 CZ PHE A 35 3.947 -7.482 -16.482 1.00 0.00 C ATOM 0 H PHE A 35 -1.884 -4.430 -17.674 1.00 0.00 H new ATOM 0 HA PHE A 35 -0.599 -6.867 -18.375 1.00 0.00 H new ATOM 0 HB2 PHE A 35 0.467 -4.612 -18.013 1.00 0.00 H new ATOM 0 HB3 PHE A 35 0.080 -4.707 -16.306 1.00 0.00 H new ATOM 0 HD1 PHE A 35 1.772 -6.728 -18.983 1.00 0.00 H new ATOM 0 HD2 PHE A 35 1.657 -5.581 -14.852 1.00 0.00 H new ATOM 0 HE1 PHE A 35 3.875 -7.981 -18.576 1.00 0.00 H new ATOM 0 HE2 PHE A 35 3.753 -6.831 -14.444 1.00 0.00 H new ATOM 0 HZ PHE A 35 4.863 -8.025 -16.303 1.00 0.00 H new ATOM 568 N MET A 36 -1.648 -6.760 -15.272 1.00 0.00 N ATOM 569 CA MET A 36 -1.873 -7.642 -14.088 1.00 0.00 C ATOM 570 C MET A 36 -2.655 -8.892 -14.494 1.00 0.00 C ATOM 571 O MET A 36 -2.444 -9.964 -13.962 1.00 0.00 O ATOM 572 CB MET A 36 -2.668 -6.862 -13.043 1.00 0.00 C ATOM 573 CG MET A 36 -1.804 -5.724 -12.504 1.00 0.00 C ATOM 574 SD MET A 36 -0.716 -6.354 -11.208 1.00 0.00 S ATOM 575 CE MET A 36 -1.925 -6.262 -9.870 1.00 0.00 C ATOM 0 H MET A 36 -2.005 -5.809 -15.178 1.00 0.00 H new ATOM 0 HA MET A 36 -0.911 -7.952 -13.680 1.00 0.00 H new ATOM 0 HB2 MET A 36 -3.581 -6.464 -13.486 1.00 0.00 H new ATOM 0 HB3 MET A 36 -2.970 -7.522 -12.230 1.00 0.00 H new ATOM 0 HG2 MET A 36 -1.213 -5.289 -13.310 1.00 0.00 H new ATOM 0 HG3 MET A 36 -2.436 -4.929 -12.108 1.00 0.00 H new ATOM 0 HE1 MET A 36 -1.715 -7.040 -9.136 1.00 0.00 H new ATOM 0 HE2 MET A 36 -1.864 -5.285 -9.391 1.00 0.00 H new ATOM 0 HE3 MET A 36 -2.927 -6.405 -10.275 1.00 0.00 H new ATOM 585 N GLN A 37 -3.561 -8.771 -15.424 1.00 0.00 N ATOM 586 CA GLN A 37 -4.349 -9.963 -15.842 1.00 0.00 C ATOM 587 C GLN A 37 -3.392 -11.086 -16.252 1.00 0.00 C ATOM 588 O GLN A 37 -3.612 -12.241 -15.948 1.00 0.00 O ATOM 589 CB GLN A 37 -5.249 -9.590 -17.021 1.00 0.00 C ATOM 590 CG GLN A 37 -6.184 -10.758 -17.345 1.00 0.00 C ATOM 591 CD GLN A 37 -7.231 -10.899 -16.238 1.00 0.00 C ATOM 592 OE1 GLN A 37 -7.983 -9.983 -15.975 1.00 0.00 O ATOM 593 NE2 GLN A 37 -7.311 -12.020 -15.576 1.00 0.00 N ATOM 0 H GLN A 37 -3.789 -7.904 -15.910 1.00 0.00 H new ATOM 0 HA GLN A 37 -4.968 -10.304 -15.012 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -5.832 -8.701 -16.779 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -4.641 -9.346 -17.892 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -6.674 -10.590 -18.304 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -5.611 -11.681 -17.438 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -6.679 -12.789 -15.797 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -8.006 -12.127 -14.837 1.00 0.00 H new ATOM 602 N LYS A 38 -2.329 -10.756 -16.932 1.00 0.00 N ATOM 603 CA LYS A 38 -1.354 -11.804 -17.353 1.00 0.00 C ATOM 604 C LYS A 38 -0.538 -12.235 -16.135 1.00 0.00 C ATOM 605 O LYS A 38 -0.082 -13.358 -16.037 1.00 0.00 O ATOM 606 CB LYS A 38 -0.413 -11.225 -18.413 1.00 0.00 C ATOM 607 CG LYS A 38 -1.125 -10.094 -19.143 1.00 0.00 C ATOM 608 CD LYS A 38 -0.427 -9.825 -20.479 1.00 0.00 C ATOM 609 CE LYS A 38 1.030 -9.420 -20.236 1.00 0.00 C ATOM 610 NZ LYS A 38 1.457 -8.457 -21.289 1.00 0.00 N ATOM 0 H LYS A 38 -2.092 -9.805 -17.215 1.00 0.00 H new ATOM 0 HA LYS A 38 -1.885 -12.661 -17.768 1.00 0.00 H new ATOM 0 HB2 LYS A 38 0.499 -10.855 -17.945 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -0.117 -12.001 -19.119 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -2.169 -10.358 -19.313 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -1.120 -9.192 -18.531 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -0.466 -10.716 -21.105 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -0.948 -9.034 -21.018 1.00 0.00 H new ATOM 0 HE2 LYS A 38 1.134 -8.967 -19.250 1.00 0.00 H new ATOM 0 HE3 LYS A 38 1.672 -10.301 -20.251 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 2.446 -8.181 -21.126 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 1.372 -8.905 -22.224 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 0.851 -7.612 -21.253 1.00 0.00 H new ATOM 624 N ARG A 39 -0.343 -11.334 -15.216 1.00 0.00 N ATOM 625 CA ARG A 39 0.456 -11.676 -14.004 1.00 0.00 C ATOM 626 C ARG A 39 -0.280 -12.727 -13.182 1.00 0.00 C ATOM 627 O ARG A 39 0.326 -13.527 -12.499 1.00 0.00 O ATOM 628 CB ARG A 39 0.657 -10.429 -13.136 1.00 0.00 C ATOM 629 CG ARG A 39 1.437 -9.370 -13.909 1.00 0.00 C ATOM 630 CD ARG A 39 2.771 -9.950 -14.385 1.00 0.00 C ATOM 631 NE ARG A 39 3.285 -10.930 -13.383 1.00 0.00 N ATOM 632 CZ ARG A 39 4.219 -11.779 -13.723 1.00 0.00 C ATOM 633 NH1 ARG A 39 4.688 -11.778 -14.941 1.00 0.00 N ATOM 634 NH2 ARG A 39 4.682 -12.630 -12.846 1.00 0.00 N ATOM 0 H ARG A 39 -0.700 -10.379 -15.249 1.00 0.00 H new ATOM 0 HA ARG A 39 1.424 -12.061 -14.324 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -0.310 -10.029 -12.832 1.00 0.00 H new ATOM 0 HB3 ARG A 39 1.194 -10.694 -12.225 1.00 0.00 H new ATOM 0 HG2 ARG A 39 0.854 -9.028 -14.764 1.00 0.00 H new ATOM 0 HG3 ARG A 39 1.614 -8.501 -13.275 1.00 0.00 H new ATOM 0 HD2 ARG A 39 2.641 -10.438 -15.351 1.00 0.00 H new ATOM 0 HD3 ARG A 39 3.496 -9.149 -14.528 1.00 0.00 H new ATOM 0 HE ARG A 39 2.908 -10.937 -12.435 1.00 0.00 H new ATOM 0 HH11 ARG A 39 4.326 -11.115 -15.626 1.00 0.00 H new ATOM 0 HH12 ARG A 39 5.417 -12.440 -15.207 1.00 0.00 H new ATOM 0 HH21 ARG A 39 4.315 -12.632 -11.894 1.00 0.00 H new ATOM 0 HH22 ARG A 39 5.411 -13.292 -13.113 1.00 0.00 H new ATOM 648 N GLY A 40 -1.581 -12.720 -13.217 1.00 0.00 N ATOM 649 CA GLY A 40 -2.333 -13.708 -12.404 1.00 0.00 C ATOM 650 C GLY A 40 -2.652 -13.050 -11.070 1.00 0.00 C ATOM 651 O GLY A 40 -3.293 -13.623 -10.210 1.00 0.00 O ATOM 0 H GLY A 40 -2.151 -12.079 -13.768 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -3.249 -14.007 -12.914 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -1.742 -14.612 -12.255 1.00 0.00 H new ATOM 655 N THR A 41 -2.217 -11.824 -10.905 1.00 0.00 N ATOM 656 CA THR A 41 -2.498 -11.085 -9.644 1.00 0.00 C ATOM 657 C THR A 41 -3.361 -9.878 -9.993 1.00 0.00 C ATOM 658 O THR A 41 -2.861 -8.788 -10.187 1.00 0.00 O ATOM 659 CB THR A 41 -1.190 -10.580 -9.025 1.00 0.00 C ATOM 660 OG1 THR A 41 -0.547 -9.698 -9.936 1.00 0.00 O ATOM 661 CG2 THR A 41 -0.264 -11.755 -8.719 1.00 0.00 C ATOM 0 H THR A 41 -1.677 -11.304 -11.597 1.00 0.00 H new ATOM 0 HA THR A 41 -3.000 -11.744 -8.935 1.00 0.00 H new ATOM 0 HB THR A 41 -1.416 -10.054 -8.097 1.00 0.00 H new ATOM 0 HG1 THR A 41 -1.119 -8.919 -10.096 1.00 0.00 H new ATOM 0 HG21 THR A 41 0.662 -11.384 -8.280 1.00 0.00 H new ATOM 0 HG22 THR A 41 -0.753 -12.431 -8.017 1.00 0.00 H new ATOM 0 HG23 THR A 41 -0.039 -12.291 -9.641 1.00 0.00 H new ATOM 669 N PRO A 42 -4.647 -10.067 -10.078 1.00 0.00 N ATOM 670 CA PRO A 42 -5.593 -8.976 -10.409 1.00 0.00 C ATOM 671 C PRO A 42 -5.946 -8.165 -9.166 1.00 0.00 C ATOM 672 O PRO A 42 -6.119 -8.707 -8.092 1.00 0.00 O ATOM 673 CB PRO A 42 -6.800 -9.731 -10.956 1.00 0.00 C ATOM 674 CG PRO A 42 -6.810 -11.027 -10.215 1.00 0.00 C ATOM 675 CD PRO A 42 -5.352 -11.343 -9.864 1.00 0.00 C ATOM 0 HA PRO A 42 -5.194 -8.248 -11.115 1.00 0.00 H new ATOM 0 HB2 PRO A 42 -7.722 -9.174 -10.791 1.00 0.00 H new ATOM 0 HB3 PRO A 42 -6.712 -9.891 -12.031 1.00 0.00 H new ATOM 0 HG2 PRO A 42 -7.418 -10.953 -9.313 1.00 0.00 H new ATOM 0 HG3 PRO A 42 -7.242 -11.819 -10.826 1.00 0.00 H new ATOM 0 HD2 PRO A 42 -5.255 -11.684 -8.833 1.00 0.00 H new ATOM 0 HD3 PRO A 42 -4.951 -12.132 -10.500 1.00 0.00 H new ATOM 683 N ILE A 43 -6.023 -6.873 -9.286 1.00 0.00 N ATOM 684 CA ILE A 43 -6.324 -6.047 -8.089 1.00 0.00 C ATOM 685 C ILE A 43 -7.798 -6.190 -7.704 1.00 0.00 C ATOM 686 O ILE A 43 -8.658 -5.516 -8.237 1.00 0.00 O ATOM 687 CB ILE A 43 -6.009 -4.584 -8.395 1.00 0.00 C ATOM 688 CG1 ILE A 43 -4.641 -4.506 -9.085 1.00 0.00 C ATOM 689 CG2 ILE A 43 -5.978 -3.802 -7.083 1.00 0.00 C ATOM 690 CD1 ILE A 43 -4.228 -3.048 -9.296 1.00 0.00 C ATOM 0 H ILE A 43 -5.892 -6.355 -10.155 1.00 0.00 H new ATOM 0 HA ILE A 43 -5.711 -6.388 -7.255 1.00 0.00 H new ATOM 0 HB ILE A 43 -6.769 -4.159 -9.051 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -3.893 -5.018 -8.480 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -4.682 -5.021 -10.045 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -5.754 -2.755 -7.289 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -6.949 -3.876 -6.592 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -5.209 -4.216 -6.431 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -3.255 -3.013 -9.787 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -4.968 -2.547 -9.920 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -4.166 -2.544 -8.331 1.00 0.00 H new ATOM 702 N ASN A 44 -8.095 -7.052 -6.766 1.00 0.00 N ATOM 703 CA ASN A 44 -9.511 -7.225 -6.334 1.00 0.00 C ATOM 704 C ASN A 44 -10.020 -5.891 -5.791 1.00 0.00 C ATOM 705 O ASN A 44 -11.174 -5.543 -5.937 1.00 0.00 O ATOM 706 CB ASN A 44 -9.591 -8.284 -5.228 1.00 0.00 C ATOM 707 CG ASN A 44 -9.132 -9.641 -5.770 1.00 0.00 C ATOM 708 OD1 ASN A 44 -9.081 -9.847 -6.966 1.00 0.00 O ATOM 709 ND2 ASN A 44 -8.795 -10.583 -4.931 1.00 0.00 N ATOM 0 H ASN A 44 -7.418 -7.642 -6.282 1.00 0.00 H new ATOM 0 HA ASN A 44 -10.118 -7.546 -7.180 1.00 0.00 H new ATOM 0 HB2 ASN A 44 -8.966 -7.989 -4.385 1.00 0.00 H new ATOM 0 HB3 ASN A 44 -10.613 -8.358 -4.857 1.00 0.00 H new ATOM 0 HD21 ASN A 44 -8.489 -11.491 -5.280 1.00 0.00 H new ATOM 0 HD22 ASN A 44 -8.838 -10.411 -3.927 1.00 0.00 H new ATOM 716 N ARG A 45 -9.153 -5.143 -5.166 1.00 0.00 N ATOM 717 CA ARG A 45 -9.554 -3.825 -4.609 1.00 0.00 C ATOM 718 C ARG A 45 -8.303 -2.967 -4.420 1.00 0.00 C ATOM 719 O ARG A 45 -7.268 -3.451 -4.004 1.00 0.00 O ATOM 720 CB ARG A 45 -10.261 -4.033 -3.277 1.00 0.00 C ATOM 721 CG ARG A 45 -9.337 -4.784 -2.326 1.00 0.00 C ATOM 722 CD ARG A 45 -10.186 -5.554 -1.320 1.00 0.00 C ATOM 723 NE ARG A 45 -11.060 -4.608 -0.576 1.00 0.00 N ATOM 724 CZ ARG A 45 -12.084 -5.059 0.096 1.00 0.00 C ATOM 725 NH1 ARG A 45 -12.337 -6.340 0.121 1.00 0.00 N ATOM 726 NH2 ARG A 45 -12.854 -4.227 0.746 1.00 0.00 N ATOM 0 H ARG A 45 -8.175 -5.393 -5.017 1.00 0.00 H new ATOM 0 HA ARG A 45 -10.237 -3.319 -5.292 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -10.540 -3.071 -2.847 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -11.183 -4.595 -3.426 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -8.698 -5.469 -2.883 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -8.680 -4.085 -1.808 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -10.794 -6.297 -1.836 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -9.543 -6.094 -0.625 1.00 0.00 H new ATOM 0 HE ARG A 45 -10.859 -3.608 -0.591 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -11.734 -6.989 -0.385 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -13.137 -6.692 0.646 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -12.654 -3.227 0.728 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -13.655 -4.578 1.272 1.00 0.00 H new ATOM 740 N LEU A 46 -8.376 -1.703 -4.733 1.00 0.00 N ATOM 741 CA LEU A 46 -7.171 -0.834 -4.580 1.00 0.00 C ATOM 742 C LEU A 46 -6.873 -0.602 -3.097 1.00 0.00 C ATOM 743 O LEU A 46 -7.716 -0.104 -2.380 1.00 0.00 O ATOM 744 CB LEU A 46 -7.426 0.548 -5.198 1.00 0.00 C ATOM 745 CG LEU A 46 -8.173 0.433 -6.523 1.00 0.00 C ATOM 746 CD1 LEU A 46 -8.660 1.821 -6.929 1.00 0.00 C ATOM 747 CD2 LEU A 46 -7.236 -0.108 -7.606 1.00 0.00 C ATOM 0 H LEU A 46 -9.211 -1.235 -5.086 1.00 0.00 H new ATOM 0 HA LEU A 46 -6.340 -1.336 -5.076 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -8.004 1.158 -4.504 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -6.476 1.059 -5.357 1.00 0.00 H new ATOM 0 HG LEU A 46 -9.017 -0.248 -6.410 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -9.197 1.756 -7.875 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -9.326 2.212 -6.160 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -7.805 2.488 -7.042 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -7.777 -0.187 -8.549 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -6.391 0.570 -7.728 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -6.872 -1.093 -7.313 1.00 0.00 H new ATOM 759 N PRO A 47 -5.681 -0.888 -2.628 1.00 0.00 N ATOM 760 CA PRO A 47 -5.343 -0.602 -1.216 1.00 0.00 C ATOM 761 C PRO A 47 -5.660 0.868 -0.938 1.00 0.00 C ATOM 762 O PRO A 47 -5.431 1.716 -1.777 1.00 0.00 O ATOM 763 CB PRO A 47 -3.838 -0.873 -1.118 1.00 0.00 C ATOM 764 CG PRO A 47 -3.508 -1.761 -2.274 1.00 0.00 C ATOM 765 CD PRO A 47 -4.556 -1.500 -3.357 1.00 0.00 C ATOM 0 HA PRO A 47 -5.898 -1.203 -0.496 1.00 0.00 H new ATOM 0 HB2 PRO A 47 -3.270 0.056 -1.164 1.00 0.00 H new ATOM 0 HB3 PRO A 47 -3.588 -1.353 -0.172 1.00 0.00 H new ATOM 0 HG2 PRO A 47 -2.507 -1.549 -2.648 1.00 0.00 H new ATOM 0 HG3 PRO A 47 -3.520 -2.808 -1.971 1.00 0.00 H new ATOM 0 HD2 PRO A 47 -4.173 -0.834 -4.130 1.00 0.00 H new ATOM 0 HD3 PRO A 47 -4.857 -2.424 -3.852 1.00 0.00 H new ATOM 773 N ILE A 48 -6.209 1.184 0.197 1.00 0.00 N ATOM 774 CA ILE A 48 -6.561 2.609 0.470 1.00 0.00 C ATOM 775 C ILE A 48 -5.547 3.243 1.408 1.00 0.00 C ATOM 776 O ILE A 48 -4.998 2.610 2.284 1.00 0.00 O ATOM 777 CB ILE A 48 -7.966 2.674 1.084 1.00 0.00 C ATOM 778 CG1 ILE A 48 -8.969 2.157 0.041 1.00 0.00 C ATOM 779 CG2 ILE A 48 -8.317 4.119 1.483 1.00 0.00 C ATOM 780 CD1 ILE A 48 -10.394 2.542 0.437 1.00 0.00 C ATOM 0 H ILE A 48 -6.430 0.527 0.945 1.00 0.00 H new ATOM 0 HA ILE A 48 -6.547 3.165 -0.467 1.00 0.00 H new ATOM 0 HB ILE A 48 -8.004 2.060 1.984 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -8.732 2.573 -0.938 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -8.889 1.073 -0.045 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -9.317 4.144 1.916 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -7.595 4.480 2.215 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -8.288 4.757 0.600 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -11.093 2.169 -0.311 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -10.633 2.105 1.407 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -10.474 3.627 0.499 1.00 0.00 H new ATOM 792 N MET A 49 -5.308 4.507 1.218 1.00 0.00 N ATOM 793 CA MET A 49 -4.348 5.235 2.083 1.00 0.00 C ATOM 794 C MET A 49 -4.943 6.589 2.426 1.00 0.00 C ATOM 795 O MET A 49 -5.382 7.325 1.565 1.00 0.00 O ATOM 796 CB MET A 49 -3.028 5.402 1.349 1.00 0.00 C ATOM 797 CG MET A 49 -2.313 4.056 1.357 1.00 0.00 C ATOM 798 SD MET A 49 -1.682 3.709 3.017 1.00 0.00 S ATOM 799 CE MET A 49 -0.152 4.664 2.883 1.00 0.00 C ATOM 0 H MET A 49 -5.744 5.073 0.490 1.00 0.00 H new ATOM 0 HA MET A 49 -4.162 4.677 3.001 1.00 0.00 H new ATOM 0 HB2 MET A 49 -3.200 5.736 0.326 1.00 0.00 H new ATOM 0 HB3 MET A 49 -2.415 6.162 1.834 1.00 0.00 H new ATOM 0 HG2 MET A 49 -2.998 3.268 1.046 1.00 0.00 H new ATOM 0 HG3 MET A 49 -1.492 4.065 0.640 1.00 0.00 H new ATOM 0 HE1 MET A 49 0.082 5.113 3.848 1.00 0.00 H new ATOM 0 HE2 MET A 49 0.663 4.005 2.582 1.00 0.00 H new ATOM 0 HE3 MET A 49 -0.277 5.450 2.138 1.00 0.00 H new ATOM 809 N ALA A 50 -5.001 6.893 3.681 1.00 0.00 N ATOM 810 CA ALA A 50 -5.615 8.182 4.109 1.00 0.00 C ATOM 811 C ALA A 50 -7.045 8.220 3.562 1.00 0.00 C ATOM 812 O ALA A 50 -7.513 9.221 3.057 1.00 0.00 O ATOM 813 CB ALA A 50 -4.809 9.359 3.559 1.00 0.00 C ATOM 0 H ALA A 50 -4.650 6.307 4.438 1.00 0.00 H new ATOM 0 HA ALA A 50 -5.621 8.258 5.196 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -5.267 10.295 3.878 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -3.787 9.308 3.936 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -4.797 9.314 2.470 1.00 0.00 H new ATOM 819 N LYS A 51 -7.724 7.111 3.671 1.00 0.00 N ATOM 820 CA LYS A 51 -9.132 7.002 3.180 1.00 0.00 C ATOM 821 C LYS A 51 -9.199 7.309 1.681 1.00 0.00 C ATOM 822 O LYS A 51 -10.225 7.702 1.163 1.00 0.00 O ATOM 823 CB LYS A 51 -10.013 7.992 3.938 1.00 0.00 C ATOM 824 CG LYS A 51 -9.958 7.675 5.430 1.00 0.00 C ATOM 825 CD LYS A 51 -10.880 8.636 6.174 1.00 0.00 C ATOM 826 CE LYS A 51 -10.720 8.440 7.684 1.00 0.00 C ATOM 827 NZ LYS A 51 -11.058 7.034 8.041 1.00 0.00 N ATOM 0 H LYS A 51 -7.356 6.256 4.088 1.00 0.00 H new ATOM 0 HA LYS A 51 -9.486 5.985 3.350 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -9.672 9.012 3.758 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -11.040 7.931 3.579 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -10.265 6.644 5.608 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -8.937 7.771 5.798 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -10.643 9.665 5.904 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -11.916 8.461 5.883 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -9.697 8.667 7.985 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -11.371 9.129 8.222 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -11.215 6.964 9.067 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -11.922 6.746 7.538 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -10.274 6.408 7.767 1.00 0.00 H new ATOM 841 N SER A 52 -8.117 7.126 0.980 1.00 0.00 N ATOM 842 CA SER A 52 -8.115 7.400 -0.492 1.00 0.00 C ATOM 843 C SER A 52 -7.411 6.252 -1.220 1.00 0.00 C ATOM 844 O SER A 52 -6.578 5.570 -0.657 1.00 0.00 O ATOM 845 CB SER A 52 -7.378 8.710 -0.768 1.00 0.00 C ATOM 846 OG SER A 52 -8.098 9.787 -0.181 1.00 0.00 O ATOM 0 H SER A 52 -7.229 6.798 1.359 1.00 0.00 H new ATOM 0 HA SER A 52 -9.142 7.483 -0.849 1.00 0.00 H new ATOM 0 HB2 SER A 52 -6.369 8.666 -0.358 1.00 0.00 H new ATOM 0 HB3 SER A 52 -7.280 8.866 -1.842 1.00 0.00 H new ATOM 0 HG SER A 52 -7.987 9.763 0.792 1.00 0.00 H new ATOM 852 N VAL A 53 -7.740 6.022 -2.466 1.00 0.00 N ATOM 853 CA VAL A 53 -7.087 4.909 -3.209 1.00 0.00 C ATOM 854 C VAL A 53 -5.608 5.236 -3.416 1.00 0.00 C ATOM 855 O VAL A 53 -5.240 6.370 -3.646 1.00 0.00 O ATOM 856 CB VAL A 53 -7.773 4.715 -4.569 1.00 0.00 C ATOM 857 CG1 VAL A 53 -9.289 4.681 -4.374 1.00 0.00 C ATOM 858 CG2 VAL A 53 -7.408 5.870 -5.508 1.00 0.00 C ATOM 0 H VAL A 53 -8.429 6.555 -2.996 1.00 0.00 H new ATOM 0 HA VAL A 53 -7.178 3.988 -2.633 1.00 0.00 H new ATOM 0 HB VAL A 53 -7.437 3.775 -5.008 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -9.777 4.543 -5.339 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -9.552 3.855 -3.713 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -9.620 5.620 -3.931 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -7.898 5.725 -6.471 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -7.738 6.812 -5.071 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -6.328 5.895 -5.651 1.00 0.00 H new ATOM 868 N LEU A 54 -4.755 4.252 -3.321 1.00 0.00 N ATOM 869 CA LEU A 54 -3.297 4.506 -3.497 1.00 0.00 C ATOM 870 C LEU A 54 -2.977 4.714 -4.978 1.00 0.00 C ATOM 871 O LEU A 54 -3.268 3.880 -5.813 1.00 0.00 O ATOM 872 CB LEU A 54 -2.514 3.296 -2.972 1.00 0.00 C ATOM 873 CG LEU A 54 -1.007 3.506 -3.178 1.00 0.00 C ATOM 874 CD1 LEU A 54 -0.526 4.700 -2.346 1.00 0.00 C ATOM 875 CD2 LEU A 54 -0.258 2.238 -2.742 1.00 0.00 C ATOM 0 H LEU A 54 -5.006 3.282 -3.129 1.00 0.00 H new ATOM 0 HA LEU A 54 -3.016 5.402 -2.944 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -2.726 3.149 -1.913 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -2.836 2.393 -3.490 1.00 0.00 H new ATOM 0 HG LEU A 54 -0.810 3.707 -4.231 1.00 0.00 H new ATOM 0 HD11 LEU A 54 0.544 4.842 -2.498 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -1.059 5.598 -2.657 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -0.720 4.510 -1.290 1.00 0.00 H new ATOM 0 HD21 LEU A 54 0.813 2.381 -2.886 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -0.460 2.040 -1.689 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -0.595 1.392 -3.341 1.00 0.00 H new ATOM 887 N ASP A 55 -2.388 5.831 -5.306 1.00 0.00 N ATOM 888 CA ASP A 55 -2.051 6.116 -6.728 1.00 0.00 C ATOM 889 C ASP A 55 -1.109 5.031 -7.264 1.00 0.00 C ATOM 890 O ASP A 55 0.081 5.058 -7.018 1.00 0.00 O ATOM 891 CB ASP A 55 -1.346 7.471 -6.801 1.00 0.00 C ATOM 892 CG ASP A 55 -2.286 8.560 -6.281 1.00 0.00 C ATOM 893 OD1 ASP A 55 -3.411 8.231 -5.945 1.00 0.00 O ATOM 894 OD2 ASP A 55 -1.865 9.704 -6.231 1.00 0.00 O ATOM 0 H ASP A 55 -2.124 6.562 -4.646 1.00 0.00 H new ATOM 0 HA ASP A 55 -2.962 6.130 -7.327 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -0.432 7.450 -6.208 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -1.054 7.687 -7.829 1.00 0.00 H new ATOM 899 N LEU A 56 -1.626 4.076 -7.991 1.00 0.00 N ATOM 900 CA LEU A 56 -0.742 3.008 -8.527 1.00 0.00 C ATOM 901 C LEU A 56 0.277 3.628 -9.472 1.00 0.00 C ATOM 902 O LEU A 56 1.376 3.132 -9.630 1.00 0.00 O ATOM 903 CB LEU A 56 -1.571 1.987 -9.301 1.00 0.00 C ATOM 904 CG LEU A 56 -2.713 1.479 -8.429 1.00 0.00 C ATOM 905 CD1 LEU A 56 -3.454 0.372 -9.177 1.00 0.00 C ATOM 906 CD2 LEU A 56 -2.154 0.922 -7.117 1.00 0.00 C ATOM 0 H LEU A 56 -2.613 3.992 -8.233 1.00 0.00 H new ATOM 0 HA LEU A 56 -0.236 2.514 -7.697 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -1.969 2.441 -10.208 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -0.941 1.154 -9.612 1.00 0.00 H new ATOM 0 HG LEU A 56 -3.396 2.299 -8.207 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -4.273 0.002 -8.561 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -3.853 0.768 -10.111 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -2.765 -0.445 -9.394 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -2.974 0.560 -6.497 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -1.471 0.100 -7.332 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -1.618 1.709 -6.587 1.00 0.00 H new ATOM 918 N TYR A 57 -0.084 4.694 -10.126 1.00 0.00 N ATOM 919 CA TYR A 57 0.858 5.318 -11.083 1.00 0.00 C ATOM 920 C TYR A 57 1.878 6.198 -10.372 1.00 0.00 C ATOM 921 O TYR A 57 3.067 5.967 -10.465 1.00 0.00 O ATOM 922 CB TYR A 57 0.078 6.161 -12.077 1.00 0.00 C ATOM 923 CG TYR A 57 1.042 6.852 -13.008 1.00 0.00 C ATOM 924 CD1 TYR A 57 1.936 6.093 -13.764 1.00 0.00 C ATOM 925 CD2 TYR A 57 1.019 8.241 -13.144 1.00 0.00 C ATOM 926 CE1 TYR A 57 2.810 6.706 -14.653 1.00 0.00 C ATOM 927 CE2 TYR A 57 1.901 8.869 -14.034 1.00 0.00 C ATOM 928 CZ TYR A 57 2.798 8.100 -14.791 1.00 0.00 C ATOM 929 OH TYR A 57 3.662 8.714 -15.673 1.00 0.00 O ATOM 0 H TYR A 57 -0.989 5.157 -10.038 1.00 0.00 H new ATOM 0 HA TYR A 57 1.396 4.521 -11.597 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -0.607 5.532 -12.646 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -0.528 6.898 -11.550 1.00 0.00 H new ATOM 0 HD1 TYR A 57 1.949 5.018 -13.657 1.00 0.00 H new ATOM 0 HD2 TYR A 57 0.323 8.830 -12.565 1.00 0.00 H new ATOM 0 HE1 TYR A 57 3.496 6.110 -15.236 1.00 0.00 H new ATOM 0 HE2 TYR A 57 1.890 9.944 -14.137 1.00 0.00 H new ATOM 0 HH TYR A 57 3.522 9.684 -15.646 1.00 0.00 H new ATOM 939 N GLU A 58 1.450 7.216 -9.676 1.00 0.00 N ATOM 940 CA GLU A 58 2.441 8.086 -9.000 1.00 0.00 C ATOM 941 C GLU A 58 3.337 7.215 -8.128 1.00 0.00 C ATOM 942 O GLU A 58 4.529 7.416 -8.062 1.00 0.00 O ATOM 943 CB GLU A 58 1.712 9.125 -8.143 1.00 0.00 C ATOM 944 CG GLU A 58 0.861 10.020 -9.048 1.00 0.00 C ATOM 945 CD GLU A 58 0.203 11.118 -8.209 1.00 0.00 C ATOM 946 OE1 GLU A 58 0.299 11.047 -6.996 1.00 0.00 O ATOM 947 OE2 GLU A 58 -0.386 12.011 -8.795 1.00 0.00 O ATOM 0 H GLU A 58 0.472 7.477 -9.550 1.00 0.00 H new ATOM 0 HA GLU A 58 3.049 8.610 -9.738 1.00 0.00 H new ATOM 0 HB2 GLU A 58 1.081 8.628 -7.407 1.00 0.00 H new ATOM 0 HB3 GLU A 58 2.433 9.728 -7.590 1.00 0.00 H new ATOM 0 HG2 GLU A 58 1.482 10.465 -9.825 1.00 0.00 H new ATOM 0 HG3 GLU A 58 0.098 9.426 -9.551 1.00 0.00 H new ATOM 954 N LEU A 59 2.793 6.217 -7.493 1.00 0.00 N ATOM 955 CA LEU A 59 3.661 5.333 -6.676 1.00 0.00 C ATOM 956 C LEU A 59 4.700 4.717 -7.607 1.00 0.00 C ATOM 957 O LEU A 59 5.880 4.708 -7.331 1.00 0.00 O ATOM 958 CB LEU A 59 2.810 4.233 -6.035 1.00 0.00 C ATOM 959 CG LEU A 59 3.701 3.313 -5.201 1.00 0.00 C ATOM 960 CD1 LEU A 59 4.345 4.114 -4.066 1.00 0.00 C ATOM 961 CD2 LEU A 59 2.853 2.178 -4.612 1.00 0.00 C ATOM 0 H LEU A 59 1.801 5.979 -7.504 1.00 0.00 H new ATOM 0 HA LEU A 59 4.152 5.896 -5.882 1.00 0.00 H new ATOM 0 HB2 LEU A 59 2.039 4.677 -5.406 1.00 0.00 H new ATOM 0 HB3 LEU A 59 2.299 3.658 -6.808 1.00 0.00 H new ATOM 0 HG LEU A 59 4.482 2.892 -5.834 1.00 0.00 H new ATOM 0 HD11 LEU A 59 4.980 3.457 -3.472 1.00 0.00 H new ATOM 0 HD12 LEU A 59 4.948 4.919 -4.486 1.00 0.00 H new ATOM 0 HD13 LEU A 59 3.566 4.537 -3.431 1.00 0.00 H new ATOM 0 HD21 LEU A 59 3.487 1.521 -4.017 1.00 0.00 H new ATOM 0 HD22 LEU A 59 2.071 2.598 -3.979 1.00 0.00 H new ATOM 0 HD23 LEU A 59 2.397 1.607 -5.421 1.00 0.00 H new ATOM 973 N TYR A 60 4.257 4.236 -8.728 1.00 0.00 N ATOM 974 CA TYR A 60 5.189 3.637 -9.719 1.00 0.00 C ATOM 975 C TYR A 60 6.225 4.680 -10.151 1.00 0.00 C ATOM 976 O TYR A 60 7.405 4.545 -9.897 1.00 0.00 O ATOM 977 CB TYR A 60 4.355 3.209 -10.926 1.00 0.00 C ATOM 978 CG TYR A 60 5.182 2.373 -11.859 1.00 0.00 C ATOM 979 CD1 TYR A 60 5.520 1.070 -11.498 1.00 0.00 C ATOM 980 CD2 TYR A 60 5.595 2.893 -13.090 1.00 0.00 C ATOM 981 CE1 TYR A 60 6.273 0.279 -12.368 1.00 0.00 C ATOM 982 CE2 TYR A 60 6.350 2.104 -13.962 1.00 0.00 C ATOM 983 CZ TYR A 60 6.690 0.795 -13.601 1.00 0.00 C ATOM 984 OH TYR A 60 7.436 0.014 -14.462 1.00 0.00 O ATOM 0 H TYR A 60 3.275 4.231 -9.006 1.00 0.00 H new ATOM 0 HA TYR A 60 5.716 2.785 -9.289 1.00 0.00 H new ATOM 0 HB2 TYR A 60 3.485 2.643 -10.593 1.00 0.00 H new ATOM 0 HB3 TYR A 60 3.981 4.089 -11.449 1.00 0.00 H new ATOM 0 HD1 TYR A 60 5.200 0.672 -10.546 1.00 0.00 H new ATOM 0 HD2 TYR A 60 5.331 3.903 -13.366 1.00 0.00 H new ATOM 0 HE1 TYR A 60 6.534 -0.731 -12.090 1.00 0.00 H new ATOM 0 HE2 TYR A 60 6.671 2.504 -14.913 1.00 0.00 H new ATOM 0 HH TYR A 60 7.641 0.525 -15.273 1.00 0.00 H new ATOM 994 N ASN A 61 5.786 5.702 -10.824 1.00 0.00 N ATOM 995 CA ASN A 61 6.724 6.748 -11.321 1.00 0.00 C ATOM 996 C ASN A 61 7.766 7.120 -10.260 1.00 0.00 C ATOM 997 O ASN A 61 8.930 7.271 -10.569 1.00 0.00 O ATOM 998 CB ASN A 61 5.921 7.994 -11.699 1.00 0.00 C ATOM 999 CG ASN A 61 6.825 8.996 -12.419 1.00 0.00 C ATOM 1000 OD1 ASN A 61 7.917 8.659 -12.832 1.00 0.00 O ATOM 1001 ND2 ASN A 61 6.410 10.223 -12.591 1.00 0.00 N ATOM 0 H ASN A 61 4.805 5.861 -11.055 1.00 0.00 H new ATOM 0 HA ASN A 61 7.253 6.352 -12.188 1.00 0.00 H new ATOM 0 HB2 ASN A 61 5.085 7.718 -12.342 1.00 0.00 H new ATOM 0 HB3 ASN A 61 5.498 8.450 -10.804 1.00 0.00 H new ATOM 0 HD21 ASN A 61 7.003 10.899 -13.072 1.00 0.00 H new ATOM 0 HD22 ASN A 61 5.493 10.505 -12.244 1.00 0.00 H new ATOM 1008 N LEU A 62 7.386 7.261 -9.021 1.00 0.00 N ATOM 1009 CA LEU A 62 8.421 7.614 -8.005 1.00 0.00 C ATOM 1010 C LEU A 62 9.300 6.386 -7.778 1.00 0.00 C ATOM 1011 O LEU A 62 10.509 6.480 -7.715 1.00 0.00 O ATOM 1012 CB LEU A 62 7.783 8.076 -6.682 1.00 0.00 C ATOM 1013 CG LEU A 62 6.868 9.297 -6.909 1.00 0.00 C ATOM 1014 CD1 LEU A 62 6.563 9.981 -5.578 1.00 0.00 C ATOM 1015 CD2 LEU A 62 7.528 10.313 -7.848 1.00 0.00 C ATOM 0 H LEU A 62 6.434 7.152 -8.673 1.00 0.00 H new ATOM 0 HA LEU A 62 9.020 8.447 -8.373 1.00 0.00 H new ATOM 0 HB2 LEU A 62 7.206 7.260 -6.247 1.00 0.00 H new ATOM 0 HB3 LEU A 62 8.565 8.330 -5.966 1.00 0.00 H new ATOM 0 HG LEU A 62 5.944 8.939 -7.364 1.00 0.00 H new ATOM 0 HD11 LEU A 62 5.916 10.841 -5.751 1.00 0.00 H new ATOM 0 HD12 LEU A 62 6.061 9.277 -4.914 1.00 0.00 H new ATOM 0 HD13 LEU A 62 7.494 10.313 -5.118 1.00 0.00 H new ATOM 0 HD21 LEU A 62 6.861 11.163 -7.991 1.00 0.00 H new ATOM 0 HD22 LEU A 62 8.466 10.656 -7.411 1.00 0.00 H new ATOM 0 HD23 LEU A 62 7.727 9.843 -8.811 1.00 0.00 H new ATOM 1027 N VAL A 63 8.705 5.232 -7.665 1.00 0.00 N ATOM 1028 CA VAL A 63 9.521 4.005 -7.459 1.00 0.00 C ATOM 1029 C VAL A 63 10.497 3.839 -8.636 1.00 0.00 C ATOM 1030 O VAL A 63 11.663 3.557 -8.440 1.00 0.00 O ATOM 1031 CB VAL A 63 8.600 2.780 -7.345 1.00 0.00 C ATOM 1032 CG1 VAL A 63 9.433 1.515 -7.499 1.00 0.00 C ATOM 1033 CG2 VAL A 63 7.915 2.762 -5.963 1.00 0.00 C ATOM 0 H VAL A 63 7.696 5.086 -7.706 1.00 0.00 H new ATOM 0 HA VAL A 63 10.092 4.095 -6.535 1.00 0.00 H new ATOM 0 HB VAL A 63 7.840 2.829 -8.125 1.00 0.00 H new ATOM 0 HG11 VAL A 63 8.786 0.641 -7.419 1.00 0.00 H new ATOM 0 HG12 VAL A 63 9.921 1.517 -8.474 1.00 0.00 H new ATOM 0 HG13 VAL A 63 10.189 1.479 -6.715 1.00 0.00 H new ATOM 0 HG21 VAL A 63 7.264 1.891 -5.891 1.00 0.00 H new ATOM 0 HG22 VAL A 63 8.673 2.714 -5.182 1.00 0.00 H new ATOM 0 HG23 VAL A 63 7.323 3.669 -5.839 1.00 0.00 H new ATOM 1043 N ILE A 64 10.048 4.027 -9.855 1.00 0.00 N ATOM 1044 CA ILE A 64 10.987 3.895 -11.013 1.00 0.00 C ATOM 1045 C ILE A 64 11.969 5.066 -10.974 1.00 0.00 C ATOM 1046 O ILE A 64 13.137 4.934 -11.285 1.00 0.00 O ATOM 1047 CB ILE A 64 10.227 3.947 -12.346 1.00 0.00 C ATOM 1048 CG1 ILE A 64 9.016 3.025 -12.305 1.00 0.00 C ATOM 1049 CG2 ILE A 64 11.148 3.463 -13.467 1.00 0.00 C ATOM 1050 CD1 ILE A 64 9.446 1.659 -11.793 1.00 0.00 C ATOM 0 H ILE A 64 9.085 4.263 -10.096 1.00 0.00 H new ATOM 0 HA ILE A 64 11.504 2.938 -10.939 1.00 0.00 H new ATOM 0 HB ILE A 64 9.903 4.973 -12.520 1.00 0.00 H new ATOM 0 HG12 ILE A 64 8.246 3.444 -11.657 1.00 0.00 H new ATOM 0 HG13 ILE A 64 8.580 2.933 -13.300 1.00 0.00 H new ATOM 0 HG21 ILE A 64 10.614 3.497 -14.417 1.00 0.00 H new ATOM 0 HG22 ILE A 64 12.026 4.107 -13.520 1.00 0.00 H new ATOM 0 HG23 ILE A 64 11.461 2.439 -13.264 1.00 0.00 H new ATOM 0 HD11 ILE A 64 8.583 0.994 -11.761 1.00 0.00 H new ATOM 0 HD12 ILE A 64 10.201 1.242 -12.459 1.00 0.00 H new ATOM 0 HD13 ILE A 64 9.863 1.761 -10.791 1.00 0.00 H new ATOM 1062 N ALA A 65 11.478 6.221 -10.622 1.00 0.00 N ATOM 1063 CA ALA A 65 12.345 7.431 -10.589 1.00 0.00 C ATOM 1064 C ALA A 65 13.566 7.179 -9.706 1.00 0.00 C ATOM 1065 O ALA A 65 14.568 7.857 -9.824 1.00 0.00 O ATOM 1066 CB ALA A 65 11.551 8.618 -10.038 1.00 0.00 C ATOM 0 H ALA A 65 10.507 6.380 -10.354 1.00 0.00 H new ATOM 0 HA ALA A 65 12.679 7.655 -11.602 1.00 0.00 H new ATOM 0 HB1 ALA A 65 12.188 9.502 -10.015 1.00 0.00 H new ATOM 0 HB2 ALA A 65 10.689 8.808 -10.678 1.00 0.00 H new ATOM 0 HB3 ALA A 65 11.210 8.390 -9.028 1.00 0.00 H new ATOM 1072 N ARG A 66 13.518 6.210 -8.830 1.00 0.00 N ATOM 1073 CA ARG A 66 14.701 5.935 -7.968 1.00 0.00 C ATOM 1074 C ARG A 66 15.540 4.828 -8.613 1.00 0.00 C ATOM 1075 O ARG A 66 16.595 4.462 -8.135 1.00 0.00 O ATOM 1076 CB ARG A 66 14.221 5.503 -6.577 1.00 0.00 C ATOM 1077 CG ARG A 66 14.014 6.737 -5.690 1.00 0.00 C ATOM 1078 CD ARG A 66 12.730 7.464 -6.086 1.00 0.00 C ATOM 1079 NE ARG A 66 12.733 8.808 -5.454 1.00 0.00 N ATOM 1080 CZ ARG A 66 11.919 9.733 -5.889 1.00 0.00 C ATOM 1081 NH1 ARG A 66 11.049 9.452 -6.822 1.00 0.00 N ATOM 1082 NH2 ARG A 66 11.968 10.935 -5.386 1.00 0.00 N ATOM 0 H ARG A 66 12.714 5.601 -8.676 1.00 0.00 H new ATOM 0 HA ARG A 66 15.313 6.831 -7.866 1.00 0.00 H new ATOM 0 HB2 ARG A 66 13.289 4.945 -6.662 1.00 0.00 H new ATOM 0 HB3 ARG A 66 14.952 4.835 -6.121 1.00 0.00 H new ATOM 0 HG2 ARG A 66 13.962 6.437 -4.643 1.00 0.00 H new ATOM 0 HG3 ARG A 66 14.866 7.410 -5.787 1.00 0.00 H new ATOM 0 HD2 ARG A 66 12.666 7.556 -7.170 1.00 0.00 H new ATOM 0 HD3 ARG A 66 11.858 6.896 -5.762 1.00 0.00 H new ATOM 0 HE ARG A 66 13.369 9.009 -4.682 1.00 0.00 H new ATOM 0 HH11 ARG A 66 11.005 8.510 -7.211 1.00 0.00 H new ATOM 0 HH12 ARG A 66 10.414 10.174 -7.161 1.00 0.00 H new ATOM 0 HH21 ARG A 66 12.642 11.154 -4.652 1.00 0.00 H new ATOM 0 HH22 ARG A 66 11.332 11.656 -5.726 1.00 0.00 H new ATOM 1096 N GLY A 67 15.087 4.338 -9.730 1.00 0.00 N ATOM 1097 CA GLY A 67 15.857 3.296 -10.470 1.00 0.00 C ATOM 1098 C GLY A 67 15.559 1.879 -9.958 1.00 0.00 C ATOM 1099 O GLY A 67 16.257 0.947 -10.309 1.00 0.00 O ATOM 0 H GLY A 67 14.209 4.615 -10.168 1.00 0.00 H new ATOM 0 HA2 GLY A 67 15.616 3.355 -11.531 1.00 0.00 H new ATOM 0 HA3 GLY A 67 16.924 3.498 -10.373 1.00 0.00 H new ATOM 1103 N GLY A 68 14.541 1.678 -9.160 1.00 0.00 N ATOM 1104 CA GLY A 68 14.253 0.284 -8.693 1.00 0.00 C ATOM 1105 C GLY A 68 13.739 0.265 -7.255 1.00 0.00 C ATOM 1106 O GLY A 68 14.300 0.876 -6.367 1.00 0.00 O ATOM 0 H GLY A 68 13.908 2.400 -8.817 1.00 0.00 H new ATOM 0 HA2 GLY A 68 13.514 -0.174 -9.350 1.00 0.00 H new ATOM 0 HA3 GLY A 68 15.159 -0.318 -8.764 1.00 0.00 H new ATOM 1110 N LEU A 69 12.664 -0.443 -7.028 1.00 0.00 N ATOM 1111 CA LEU A 69 12.082 -0.532 -5.661 1.00 0.00 C ATOM 1112 C LEU A 69 13.164 -0.960 -4.665 1.00 0.00 C ATOM 1113 O LEU A 69 13.216 -0.479 -3.551 1.00 0.00 O ATOM 1114 CB LEU A 69 10.958 -1.576 -5.679 1.00 0.00 C ATOM 1115 CG LEU A 69 10.257 -1.622 -4.316 1.00 0.00 C ATOM 1116 CD1 LEU A 69 9.329 -0.404 -4.153 1.00 0.00 C ATOM 1117 CD2 LEU A 69 9.440 -2.920 -4.216 1.00 0.00 C ATOM 0 H LEU A 69 12.160 -0.969 -7.742 1.00 0.00 H new ATOM 0 HA LEU A 69 11.689 0.439 -5.359 1.00 0.00 H new ATOM 0 HB2 LEU A 69 10.237 -1.331 -6.459 1.00 0.00 H new ATOM 0 HB3 LEU A 69 11.367 -2.557 -5.919 1.00 0.00 H new ATOM 0 HG LEU A 69 11.005 -1.596 -3.523 1.00 0.00 H new ATOM 0 HD11 LEU A 69 8.837 -0.449 -3.181 1.00 0.00 H new ATOM 0 HD12 LEU A 69 9.916 0.512 -4.221 1.00 0.00 H new ATOM 0 HD13 LEU A 69 8.576 -0.412 -4.941 1.00 0.00 H new ATOM 0 HD21 LEU A 69 8.938 -2.960 -3.249 1.00 0.00 H new ATOM 0 HD22 LEU A 69 8.696 -2.944 -5.012 1.00 0.00 H new ATOM 0 HD23 LEU A 69 10.106 -3.777 -4.315 1.00 0.00 H new ATOM 1129 N VAL A 70 14.026 -1.860 -5.054 1.00 0.00 N ATOM 1130 CA VAL A 70 15.096 -2.311 -4.119 1.00 0.00 C ATOM 1131 C VAL A 70 15.894 -1.091 -3.650 1.00 0.00 C ATOM 1132 O VAL A 70 16.211 -0.957 -2.484 1.00 0.00 O ATOM 1133 CB VAL A 70 16.017 -3.309 -4.849 1.00 0.00 C ATOM 1134 CG1 VAL A 70 17.233 -3.658 -3.983 1.00 0.00 C ATOM 1135 CG2 VAL A 70 15.234 -4.593 -5.140 1.00 0.00 C ATOM 0 H VAL A 70 14.036 -2.301 -5.974 1.00 0.00 H new ATOM 0 HA VAL A 70 14.658 -2.805 -3.251 1.00 0.00 H new ATOM 0 HB VAL A 70 16.362 -2.851 -5.776 1.00 0.00 H new ATOM 0 HG11 VAL A 70 17.870 -4.363 -4.517 1.00 0.00 H new ATOM 0 HG12 VAL A 70 17.798 -2.751 -3.767 1.00 0.00 H new ATOM 0 HG13 VAL A 70 16.897 -4.108 -3.049 1.00 0.00 H new ATOM 0 HG21 VAL A 70 15.879 -5.304 -5.656 1.00 0.00 H new ATOM 0 HG22 VAL A 70 14.890 -5.030 -4.202 1.00 0.00 H new ATOM 0 HG23 VAL A 70 14.374 -4.360 -5.769 1.00 0.00 H new ATOM 1145 N ASP A 71 16.224 -0.203 -4.545 1.00 0.00 N ATOM 1146 CA ASP A 71 17.004 1.002 -4.145 1.00 0.00 C ATOM 1147 C ASP A 71 16.231 1.801 -3.086 1.00 0.00 C ATOM 1148 O ASP A 71 16.796 2.299 -2.136 1.00 0.00 O ATOM 1149 CB ASP A 71 17.253 1.873 -5.380 1.00 0.00 C ATOM 1150 CG ASP A 71 18.221 1.151 -6.322 1.00 0.00 C ATOM 1151 OD1 ASP A 71 18.984 0.330 -5.838 1.00 0.00 O ATOM 1152 OD2 ASP A 71 18.186 1.435 -7.507 1.00 0.00 O ATOM 0 H ASP A 71 15.988 -0.259 -5.536 1.00 0.00 H new ATOM 0 HA ASP A 71 17.959 0.692 -3.720 1.00 0.00 H new ATOM 0 HB2 ASP A 71 16.312 2.075 -5.892 1.00 0.00 H new ATOM 0 HB3 ASP A 71 17.668 2.836 -5.082 1.00 0.00 H new ATOM 1157 N VAL A 72 14.944 1.921 -3.232 1.00 0.00 N ATOM 1158 CA VAL A 72 14.153 2.682 -2.225 1.00 0.00 C ATOM 1159 C VAL A 72 14.238 1.980 -0.872 1.00 0.00 C ATOM 1160 O VAL A 72 14.409 2.613 0.139 1.00 0.00 O ATOM 1161 CB VAL A 72 12.692 2.756 -2.684 1.00 0.00 C ATOM 1162 CG1 VAL A 72 11.841 3.539 -1.673 1.00 0.00 C ATOM 1163 CG2 VAL A 72 12.625 3.443 -4.052 1.00 0.00 C ATOM 0 H VAL A 72 14.405 1.527 -4.003 1.00 0.00 H new ATOM 0 HA VAL A 72 14.554 3.691 -2.127 1.00 0.00 H new ATOM 0 HB VAL A 72 12.297 1.743 -2.756 1.00 0.00 H new ATOM 0 HG11 VAL A 72 10.808 3.578 -2.020 1.00 0.00 H new ATOM 0 HG12 VAL A 72 11.879 3.043 -0.703 1.00 0.00 H new ATOM 0 HG13 VAL A 72 12.230 4.553 -1.577 1.00 0.00 H new ATOM 0 HG21 VAL A 72 11.587 3.497 -4.381 1.00 0.00 H new ATOM 0 HG22 VAL A 72 13.034 4.450 -3.974 1.00 0.00 H new ATOM 0 HG23 VAL A 72 13.206 2.871 -4.775 1.00 0.00 H new ATOM 1173 N ILE A 73 14.109 0.685 -0.833 1.00 0.00 N ATOM 1174 CA ILE A 73 14.173 -0.008 0.483 1.00 0.00 C ATOM 1175 C ILE A 73 15.570 0.147 1.095 1.00 0.00 C ATOM 1176 O ILE A 73 15.733 0.703 2.161 1.00 0.00 O ATOM 1177 CB ILE A 73 13.859 -1.499 0.301 1.00 0.00 C ATOM 1178 CG1 ILE A 73 12.514 -1.659 -0.410 1.00 0.00 C ATOM 1179 CG2 ILE A 73 13.777 -2.169 1.673 1.00 0.00 C ATOM 1180 CD1 ILE A 73 12.156 -3.147 -0.504 1.00 0.00 C ATOM 0 H ILE A 73 13.964 0.082 -1.643 1.00 0.00 H new ATOM 0 HA ILE A 73 13.438 0.441 1.151 1.00 0.00 H new ATOM 0 HB ILE A 73 14.646 -1.962 -0.294 1.00 0.00 H new ATOM 0 HG12 ILE A 73 11.737 -1.121 0.134 1.00 0.00 H new ATOM 0 HG13 ILE A 73 12.564 -1.223 -1.408 1.00 0.00 H new ATOM 0 HG21 ILE A 73 13.554 -3.229 1.548 1.00 0.00 H new ATOM 0 HG22 ILE A 73 14.730 -2.057 2.190 1.00 0.00 H new ATOM 0 HG23 ILE A 73 12.988 -1.699 2.261 1.00 0.00 H new ATOM 0 HD11 ILE A 73 11.198 -3.259 -1.011 1.00 0.00 H new ATOM 0 HD12 ILE A 73 12.928 -3.672 -1.067 1.00 0.00 H new ATOM 0 HD13 ILE A 73 12.088 -3.569 0.499 1.00 0.00 H new ATOM 1192 N ASN A 74 16.579 -0.353 0.432 1.00 0.00 N ATOM 1193 CA ASN A 74 17.961 -0.254 0.969 1.00 0.00 C ATOM 1194 C ASN A 74 18.353 1.204 1.188 1.00 0.00 C ATOM 1195 O ASN A 74 18.968 1.543 2.178 1.00 0.00 O ATOM 1196 CB ASN A 74 18.933 -0.910 -0.014 1.00 0.00 C ATOM 1197 CG ASN A 74 18.662 -2.415 -0.062 1.00 0.00 C ATOM 1198 OD1 ASN A 74 18.114 -2.974 0.867 1.00 0.00 O ATOM 1199 ND2 ASN A 74 19.023 -3.102 -1.112 1.00 0.00 N ATOM 0 H ASN A 74 16.500 -0.829 -0.466 1.00 0.00 H new ATOM 0 HA ASN A 74 18.003 -0.768 1.929 1.00 0.00 H new ATOM 0 HB2 ASN A 74 18.814 -0.475 -1.006 1.00 0.00 H new ATOM 0 HB3 ASN A 74 19.962 -0.723 0.294 1.00 0.00 H new ATOM 0 HD21 ASN A 74 18.845 -4.106 -1.151 1.00 0.00 H new ATOM 0 HD22 ASN A 74 19.483 -2.635 -1.893 1.00 0.00 H new ATOM 1206 N LYS A 75 18.009 2.077 0.279 1.00 0.00 N ATOM 1207 CA LYS A 75 18.380 3.503 0.464 1.00 0.00 C ATOM 1208 C LYS A 75 17.263 4.251 1.204 1.00 0.00 C ATOM 1209 O LYS A 75 17.430 5.385 1.609 1.00 0.00 O ATOM 1210 CB LYS A 75 18.634 4.160 -0.897 1.00 0.00 C ATOM 1211 CG LYS A 75 19.528 3.260 -1.769 1.00 0.00 C ATOM 1212 CD LYS A 75 20.873 2.988 -1.085 1.00 0.00 C ATOM 1213 CE LYS A 75 21.587 4.310 -0.778 1.00 0.00 C ATOM 1214 NZ LYS A 75 21.220 4.776 0.589 1.00 0.00 N ATOM 0 H LYS A 75 17.492 1.864 -0.574 1.00 0.00 H new ATOM 0 HA LYS A 75 19.292 3.552 1.060 1.00 0.00 H new ATOM 0 HB2 LYS A 75 17.686 4.341 -1.403 1.00 0.00 H new ATOM 0 HB3 LYS A 75 19.111 5.130 -0.756 1.00 0.00 H new ATOM 0 HG2 LYS A 75 19.019 2.316 -1.964 1.00 0.00 H new ATOM 0 HG3 LYS A 75 19.697 3.737 -2.734 1.00 0.00 H new ATOM 0 HD2 LYS A 75 20.714 2.429 -0.163 1.00 0.00 H new ATOM 0 HD3 LYS A 75 21.498 2.369 -1.729 1.00 0.00 H new ATOM 0 HE2 LYS A 75 22.666 4.176 -0.849 1.00 0.00 H new ATOM 0 HE3 LYS A 75 21.310 5.063 -1.516 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 21.974 5.389 0.961 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 20.329 5.310 0.546 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 21.101 3.954 1.216 1.00 0.00 H new ATOM 1228 N LYS A 76 16.125 3.631 1.372 1.00 0.00 N ATOM 1229 CA LYS A 76 14.987 4.303 2.078 1.00 0.00 C ATOM 1230 C LYS A 76 14.591 5.596 1.368 1.00 0.00 C ATOM 1231 O LYS A 76 14.628 6.663 1.947 1.00 0.00 O ATOM 1232 CB LYS A 76 15.355 4.624 3.533 1.00 0.00 C ATOM 1233 CG LYS A 76 15.162 3.391 4.431 1.00 0.00 C ATOM 1234 CD LYS A 76 14.735 3.843 5.831 1.00 0.00 C ATOM 1235 CE LYS A 76 15.891 4.582 6.508 1.00 0.00 C ATOM 1236 NZ LYS A 76 16.951 3.607 6.888 1.00 0.00 N ATOM 0 H LYS A 76 15.931 2.683 1.050 1.00 0.00 H new ATOM 0 HA LYS A 76 14.144 3.612 2.064 1.00 0.00 H new ATOM 0 HB2 LYS A 76 16.391 4.959 3.585 1.00 0.00 H new ATOM 0 HB3 LYS A 76 14.736 5.444 3.897 1.00 0.00 H new ATOM 0 HG2 LYS A 76 14.407 2.731 4.004 1.00 0.00 H new ATOM 0 HG3 LYS A 76 16.089 2.820 4.488 1.00 0.00 H new ATOM 0 HD2 LYS A 76 13.864 4.494 5.764 1.00 0.00 H new ATOM 0 HD3 LYS A 76 14.442 2.980 6.429 1.00 0.00 H new ATOM 0 HE2 LYS A 76 16.300 5.335 5.834 1.00 0.00 H new ATOM 0 HE3 LYS A 76 15.532 5.108 7.393 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 17.587 4.041 7.587 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 16.511 2.759 7.299 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 17.495 3.339 6.043 1.00 0.00 H new ATOM 1250 N LEU A 77 14.183 5.514 0.134 1.00 0.00 N ATOM 1251 CA LEU A 77 13.754 6.746 -0.581 1.00 0.00 C ATOM 1252 C LEU A 77 12.234 6.871 -0.466 1.00 0.00 C ATOM 1253 O LEU A 77 11.610 7.649 -1.159 1.00 0.00 O ATOM 1254 CB LEU A 77 14.180 6.668 -2.051 1.00 0.00 C ATOM 1255 CG LEU A 77 15.715 6.683 -2.128 1.00 0.00 C ATOM 1256 CD1 LEU A 77 16.212 5.958 -3.389 1.00 0.00 C ATOM 1257 CD2 LEU A 77 16.203 8.137 -2.156 1.00 0.00 C ATOM 0 H LEU A 77 14.128 4.652 -0.408 1.00 0.00 H new ATOM 0 HA LEU A 77 14.224 7.623 -0.137 1.00 0.00 H new ATOM 0 HB2 LEU A 77 13.789 5.759 -2.509 1.00 0.00 H new ATOM 0 HB3 LEU A 77 13.767 7.509 -2.608 1.00 0.00 H new ATOM 0 HG LEU A 77 16.111 6.166 -1.254 1.00 0.00 H new ATOM 0 HD11 LEU A 77 17.301 5.984 -3.418 1.00 0.00 H new ATOM 0 HD12 LEU A 77 15.874 4.922 -3.370 1.00 0.00 H new ATOM 0 HD13 LEU A 77 15.814 6.453 -4.274 1.00 0.00 H new ATOM 0 HD21 LEU A 77 17.291 8.154 -2.211 1.00 0.00 H new ATOM 0 HD22 LEU A 77 15.788 8.643 -3.027 1.00 0.00 H new ATOM 0 HD23 LEU A 77 15.877 8.648 -1.250 1.00 0.00 H new ATOM 1269 N TRP A 78 11.633 6.114 0.423 1.00 0.00 N ATOM 1270 CA TRP A 78 10.157 6.203 0.593 1.00 0.00 C ATOM 1271 C TRP A 78 9.792 7.614 1.024 1.00 0.00 C ATOM 1272 O TRP A 78 8.824 8.172 0.565 1.00 0.00 O ATOM 1273 CB TRP A 78 9.670 5.219 1.659 1.00 0.00 C ATOM 1274 CG TRP A 78 9.848 3.824 1.164 1.00 0.00 C ATOM 1275 CD1 TRP A 78 10.791 2.961 1.598 1.00 0.00 C ATOM 1276 CD2 TRP A 78 9.082 3.118 0.149 1.00 0.00 C ATOM 1277 NE1 TRP A 78 10.653 1.767 0.918 1.00 0.00 N ATOM 1278 CE2 TRP A 78 9.613 1.813 0.014 1.00 0.00 C ATOM 1279 CE3 TRP A 78 7.987 3.475 -0.659 1.00 0.00 C ATOM 1280 CZ2 TRP A 78 9.079 0.897 -0.889 1.00 0.00 C ATOM 1281 CZ3 TRP A 78 7.451 2.555 -1.569 1.00 0.00 C ATOM 1282 CH2 TRP A 78 7.992 1.272 -1.684 1.00 0.00 C ATOM 0 H TRP A 78 12.102 5.444 1.032 1.00 0.00 H new ATOM 0 HA TRP A 78 9.682 5.956 -0.356 1.00 0.00 H new ATOM 0 HB2 TRP A 78 10.228 5.362 2.584 1.00 0.00 H new ATOM 0 HB3 TRP A 78 8.621 5.404 1.888 1.00 0.00 H new ATOM 0 HD1 TRP A 78 11.533 3.170 2.354 1.00 0.00 H new ATOM 0 HE1 TRP A 78 11.247 0.951 1.066 1.00 0.00 H new ATOM 0 HE3 TRP A 78 7.558 4.463 -0.577 1.00 0.00 H new ATOM 0 HZ2 TRP A 78 9.501 -0.094 -0.974 1.00 0.00 H new ATOM 0 HZ3 TRP A 78 6.612 2.840 -2.187 1.00 0.00 H new ATOM 0 HH2 TRP A 78 7.570 0.570 -2.388 1.00 0.00 H new ATOM 1293 N GLN A 79 10.560 8.221 1.889 1.00 0.00 N ATOM 1294 CA GLN A 79 10.209 9.605 2.303 1.00 0.00 C ATOM 1295 C GLN A 79 9.922 10.425 1.050 1.00 0.00 C ATOM 1296 O GLN A 79 9.007 11.224 1.015 1.00 0.00 O ATOM 1297 CB GLN A 79 11.375 10.220 3.074 1.00 0.00 C ATOM 1298 CG GLN A 79 11.554 9.465 4.391 1.00 0.00 C ATOM 1299 CD GLN A 79 12.726 10.057 5.167 1.00 0.00 C ATOM 1300 OE1 GLN A 79 13.019 11.231 5.053 1.00 0.00 O ATOM 1301 NE2 GLN A 79 13.414 9.284 5.954 1.00 0.00 N ATOM 0 H GLN A 79 11.397 7.827 2.318 1.00 0.00 H new ATOM 0 HA GLN A 79 9.330 9.595 2.948 1.00 0.00 H new ATOM 0 HB2 GLN A 79 12.288 10.166 2.482 1.00 0.00 H new ATOM 0 HB3 GLN A 79 11.183 11.275 3.268 1.00 0.00 H new ATOM 0 HG2 GLN A 79 10.642 9.529 4.985 1.00 0.00 H new ATOM 0 HG3 GLN A 79 11.732 8.408 4.194 1.00 0.00 H new ATOM 0 HE21 GLN A 79 13.165 8.299 6.047 1.00 0.00 H new ATOM 0 HE22 GLN A 79 14.203 9.662 6.478 1.00 0.00 H new ATOM 1310 N GLU A 80 10.677 10.213 0.008 1.00 0.00 N ATOM 1311 CA GLU A 80 10.416 10.960 -1.248 1.00 0.00 C ATOM 1312 C GLU A 80 9.077 10.480 -1.814 1.00 0.00 C ATOM 1313 O GLU A 80 8.285 11.253 -2.318 1.00 0.00 O ATOM 1314 CB GLU A 80 11.532 10.681 -2.256 1.00 0.00 C ATOM 1315 CG GLU A 80 12.866 11.189 -1.703 1.00 0.00 C ATOM 1316 CD GLU A 80 12.797 12.703 -1.499 1.00 0.00 C ATOM 1317 OE1 GLU A 80 11.934 13.323 -2.097 1.00 0.00 O ATOM 1318 OE2 GLU A 80 13.610 13.216 -0.750 1.00 0.00 O ATOM 0 H GLU A 80 11.458 9.558 -0.026 1.00 0.00 H new ATOM 0 HA GLU A 80 10.383 12.032 -1.052 1.00 0.00 H new ATOM 0 HB2 GLU A 80 11.594 9.612 -2.457 1.00 0.00 H new ATOM 0 HB3 GLU A 80 11.310 11.171 -3.204 1.00 0.00 H new ATOM 0 HG2 GLU A 80 13.090 10.695 -0.758 1.00 0.00 H new ATOM 0 HG3 GLU A 80 13.674 10.942 -2.392 1.00 0.00 H new ATOM 1325 N ILE A 81 8.812 9.200 -1.711 1.00 0.00 N ATOM 1326 CA ILE A 81 7.519 8.655 -2.215 1.00 0.00 C ATOM 1327 C ILE A 81 6.405 9.056 -1.247 1.00 0.00 C ATOM 1328 O ILE A 81 5.389 9.594 -1.637 1.00 0.00 O ATOM 1329 CB ILE A 81 7.601 7.131 -2.296 1.00 0.00 C ATOM 1330 CG1 ILE A 81 8.823 6.748 -3.139 1.00 0.00 C ATOM 1331 CG2 ILE A 81 6.325 6.580 -2.946 1.00 0.00 C ATOM 1332 CD1 ILE A 81 8.677 5.318 -3.658 1.00 0.00 C ATOM 0 H ILE A 81 9.439 8.510 -1.298 1.00 0.00 H new ATOM 0 HA ILE A 81 7.311 9.054 -3.208 1.00 0.00 H new ATOM 0 HB ILE A 81 7.697 6.709 -1.296 1.00 0.00 H new ATOM 0 HG12 ILE A 81 8.927 7.438 -3.976 1.00 0.00 H new ATOM 0 HG13 ILE A 81 9.729 6.835 -2.540 1.00 0.00 H new ATOM 0 HG21 ILE A 81 6.386 5.493 -3.003 1.00 0.00 H new ATOM 0 HG22 ILE A 81 5.460 6.864 -2.347 1.00 0.00 H new ATOM 0 HG23 ILE A 81 6.222 6.991 -3.950 1.00 0.00 H new ATOM 0 HD11 ILE A 81 9.551 5.057 -4.255 1.00 0.00 H new ATOM 0 HD12 ILE A 81 8.595 4.632 -2.815 1.00 0.00 H new ATOM 0 HD13 ILE A 81 7.781 5.244 -4.274 1.00 0.00 H new ATOM 1344 N ILE A 82 6.596 8.792 0.019 1.00 0.00 N ATOM 1345 CA ILE A 82 5.560 9.148 1.024 1.00 0.00 C ATOM 1346 C ILE A 82 5.195 10.622 0.843 1.00 0.00 C ATOM 1347 O ILE A 82 4.048 10.967 0.632 1.00 0.00 O ATOM 1348 CB ILE A 82 6.136 8.930 2.432 1.00 0.00 C ATOM 1349 CG1 ILE A 82 6.604 7.475 2.579 1.00 0.00 C ATOM 1350 CG2 ILE A 82 5.060 9.217 3.483 1.00 0.00 C ATOM 1351 CD1 ILE A 82 7.539 7.332 3.796 1.00 0.00 C ATOM 0 H ILE A 82 7.430 8.343 0.398 1.00 0.00 H new ATOM 0 HA ILE A 82 4.673 8.528 0.894 1.00 0.00 H new ATOM 0 HB ILE A 82 6.979 9.605 2.578 1.00 0.00 H new ATOM 0 HG12 ILE A 82 5.741 6.819 2.696 1.00 0.00 H new ATOM 0 HG13 ILE A 82 7.124 7.160 1.674 1.00 0.00 H new ATOM 0 HG21 ILE A 82 5.474 9.061 4.479 1.00 0.00 H new ATOM 0 HG22 ILE A 82 4.724 10.250 3.387 1.00 0.00 H new ATOM 0 HG23 ILE A 82 4.215 8.545 3.332 1.00 0.00 H new ATOM 0 HD11 ILE A 82 7.862 6.295 3.887 1.00 0.00 H new ATOM 0 HD12 ILE A 82 8.410 7.973 3.663 1.00 0.00 H new ATOM 0 HD13 ILE A 82 7.007 7.627 4.700 1.00 0.00 H new ATOM 1363 N LYS A 83 6.166 11.493 0.908 1.00 0.00 N ATOM 1364 CA LYS A 83 5.882 12.942 0.722 1.00 0.00 C ATOM 1365 C LYS A 83 5.572 13.218 -0.757 1.00 0.00 C ATOM 1366 O LYS A 83 4.735 14.036 -1.084 1.00 0.00 O ATOM 1367 CB LYS A 83 7.098 13.764 1.160 1.00 0.00 C ATOM 1368 CG LYS A 83 7.345 13.550 2.655 1.00 0.00 C ATOM 1369 CD LYS A 83 8.497 14.443 3.122 1.00 0.00 C ATOM 1370 CE LYS A 83 8.845 14.108 4.574 1.00 0.00 C ATOM 1371 NZ LYS A 83 9.436 12.741 4.643 1.00 0.00 N ATOM 0 H LYS A 83 7.144 11.262 1.082 1.00 0.00 H new ATOM 0 HA LYS A 83 5.022 13.225 1.329 1.00 0.00 H new ATOM 0 HB2 LYS A 83 7.977 13.466 0.589 1.00 0.00 H new ATOM 0 HB3 LYS A 83 6.929 14.821 0.956 1.00 0.00 H new ATOM 0 HG2 LYS A 83 6.441 13.781 3.219 1.00 0.00 H new ATOM 0 HG3 LYS A 83 7.582 12.504 2.848 1.00 0.00 H new ATOM 0 HD2 LYS A 83 9.368 14.294 2.484 1.00 0.00 H new ATOM 0 HD3 LYS A 83 8.215 15.493 3.037 1.00 0.00 H new ATOM 0 HE2 LYS A 83 9.550 14.840 4.968 1.00 0.00 H new ATOM 0 HE3 LYS A 83 7.950 14.160 5.195 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 8.857 12.144 5.268 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 9.460 12.325 3.690 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 10.404 12.800 5.019 1.00 0.00 H new ATOM 1385 N GLY A 84 6.252 12.545 -1.652 1.00 0.00 N ATOM 1386 CA GLY A 84 6.008 12.774 -3.107 1.00 0.00 C ATOM 1387 C GLY A 84 4.514 12.652 -3.403 1.00 0.00 C ATOM 1388 O GLY A 84 3.976 13.350 -4.240 1.00 0.00 O ATOM 0 H GLY A 84 6.965 11.848 -1.437 1.00 0.00 H new ATOM 0 HA2 GLY A 84 6.366 13.762 -3.395 1.00 0.00 H new ATOM 0 HA3 GLY A 84 6.566 12.048 -3.698 1.00 0.00 H new ATOM 1392 N LEU A 85 3.839 11.778 -2.714 1.00 0.00 N ATOM 1393 CA LEU A 85 2.375 11.615 -2.940 1.00 0.00 C ATOM 1394 C LEU A 85 1.618 12.533 -1.983 1.00 0.00 C ATOM 1395 O LEU A 85 0.409 12.633 -2.031 1.00 0.00 O ATOM 1396 CB LEU A 85 1.985 10.170 -2.659 1.00 0.00 C ATOM 1397 CG LEU A 85 2.804 9.233 -3.550 1.00 0.00 C ATOM 1398 CD1 LEU A 85 2.456 7.779 -3.220 1.00 0.00 C ATOM 1399 CD2 LEU A 85 2.480 9.513 -5.020 1.00 0.00 C ATOM 0 H LEU A 85 4.238 11.167 -2.001 1.00 0.00 H new ATOM 0 HA LEU A 85 2.128 11.870 -3.971 1.00 0.00 H new ATOM 0 HB2 LEU A 85 2.159 9.934 -1.609 1.00 0.00 H new ATOM 0 HB3 LEU A 85 0.921 10.027 -2.846 1.00 0.00 H new ATOM 0 HG LEU A 85 3.866 9.402 -3.373 1.00 0.00 H new ATOM 0 HD11 LEU A 85 3.039 7.112 -3.855 1.00 0.00 H new ATOM 0 HD12 LEU A 85 2.687 7.578 -2.174 1.00 0.00 H new ATOM 0 HD13 LEU A 85 1.394 7.610 -3.396 1.00 0.00 H new ATOM 0 HD21 LEU A 85 3.063 8.846 -5.655 1.00 0.00 H new ATOM 0 HD22 LEU A 85 1.418 9.345 -5.197 1.00 0.00 H new ATOM 0 HD23 LEU A 85 2.728 10.548 -5.257 1.00 0.00 H new ATOM 1411 N HIS A 86 2.329 13.190 -1.108 1.00 0.00 N ATOM 1412 CA HIS A 86 1.681 14.104 -0.123 1.00 0.00 C ATOM 1413 C HIS A 86 0.811 13.282 0.827 1.00 0.00 C ATOM 1414 O HIS A 86 -0.260 13.693 1.227 1.00 0.00 O ATOM 1415 CB HIS A 86 0.829 15.147 -0.849 1.00 0.00 C ATOM 1416 CG HIS A 86 1.632 15.762 -1.962 1.00 0.00 C ATOM 1417 ND1 HIS A 86 2.536 16.787 -1.734 1.00 0.00 N ATOM 1418 CD2 HIS A 86 1.683 15.510 -3.312 1.00 0.00 C ATOM 1419 CE1 HIS A 86 3.086 17.113 -2.917 1.00 0.00 C ATOM 1420 NE2 HIS A 86 2.602 16.366 -3.913 1.00 0.00 N ATOM 0 H HIS A 86 3.345 13.132 -1.032 1.00 0.00 H new ATOM 0 HA HIS A 86 2.450 14.625 0.447 1.00 0.00 H new ATOM 0 HB2 HIS A 86 -0.072 14.682 -1.250 1.00 0.00 H new ATOM 0 HB3 HIS A 86 0.505 15.918 -0.150 1.00 0.00 H new ATOM 0 HD2 HIS A 86 1.099 14.762 -3.828 1.00 0.00 H new ATOM 0 HE1 HIS A 86 3.829 17.886 -3.046 1.00 0.00 H new ATOM 0 HE2 HIS A 86 2.852 16.413 -4.901 1.00 0.00 H new ATOM 1428 N LEU A 87 1.288 12.127 1.205 1.00 0.00 N ATOM 1429 CA LEU A 87 0.526 11.267 2.152 1.00 0.00 C ATOM 1430 C LEU A 87 0.601 11.876 3.562 1.00 0.00 C ATOM 1431 O LEU A 87 1.607 12.448 3.933 1.00 0.00 O ATOM 1432 CB LEU A 87 1.139 9.865 2.167 1.00 0.00 C ATOM 1433 CG LEU A 87 0.681 9.092 0.927 1.00 0.00 C ATOM 1434 CD1 LEU A 87 1.711 8.016 0.585 1.00 0.00 C ATOM 1435 CD2 LEU A 87 -0.671 8.427 1.200 1.00 0.00 C ATOM 0 H LEU A 87 2.180 11.741 0.895 1.00 0.00 H new ATOM 0 HA LEU A 87 -0.516 11.205 1.837 1.00 0.00 H new ATOM 0 HB2 LEU A 87 2.227 9.933 2.185 1.00 0.00 H new ATOM 0 HB3 LEU A 87 0.838 9.335 3.071 1.00 0.00 H new ATOM 0 HG LEU A 87 0.582 9.785 0.091 1.00 0.00 H new ATOM 0 HD11 LEU A 87 1.384 7.467 -0.298 1.00 0.00 H new ATOM 0 HD12 LEU A 87 2.674 8.485 0.384 1.00 0.00 H new ATOM 0 HD13 LEU A 87 1.811 7.328 1.424 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -0.992 7.878 0.314 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -0.575 7.738 2.039 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -1.410 9.191 1.441 1.00 0.00 H new ATOM 1447 N PRO A 88 -0.439 11.752 4.351 1.00 0.00 N ATOM 1448 CA PRO A 88 -0.455 12.298 5.743 1.00 0.00 C ATOM 1449 C PRO A 88 0.457 11.507 6.693 1.00 0.00 C ATOM 1450 O PRO A 88 0.480 10.292 6.678 1.00 0.00 O ATOM 1451 CB PRO A 88 -1.918 12.169 6.177 1.00 0.00 C ATOM 1452 CG PRO A 88 -2.503 11.097 5.316 1.00 0.00 C ATOM 1453 CD PRO A 88 -1.707 11.085 4.011 1.00 0.00 C ATOM 0 HA PRO A 88 -0.082 13.322 5.774 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -1.991 11.907 7.232 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -2.450 13.111 6.045 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -2.443 10.129 5.813 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -3.558 11.291 5.122 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -1.539 10.068 3.657 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -2.235 11.615 3.218 1.00 0.00 H new ATOM 1461 N SER A 89 1.206 12.188 7.519 1.00 0.00 N ATOM 1462 CA SER A 89 2.114 11.483 8.472 1.00 0.00 C ATOM 1463 C SER A 89 1.296 10.627 9.444 1.00 0.00 C ATOM 1464 O SER A 89 1.838 9.980 10.319 1.00 0.00 O ATOM 1465 CB SER A 89 2.923 12.511 9.261 1.00 0.00 C ATOM 1466 OG SER A 89 3.706 11.840 10.240 1.00 0.00 O ATOM 0 H SER A 89 1.228 13.206 7.575 1.00 0.00 H new ATOM 0 HA SER A 89 2.788 10.838 7.908 1.00 0.00 H new ATOM 0 HB2 SER A 89 3.567 13.078 8.589 1.00 0.00 H new ATOM 0 HB3 SER A 89 2.255 13.226 9.741 1.00 0.00 H new ATOM 0 HG SER A 89 3.257 11.010 10.505 1.00 0.00 H new ATOM 1472 N SER A 90 -0.004 10.640 9.325 1.00 0.00 N ATOM 1473 CA SER A 90 -0.837 9.848 10.274 1.00 0.00 C ATOM 1474 C SER A 90 -0.549 8.358 10.087 1.00 0.00 C ATOM 1475 O SER A 90 -0.699 7.569 11.000 1.00 0.00 O ATOM 1476 CB SER A 90 -2.317 10.115 10.000 1.00 0.00 C ATOM 1477 OG SER A 90 -2.679 9.519 8.759 1.00 0.00 O ATOM 0 H SER A 90 -0.522 11.161 8.617 1.00 0.00 H new ATOM 0 HA SER A 90 -0.596 10.140 11.296 1.00 0.00 H new ATOM 0 HB2 SER A 90 -2.928 9.706 10.805 1.00 0.00 H new ATOM 0 HB3 SER A 90 -2.506 11.188 9.970 1.00 0.00 H new ATOM 0 HG SER A 90 -3.628 9.686 8.580 1.00 0.00 H new ATOM 1483 N ILE A 91 -0.110 7.964 8.925 1.00 0.00 N ATOM 1484 CA ILE A 91 0.211 6.526 8.709 1.00 0.00 C ATOM 1485 C ILE A 91 1.699 6.306 8.993 1.00 0.00 C ATOM 1486 O ILE A 91 2.547 6.580 8.167 1.00 0.00 O ATOM 1487 CB ILE A 91 -0.103 6.144 7.261 1.00 0.00 C ATOM 1488 CG1 ILE A 91 -1.596 6.362 6.990 1.00 0.00 C ATOM 1489 CG2 ILE A 91 0.251 4.673 7.025 1.00 0.00 C ATOM 1490 CD1 ILE A 91 -1.929 6.011 5.532 1.00 0.00 C ATOM 0 H ILE A 91 0.040 8.571 8.119 1.00 0.00 H new ATOM 0 HA ILE A 91 -0.387 5.905 9.377 1.00 0.00 H new ATOM 0 HB ILE A 91 0.486 6.767 6.587 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -2.189 5.745 7.665 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -1.862 7.400 7.191 1.00 0.00 H new ATOM 0 HG21 ILE A 91 0.026 4.406 5.993 1.00 0.00 H new ATOM 0 HG22 ILE A 91 1.313 4.519 7.216 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -0.333 4.046 7.698 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -2.992 6.170 5.353 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -1.349 6.647 4.863 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -1.682 4.966 5.344 1.00 0.00 H new ATOM 1502 N THR A 92 2.026 5.815 10.159 1.00 0.00 N ATOM 1503 CA THR A 92 3.460 5.580 10.494 1.00 0.00 C ATOM 1504 C THR A 92 3.989 4.442 9.626 1.00 0.00 C ATOM 1505 O THR A 92 5.148 4.404 9.262 1.00 0.00 O ATOM 1506 CB THR A 92 3.578 5.198 11.970 1.00 0.00 C ATOM 1507 OG1 THR A 92 2.985 3.923 12.175 1.00 0.00 O ATOM 1508 CG2 THR A 92 2.856 6.242 12.825 1.00 0.00 C ATOM 0 H THR A 92 1.362 5.567 10.893 1.00 0.00 H new ATOM 0 HA THR A 92 4.040 6.484 10.309 1.00 0.00 H new ATOM 0 HB THR A 92 4.629 5.160 12.255 1.00 0.00 H new ATOM 0 HG1 THR A 92 3.061 3.675 13.120 1.00 0.00 H new ATOM 0 HG21 THR A 92 2.939 5.971 13.877 1.00 0.00 H new ATOM 0 HG22 THR A 92 3.310 7.220 12.665 1.00 0.00 H new ATOM 0 HG23 THR A 92 1.804 6.280 12.542 1.00 0.00 H new ATOM 1516 N SER A 93 3.137 3.520 9.283 1.00 0.00 N ATOM 1517 CA SER A 93 3.558 2.380 8.427 1.00 0.00 C ATOM 1518 C SER A 93 3.394 2.787 6.962 1.00 0.00 C ATOM 1519 O SER A 93 3.142 1.966 6.104 1.00 0.00 O ATOM 1520 CB SER A 93 2.671 1.171 8.725 1.00 0.00 C ATOM 1521 OG SER A 93 2.820 0.809 10.092 1.00 0.00 O ATOM 0 H SER A 93 2.156 3.508 9.562 1.00 0.00 H new ATOM 0 HA SER A 93 4.598 2.121 8.627 1.00 0.00 H new ATOM 0 HB2 SER A 93 1.629 1.407 8.510 1.00 0.00 H new ATOM 0 HB3 SER A 93 2.947 0.335 8.083 1.00 0.00 H new ATOM 0 HG SER A 93 2.252 0.035 10.289 1.00 0.00 H new ATOM 1527 N ALA A 94 3.522 4.056 6.674 1.00 0.00 N ATOM 1528 CA ALA A 94 3.356 4.513 5.268 1.00 0.00 C ATOM 1529 C ALA A 94 4.383 3.803 4.391 1.00 0.00 C ATOM 1530 O ALA A 94 4.044 2.995 3.550 1.00 0.00 O ATOM 1531 CB ALA A 94 3.583 6.025 5.193 1.00 0.00 C ATOM 0 H ALA A 94 3.733 4.790 7.350 1.00 0.00 H new ATOM 0 HA ALA A 94 2.349 4.281 4.921 1.00 0.00 H new ATOM 0 HB1 ALA A 94 3.462 6.361 4.163 1.00 0.00 H new ATOM 0 HB2 ALA A 94 2.858 6.534 5.828 1.00 0.00 H new ATOM 0 HB3 ALA A 94 4.591 6.259 5.534 1.00 0.00 H new ATOM 1537 N ALA A 95 5.637 4.100 4.580 1.00 0.00 N ATOM 1538 CA ALA A 95 6.681 3.435 3.749 1.00 0.00 C ATOM 1539 C ALA A 95 6.412 1.928 3.739 1.00 0.00 C ATOM 1540 O ALA A 95 6.416 1.298 2.699 1.00 0.00 O ATOM 1541 CB ALA A 95 8.063 3.708 4.346 1.00 0.00 C ATOM 0 H ALA A 95 5.984 4.769 5.268 1.00 0.00 H new ATOM 0 HA ALA A 95 6.651 3.824 2.731 1.00 0.00 H new ATOM 0 HB1 ALA A 95 8.825 3.221 3.737 1.00 0.00 H new ATOM 0 HB2 ALA A 95 8.245 4.782 4.365 1.00 0.00 H new ATOM 0 HB3 ALA A 95 8.105 3.315 5.362 1.00 0.00 H new ATOM 1547 N LEU A 96 6.173 1.344 4.884 1.00 0.00 N ATOM 1548 CA LEU A 96 5.898 -0.121 4.931 1.00 0.00 C ATOM 1549 C LEU A 96 4.663 -0.431 4.087 1.00 0.00 C ATOM 1550 O LEU A 96 4.654 -1.360 3.305 1.00 0.00 O ATOM 1551 CB LEU A 96 5.609 -0.529 6.375 1.00 0.00 C ATOM 1552 CG LEU A 96 5.379 -2.047 6.467 1.00 0.00 C ATOM 1553 CD1 LEU A 96 6.698 -2.763 6.755 1.00 0.00 C ATOM 1554 CD2 LEU A 96 4.396 -2.336 7.593 1.00 0.00 C ATOM 0 H LEU A 96 6.157 1.818 5.787 1.00 0.00 H new ATOM 0 HA LEU A 96 6.761 -0.665 4.548 1.00 0.00 H new ATOM 0 HB2 LEU A 96 6.443 -0.242 7.015 1.00 0.00 H new ATOM 0 HB3 LEU A 96 4.730 0.001 6.741 1.00 0.00 H new ATOM 0 HG LEU A 96 4.978 -2.406 5.519 1.00 0.00 H new ATOM 0 HD11 LEU A 96 6.523 -3.837 6.818 1.00 0.00 H new ATOM 0 HD12 LEU A 96 7.406 -2.557 5.953 1.00 0.00 H new ATOM 0 HD13 LEU A 96 7.107 -2.406 7.700 1.00 0.00 H new ATOM 0 HD21 LEU A 96 4.229 -3.411 7.663 1.00 0.00 H new ATOM 0 HD22 LEU A 96 4.804 -1.970 8.535 1.00 0.00 H new ATOM 0 HD23 LEU A 96 3.450 -1.834 7.388 1.00 0.00 H new ATOM 1566 N THR A 97 3.619 0.341 4.227 1.00 0.00 N ATOM 1567 CA THR A 97 2.402 0.083 3.419 1.00 0.00 C ATOM 1568 C THR A 97 2.757 0.229 1.945 1.00 0.00 C ATOM 1569 O THR A 97 2.312 -0.528 1.106 1.00 0.00 O ATOM 1570 CB THR A 97 1.316 1.095 3.804 1.00 0.00 C ATOM 1571 OG1 THR A 97 0.892 0.847 5.136 1.00 0.00 O ATOM 1572 CG2 THR A 97 0.128 0.975 2.851 1.00 0.00 C ATOM 0 H THR A 97 3.560 1.135 4.864 1.00 0.00 H new ATOM 0 HA THR A 97 2.028 -0.924 3.605 1.00 0.00 H new ATOM 0 HB THR A 97 1.723 2.104 3.734 1.00 0.00 H new ATOM 0 HG1 THR A 97 1.571 1.175 5.762 1.00 0.00 H new ATOM 0 HG21 THR A 97 -0.638 1.697 3.132 1.00 0.00 H new ATOM 0 HG22 THR A 97 0.458 1.174 1.831 1.00 0.00 H new ATOM 0 HG23 THR A 97 -0.284 -0.032 2.909 1.00 0.00 H new ATOM 1580 N LEU A 98 3.565 1.200 1.626 1.00 0.00 N ATOM 1581 CA LEU A 98 3.962 1.402 0.221 1.00 0.00 C ATOM 1582 C LEU A 98 4.905 0.274 -0.218 1.00 0.00 C ATOM 1583 O LEU A 98 4.776 -0.266 -1.297 1.00 0.00 O ATOM 1584 CB LEU A 98 4.688 2.742 0.124 1.00 0.00 C ATOM 1585 CG LEU A 98 3.737 3.890 0.488 1.00 0.00 C ATOM 1586 CD1 LEU A 98 4.532 5.048 1.098 1.00 0.00 C ATOM 1587 CD2 LEU A 98 3.051 4.391 -0.780 1.00 0.00 C ATOM 0 H LEU A 98 3.966 1.863 2.289 1.00 0.00 H new ATOM 0 HA LEU A 98 3.084 1.396 -0.425 1.00 0.00 H new ATOM 0 HB2 LEU A 98 5.548 2.747 0.794 1.00 0.00 H new ATOM 0 HB3 LEU A 98 5.070 2.884 -0.887 1.00 0.00 H new ATOM 0 HG LEU A 98 2.999 3.530 1.205 1.00 0.00 H new ATOM 0 HD11 LEU A 98 3.852 5.861 1.355 1.00 0.00 H new ATOM 0 HD12 LEU A 98 5.043 4.705 1.997 1.00 0.00 H new ATOM 0 HD13 LEU A 98 5.267 5.404 0.377 1.00 0.00 H new ATOM 0 HD21 LEU A 98 2.373 5.207 -0.529 1.00 0.00 H new ATOM 0 HD22 LEU A 98 3.803 4.747 -1.484 1.00 0.00 H new ATOM 0 HD23 LEU A 98 2.486 3.577 -1.234 1.00 0.00 H new ATOM 1599 N ARG A 99 5.857 -0.081 0.606 1.00 0.00 N ATOM 1600 CA ARG A 99 6.813 -1.168 0.231 1.00 0.00 C ATOM 1601 C ARG A 99 6.091 -2.509 0.130 1.00 0.00 C ATOM 1602 O ARG A 99 6.228 -3.234 -0.835 1.00 0.00 O ATOM 1603 CB ARG A 99 7.899 -1.269 1.308 1.00 0.00 C ATOM 1604 CG ARG A 99 9.004 -2.233 0.853 1.00 0.00 C ATOM 1605 CD ARG A 99 8.721 -3.658 1.346 1.00 0.00 C ATOM 1606 NE ARG A 99 9.503 -3.905 2.583 1.00 0.00 N ATOM 1607 CZ ARG A 99 9.236 -4.946 3.321 1.00 0.00 C ATOM 1608 NH1 ARG A 99 8.279 -5.760 2.971 1.00 0.00 N ATOM 1609 NH2 ARG A 99 9.925 -5.179 4.405 1.00 0.00 N ATOM 0 H ARG A 99 6.014 0.335 1.524 1.00 0.00 H new ATOM 0 HA ARG A 99 7.254 -0.931 -0.737 1.00 0.00 H new ATOM 0 HB2 ARG A 99 8.322 -0.284 1.502 1.00 0.00 H new ATOM 0 HB3 ARG A 99 7.463 -1.619 2.244 1.00 0.00 H new ATOM 0 HG2 ARG A 99 9.073 -2.227 -0.235 1.00 0.00 H new ATOM 0 HG3 ARG A 99 9.967 -1.896 1.235 1.00 0.00 H new ATOM 0 HD2 ARG A 99 7.656 -3.784 1.542 1.00 0.00 H new ATOM 0 HD3 ARG A 99 8.992 -4.383 0.578 1.00 0.00 H new ATOM 0 HE ARG A 99 10.247 -3.262 2.855 1.00 0.00 H new ATOM 0 HH11 ARG A 99 7.742 -5.581 2.122 1.00 0.00 H new ATOM 0 HH12 ARG A 99 8.067 -6.575 3.546 1.00 0.00 H new ATOM 0 HH21 ARG A 99 10.676 -4.545 4.678 1.00 0.00 H new ATOM 0 HH22 ARG A 99 9.712 -5.995 4.979 1.00 0.00 H new ATOM 1623 N THR A 100 5.355 -2.857 1.143 1.00 0.00 N ATOM 1624 CA THR A 100 4.649 -4.165 1.146 1.00 0.00 C ATOM 1625 C THR A 100 3.728 -4.294 -0.070 1.00 0.00 C ATOM 1626 O THR A 100 3.801 -5.250 -0.819 1.00 0.00 O ATOM 1627 CB THR A 100 3.818 -4.251 2.429 1.00 0.00 C ATOM 1628 OG1 THR A 100 4.603 -3.796 3.522 1.00 0.00 O ATOM 1629 CG2 THR A 100 3.392 -5.694 2.686 1.00 0.00 C ATOM 0 H THR A 100 5.210 -2.287 1.977 1.00 0.00 H new ATOM 0 HA THR A 100 5.380 -4.972 1.101 1.00 0.00 H new ATOM 0 HB THR A 100 2.928 -3.631 2.320 1.00 0.00 H new ATOM 0 HG1 THR A 100 4.449 -2.838 3.659 1.00 0.00 H new ATOM 0 HG21 THR A 100 2.802 -5.742 3.601 1.00 0.00 H new ATOM 0 HG22 THR A 100 2.793 -6.051 1.849 1.00 0.00 H new ATOM 0 HG23 THR A 100 4.277 -6.321 2.792 1.00 0.00 H new ATOM 1637 N GLN A 101 2.843 -3.356 -0.263 1.00 0.00 N ATOM 1638 CA GLN A 101 1.903 -3.442 -1.415 1.00 0.00 C ATOM 1639 C GLN A 101 2.652 -3.410 -2.751 1.00 0.00 C ATOM 1640 O GLN A 101 2.322 -4.133 -3.668 1.00 0.00 O ATOM 1641 CB GLN A 101 0.924 -2.274 -1.343 1.00 0.00 C ATOM 1642 CG GLN A 101 0.102 -2.395 -0.058 1.00 0.00 C ATOM 1643 CD GLN A 101 -0.864 -1.216 0.052 1.00 0.00 C ATOM 1644 OE1 GLN A 101 -0.908 -0.366 -0.815 1.00 0.00 O ATOM 1645 NE2 GLN A 101 -1.642 -1.129 1.095 1.00 0.00 N ATOM 0 H GLN A 101 2.730 -2.533 0.328 1.00 0.00 H new ATOM 0 HA GLN A 101 1.366 -4.389 -1.357 1.00 0.00 H new ATOM 0 HB2 GLN A 101 1.465 -1.328 -1.357 1.00 0.00 H new ATOM 0 HB3 GLN A 101 0.267 -2.279 -2.213 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -0.453 -3.333 -0.058 1.00 0.00 H new ATOM 0 HG3 GLN A 101 0.764 -2.416 0.807 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -1.603 -1.844 1.821 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -2.290 -0.346 1.184 1.00 0.00 H new ATOM 1654 N TYR A 102 3.651 -2.585 -2.885 1.00 0.00 N ATOM 1655 CA TYR A 102 4.378 -2.534 -4.174 1.00 0.00 C ATOM 1656 C TYR A 102 4.916 -3.920 -4.505 1.00 0.00 C ATOM 1657 O TYR A 102 4.898 -4.361 -5.637 1.00 0.00 O ATOM 1658 CB TYR A 102 5.550 -1.564 -4.058 1.00 0.00 C ATOM 1659 CG TYR A 102 5.960 -1.126 -5.436 1.00 0.00 C ATOM 1660 CD1 TYR A 102 6.577 -2.027 -6.312 1.00 0.00 C ATOM 1661 CD2 TYR A 102 5.708 0.182 -5.839 1.00 0.00 C ATOM 1662 CE1 TYR A 102 6.943 -1.610 -7.596 1.00 0.00 C ATOM 1663 CE2 TYR A 102 6.070 0.602 -7.118 1.00 0.00 C ATOM 1664 CZ TYR A 102 6.688 -0.294 -8.001 1.00 0.00 C ATOM 1665 OH TYR A 102 7.049 0.121 -9.267 1.00 0.00 O ATOM 0 H TYR A 102 3.991 -1.950 -2.162 1.00 0.00 H new ATOM 0 HA TYR A 102 3.699 -2.202 -4.959 1.00 0.00 H new ATOM 0 HB2 TYR A 102 5.266 -0.700 -3.457 1.00 0.00 H new ATOM 0 HB3 TYR A 102 6.387 -2.044 -3.551 1.00 0.00 H new ATOM 0 HD1 TYR A 102 6.770 -3.042 -5.997 1.00 0.00 H new ATOM 0 HD2 TYR A 102 5.231 0.873 -5.160 1.00 0.00 H new ATOM 0 HE1 TYR A 102 7.421 -2.302 -8.274 1.00 0.00 H new ATOM 0 HE2 TYR A 102 5.874 1.618 -7.428 1.00 0.00 H new ATOM 0 HH TYR A 102 6.453 0.843 -9.557 1.00 0.00 H new ATOM 1675 N MET A 103 5.429 -4.588 -3.519 1.00 0.00 N ATOM 1676 CA MET A 103 6.017 -5.933 -3.739 1.00 0.00 C ATOM 1677 C MET A 103 5.020 -6.871 -4.436 1.00 0.00 C ATOM 1678 O MET A 103 5.339 -7.512 -5.416 1.00 0.00 O ATOM 1679 CB MET A 103 6.410 -6.515 -2.379 1.00 0.00 C ATOM 1680 CG MET A 103 7.452 -7.616 -2.576 1.00 0.00 C ATOM 1681 SD MET A 103 8.018 -8.217 -0.966 1.00 0.00 S ATOM 1682 CE MET A 103 9.249 -6.925 -0.657 1.00 0.00 C ATOM 0 H MET A 103 5.467 -4.256 -2.555 1.00 0.00 H new ATOM 0 HA MET A 103 6.890 -5.839 -4.385 1.00 0.00 H new ATOM 0 HB2 MET A 103 6.812 -5.730 -1.738 1.00 0.00 H new ATOM 0 HB3 MET A 103 5.531 -6.918 -1.876 1.00 0.00 H new ATOM 0 HG2 MET A 103 7.023 -8.437 -3.151 1.00 0.00 H new ATOM 0 HG3 MET A 103 8.296 -7.232 -3.149 1.00 0.00 H new ATOM 0 HE1 MET A 103 9.240 -6.659 0.400 1.00 0.00 H new ATOM 0 HE2 MET A 103 10.238 -7.292 -0.930 1.00 0.00 H new ATOM 0 HE3 MET A 103 9.011 -6.045 -1.254 1.00 0.00 H new ATOM 1692 N LYS A 104 3.837 -7.005 -3.907 1.00 0.00 N ATOM 1693 CA LYS A 104 2.853 -7.956 -4.512 1.00 0.00 C ATOM 1694 C LYS A 104 2.305 -7.465 -5.861 1.00 0.00 C ATOM 1695 O LYS A 104 2.289 -8.191 -6.836 1.00 0.00 O ATOM 1696 CB LYS A 104 1.656 -8.105 -3.572 1.00 0.00 C ATOM 1697 CG LYS A 104 2.128 -8.373 -2.144 1.00 0.00 C ATOM 1698 CD LYS A 104 0.903 -8.577 -1.248 1.00 0.00 C ATOM 1699 CE LYS A 104 1.332 -8.658 0.217 1.00 0.00 C ATOM 1700 NZ LYS A 104 1.681 -10.067 0.554 1.00 0.00 N ATOM 0 H LYS A 104 3.506 -6.501 -3.085 1.00 0.00 H new ATOM 0 HA LYS A 104 3.381 -8.897 -4.667 1.00 0.00 H new ATOM 0 HB2 LYS A 104 1.051 -7.199 -3.597 1.00 0.00 H new ATOM 0 HB3 LYS A 104 1.020 -8.923 -3.911 1.00 0.00 H new ATOM 0 HG2 LYS A 104 2.766 -9.256 -2.117 1.00 0.00 H new ATOM 0 HG3 LYS A 104 2.726 -7.537 -1.781 1.00 0.00 H new ATOM 0 HD2 LYS A 104 0.202 -7.754 -1.385 1.00 0.00 H new ATOM 0 HD3 LYS A 104 0.382 -9.491 -1.534 1.00 0.00 H new ATOM 0 HE2 LYS A 104 2.189 -8.008 0.393 1.00 0.00 H new ATOM 0 HE3 LYS A 104 0.527 -8.307 0.863 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 1.973 -10.123 1.551 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 0.852 -10.676 0.401 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 2.462 -10.386 -0.054 1.00 0.00 H new ATOM 1714 N TYR A 105 1.762 -6.279 -5.889 1.00 0.00 N ATOM 1715 CA TYR A 105 1.099 -5.775 -7.132 1.00 0.00 C ATOM 1716 C TYR A 105 2.040 -5.117 -8.163 1.00 0.00 C ATOM 1717 O TYR A 105 1.896 -5.351 -9.346 1.00 0.00 O ATOM 1718 CB TYR A 105 0.030 -4.761 -6.708 1.00 0.00 C ATOM 1719 CG TYR A 105 -0.926 -5.423 -5.739 1.00 0.00 C ATOM 1720 CD1 TYR A 105 -0.638 -5.437 -4.367 1.00 0.00 C ATOM 1721 CD2 TYR A 105 -2.090 -6.034 -6.211 1.00 0.00 C ATOM 1722 CE1 TYR A 105 -1.517 -6.061 -3.472 1.00 0.00 C ATOM 1723 CE2 TYR A 105 -2.970 -6.656 -5.317 1.00 0.00 C ATOM 1724 CZ TYR A 105 -2.683 -6.671 -3.947 1.00 0.00 C ATOM 1725 OH TYR A 105 -3.549 -7.288 -3.067 1.00 0.00 O ATOM 0 H TYR A 105 1.747 -5.631 -5.101 1.00 0.00 H new ATOM 0 HA TYR A 105 0.686 -6.646 -7.641 1.00 0.00 H new ATOM 0 HB2 TYR A 105 0.498 -3.894 -6.241 1.00 0.00 H new ATOM 0 HB3 TYR A 105 -0.512 -4.398 -7.582 1.00 0.00 H new ATOM 0 HD1 TYR A 105 0.262 -4.966 -4.000 1.00 0.00 H new ATOM 0 HD2 TYR A 105 -2.312 -6.027 -7.268 1.00 0.00 H new ATOM 0 HE1 TYR A 105 -1.294 -6.071 -2.415 1.00 0.00 H new ATOM 0 HE2 TYR A 105 -3.871 -7.125 -5.685 1.00 0.00 H new ATOM 0 HH TYR A 105 -4.309 -7.660 -3.562 1.00 0.00 H new ATOM 1735 N LEU A 106 2.940 -4.250 -7.769 1.00 0.00 N ATOM 1736 CA LEU A 106 3.783 -3.554 -8.806 1.00 0.00 C ATOM 1737 C LEU A 106 5.165 -4.189 -9.026 1.00 0.00 C ATOM 1738 O LEU A 106 5.872 -3.795 -9.932 1.00 0.00 O ATOM 1739 CB LEU A 106 3.967 -2.091 -8.402 1.00 0.00 C ATOM 1740 CG LEU A 106 2.682 -1.317 -8.700 1.00 0.00 C ATOM 1741 CD1 LEU A 106 1.548 -1.851 -7.820 1.00 0.00 C ATOM 1742 CD2 LEU A 106 2.900 0.172 -8.409 1.00 0.00 C ATOM 0 H LEU A 106 3.129 -3.994 -6.800 1.00 0.00 H new ATOM 0 HA LEU A 106 3.246 -3.649 -9.750 1.00 0.00 H new ATOM 0 HB2 LEU A 106 4.208 -2.023 -7.341 1.00 0.00 H new ATOM 0 HB3 LEU A 106 4.803 -1.654 -8.948 1.00 0.00 H new ATOM 0 HG LEU A 106 2.417 -1.445 -9.750 1.00 0.00 H new ATOM 0 HD11 LEU A 106 0.632 -1.299 -8.032 1.00 0.00 H new ATOM 0 HD12 LEU A 106 1.391 -2.909 -8.030 1.00 0.00 H new ATOM 0 HD13 LEU A 106 1.812 -1.725 -6.770 1.00 0.00 H new ATOM 0 HD21 LEU A 106 1.984 0.722 -8.622 1.00 0.00 H new ATOM 0 HD22 LEU A 106 3.166 0.303 -7.360 1.00 0.00 H new ATOM 0 HD23 LEU A 106 3.705 0.552 -9.038 1.00 0.00 H new ATOM 1754 N TYR A 107 5.584 -5.142 -8.246 1.00 0.00 N ATOM 1755 CA TYR A 107 6.942 -5.711 -8.510 1.00 0.00 C ATOM 1756 C TYR A 107 7.012 -6.261 -9.943 1.00 0.00 C ATOM 1757 O TYR A 107 8.022 -6.128 -10.605 1.00 0.00 O ATOM 1758 CB TYR A 107 7.294 -6.811 -7.502 1.00 0.00 C ATOM 1759 CG TYR A 107 8.780 -7.081 -7.566 1.00 0.00 C ATOM 1760 CD1 TYR A 107 9.691 -6.088 -7.182 1.00 0.00 C ATOM 1761 CD2 TYR A 107 9.247 -8.323 -8.011 1.00 0.00 C ATOM 1762 CE1 TYR A 107 11.067 -6.337 -7.246 1.00 0.00 C ATOM 1763 CE2 TYR A 107 10.624 -8.574 -8.074 1.00 0.00 C ATOM 1764 CZ TYR A 107 11.534 -7.580 -7.692 1.00 0.00 C ATOM 1765 OH TYR A 107 12.891 -7.826 -7.753 1.00 0.00 O ATOM 0 H TYR A 107 5.070 -5.544 -7.462 1.00 0.00 H new ATOM 0 HA TYR A 107 7.672 -4.909 -8.396 1.00 0.00 H new ATOM 0 HB2 TYR A 107 7.010 -6.504 -6.495 1.00 0.00 H new ATOM 0 HB3 TYR A 107 6.736 -7.720 -7.727 1.00 0.00 H new ATOM 0 HD1 TYR A 107 9.331 -5.130 -6.836 1.00 0.00 H new ATOM 0 HD2 TYR A 107 8.545 -9.089 -8.306 1.00 0.00 H new ATOM 0 HE1 TYR A 107 11.769 -5.571 -6.951 1.00 0.00 H new ATOM 0 HE2 TYR A 107 10.983 -9.533 -8.417 1.00 0.00 H new ATOM 0 HH TYR A 107 13.349 -7.305 -7.061 1.00 0.00 H new ATOM 1775 N PRO A 108 5.956 -6.875 -10.428 1.00 0.00 N ATOM 1776 CA PRO A 108 5.923 -7.450 -11.813 1.00 0.00 C ATOM 1777 C PRO A 108 6.031 -6.372 -12.910 1.00 0.00 C ATOM 1778 O PRO A 108 6.889 -6.432 -13.769 1.00 0.00 O ATOM 1779 CB PRO A 108 4.562 -8.169 -11.875 1.00 0.00 C ATOM 1780 CG PRO A 108 4.132 -8.326 -10.456 1.00 0.00 C ATOM 1781 CD PRO A 108 4.677 -7.105 -9.732 1.00 0.00 C ATOM 0 HA PRO A 108 6.771 -8.110 -11.997 1.00 0.00 H new ATOM 0 HB2 PRO A 108 3.836 -7.588 -12.443 1.00 0.00 H new ATOM 0 HB3 PRO A 108 4.651 -9.137 -12.368 1.00 0.00 H new ATOM 0 HG2 PRO A 108 3.046 -8.377 -10.378 1.00 0.00 H new ATOM 0 HG3 PRO A 108 4.526 -9.247 -10.026 1.00 0.00 H new ATOM 0 HD2 PRO A 108 4.008 -6.249 -9.817 1.00 0.00 H new ATOM 0 HD3 PRO A 108 4.821 -7.293 -8.668 1.00 0.00 H new ATOM 1789 N TYR A 109 5.173 -5.390 -12.880 1.00 0.00 N ATOM 1790 CA TYR A 109 5.217 -4.301 -13.904 1.00 0.00 C ATOM 1791 C TYR A 109 6.599 -3.634 -13.852 1.00 0.00 C ATOM 1792 O TYR A 109 7.209 -3.369 -14.868 1.00 0.00 O ATOM 1793 CB TYR A 109 4.127 -3.266 -13.571 1.00 0.00 C ATOM 1794 CG TYR A 109 3.750 -2.434 -14.789 1.00 0.00 C ATOM 1795 CD1 TYR A 109 4.705 -1.630 -15.427 1.00 0.00 C ATOM 1796 CD2 TYR A 109 2.428 -2.454 -15.264 1.00 0.00 C ATOM 1797 CE1 TYR A 109 4.338 -0.855 -16.538 1.00 0.00 C ATOM 1798 CE2 TYR A 109 2.062 -1.675 -16.373 1.00 0.00 C ATOM 1799 CZ TYR A 109 3.019 -0.878 -17.009 1.00 0.00 C ATOM 1800 OH TYR A 109 2.661 -0.109 -18.098 1.00 0.00 O ATOM 0 H TYR A 109 4.434 -5.292 -12.183 1.00 0.00 H new ATOM 0 HA TYR A 109 5.043 -4.705 -14.901 1.00 0.00 H new ATOM 0 HB2 TYR A 109 3.243 -3.778 -13.192 1.00 0.00 H new ATOM 0 HB3 TYR A 109 4.480 -2.609 -12.776 1.00 0.00 H new ATOM 0 HD1 TYR A 109 5.722 -1.607 -15.064 1.00 0.00 H new ATOM 0 HD2 TYR A 109 1.690 -3.071 -14.774 1.00 0.00 H new ATOM 0 HE1 TYR A 109 5.075 -0.239 -17.031 1.00 0.00 H new ATOM 0 HE2 TYR A 109 1.044 -1.691 -16.734 1.00 0.00 H new ATOM 0 HH TYR A 109 2.488 -0.691 -18.867 1.00 0.00 H new ATOM 1810 N GLU A 110 7.094 -3.365 -12.671 1.00 0.00 N ATOM 1811 CA GLU A 110 8.437 -2.716 -12.541 1.00 0.00 C ATOM 1812 C GLU A 110 9.536 -3.656 -13.036 1.00 0.00 C ATOM 1813 O GLU A 110 10.354 -3.296 -13.854 1.00 0.00 O ATOM 1814 CB GLU A 110 8.709 -2.415 -11.062 1.00 0.00 C ATOM 1815 CG GLU A 110 10.067 -1.718 -10.921 1.00 0.00 C ATOM 1816 CD GLU A 110 10.356 -1.449 -9.444 1.00 0.00 C ATOM 1817 OE1 GLU A 110 9.661 -2.006 -8.612 1.00 0.00 O ATOM 1818 OE2 GLU A 110 11.265 -0.683 -9.168 1.00 0.00 O ATOM 0 H GLU A 110 6.626 -3.567 -11.788 1.00 0.00 H new ATOM 0 HA GLU A 110 8.438 -1.802 -13.135 1.00 0.00 H new ATOM 0 HB2 GLU A 110 7.920 -1.781 -10.658 1.00 0.00 H new ATOM 0 HB3 GLU A 110 8.702 -3.340 -10.485 1.00 0.00 H new ATOM 0 HG2 GLU A 110 10.853 -2.341 -11.348 1.00 0.00 H new ATOM 0 HG3 GLU A 110 10.066 -0.781 -11.478 1.00 0.00 H new ATOM 1825 N CYS A 111 9.582 -4.847 -12.512 1.00 0.00 N ATOM 1826 CA CYS A 111 10.655 -5.799 -12.911 1.00 0.00 C ATOM 1827 C CYS A 111 10.443 -6.316 -14.333 1.00 0.00 C ATOM 1828 O CYS A 111 11.373 -6.410 -15.109 1.00 0.00 O ATOM 1829 CB CYS A 111 10.659 -6.984 -11.943 1.00 0.00 C ATOM 1830 SG CYS A 111 10.808 -6.376 -10.245 1.00 0.00 S ATOM 0 H CYS A 111 8.921 -5.204 -11.822 1.00 0.00 H new ATOM 0 HA CYS A 111 11.609 -5.272 -12.877 1.00 0.00 H new ATOM 0 HB2 CYS A 111 9.741 -7.561 -12.055 1.00 0.00 H new ATOM 0 HB3 CYS A 111 11.487 -7.654 -12.175 1.00 0.00 H new ATOM 0 HG CYS A 111 10.703 -7.372 -9.417 1.00 0.00 H new ATOM 1836 N GLU A 112 9.245 -6.693 -14.676 1.00 0.00 N ATOM 1837 CA GLU A 112 9.017 -7.246 -16.034 1.00 0.00 C ATOM 1838 C GLU A 112 9.205 -6.170 -17.112 1.00 0.00 C ATOM 1839 O GLU A 112 9.890 -6.382 -18.093 1.00 0.00 O ATOM 1840 CB GLU A 112 7.595 -7.807 -16.115 1.00 0.00 C ATOM 1841 CG GLU A 112 7.446 -8.570 -17.437 1.00 0.00 C ATOM 1842 CD GLU A 112 8.334 -9.816 -17.407 1.00 0.00 C ATOM 1843 OE1 GLU A 112 8.661 -10.260 -16.319 1.00 0.00 O ATOM 1844 OE2 GLU A 112 8.675 -10.302 -18.472 1.00 0.00 O ATOM 0 H GLU A 112 8.420 -6.642 -14.078 1.00 0.00 H new ATOM 0 HA GLU A 112 9.746 -8.036 -16.213 1.00 0.00 H new ATOM 0 HB2 GLU A 112 7.401 -8.470 -15.272 1.00 0.00 H new ATOM 0 HB3 GLU A 112 6.866 -6.999 -16.060 1.00 0.00 H new ATOM 0 HG2 GLU A 112 6.405 -8.855 -17.590 1.00 0.00 H new ATOM 0 HG3 GLU A 112 7.727 -7.930 -18.273 1.00 0.00 H new ATOM 1851 N LYS A 113 8.593 -5.032 -16.955 1.00 0.00 N ATOM 1852 CA LYS A 113 8.734 -3.969 -17.994 1.00 0.00 C ATOM 1853 C LYS A 113 10.090 -3.261 -17.893 1.00 0.00 C ATOM 1854 O LYS A 113 10.547 -2.669 -18.851 1.00 0.00 O ATOM 1855 CB LYS A 113 7.618 -2.933 -17.826 1.00 0.00 C ATOM 1856 CG LYS A 113 6.248 -3.620 -17.874 1.00 0.00 C ATOM 1857 CD LYS A 113 6.034 -4.267 -19.247 1.00 0.00 C ATOM 1858 CE LYS A 113 4.546 -4.554 -19.453 1.00 0.00 C ATOM 1859 NZ LYS A 113 4.387 -5.630 -20.474 1.00 0.00 N ATOM 0 H LYS A 113 8.004 -4.789 -16.158 1.00 0.00 H new ATOM 0 HA LYS A 113 8.665 -4.447 -18.971 1.00 0.00 H new ATOM 0 HB2 LYS A 113 7.738 -2.409 -16.878 1.00 0.00 H new ATOM 0 HB3 LYS A 113 7.685 -2.184 -18.615 1.00 0.00 H new ATOM 0 HG2 LYS A 113 6.184 -4.377 -17.092 1.00 0.00 H new ATOM 0 HG3 LYS A 113 5.460 -2.893 -17.679 1.00 0.00 H new ATOM 0 HD2 LYS A 113 6.399 -3.606 -20.033 1.00 0.00 H new ATOM 0 HD3 LYS A 113 6.606 -5.192 -19.317 1.00 0.00 H new ATOM 0 HE2 LYS A 113 4.089 -4.860 -18.512 1.00 0.00 H new ATOM 0 HE3 LYS A 113 4.031 -3.650 -19.778 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 3.738 -5.308 -21.220 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 5.313 -5.851 -20.893 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 3.999 -6.483 -20.022 1.00 0.00 H new ATOM 1873 N LYS A 114 10.725 -3.273 -16.745 1.00 0.00 N ATOM 1874 CA LYS A 114 12.027 -2.549 -16.609 1.00 0.00 C ATOM 1875 C LYS A 114 13.134 -3.478 -16.079 1.00 0.00 C ATOM 1876 O LYS A 114 14.293 -3.313 -16.405 1.00 0.00 O ATOM 1877 CB LYS A 114 11.820 -1.384 -15.643 1.00 0.00 C ATOM 1878 CG LYS A 114 12.951 -0.373 -15.799 1.00 0.00 C ATOM 1879 CD LYS A 114 12.667 0.558 -16.986 1.00 0.00 C ATOM 1880 CE LYS A 114 13.669 1.713 -16.986 1.00 0.00 C ATOM 1881 NZ LYS A 114 14.928 1.273 -17.653 1.00 0.00 N ATOM 0 H LYS A 114 10.401 -3.749 -15.903 1.00 0.00 H new ATOM 0 HA LYS A 114 12.344 -2.190 -17.588 1.00 0.00 H new ATOM 0 HB2 LYS A 114 10.861 -0.904 -15.839 1.00 0.00 H new ATOM 0 HB3 LYS A 114 11.788 -1.752 -14.617 1.00 0.00 H new ATOM 0 HG2 LYS A 114 13.055 0.212 -14.885 1.00 0.00 H new ATOM 0 HG3 LYS A 114 13.896 -0.894 -15.953 1.00 0.00 H new ATOM 0 HD2 LYS A 114 12.738 0.003 -17.921 1.00 0.00 H new ATOM 0 HD3 LYS A 114 11.650 0.946 -16.921 1.00 0.00 H new ATOM 0 HE2 LYS A 114 13.249 2.574 -17.507 1.00 0.00 H new ATOM 0 HE3 LYS A 114 13.877 2.029 -15.964 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 15.612 2.056 -17.655 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 15.330 0.464 -17.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 14.722 0.991 -18.633 1.00 0.00 H new ATOM 1895 N ASN A 115 12.795 -4.449 -15.274 1.00 0.00 N ATOM 1896 CA ASN A 115 13.841 -5.379 -14.743 1.00 0.00 C ATOM 1897 C ASN A 115 14.939 -4.585 -14.017 1.00 0.00 C ATOM 1898 O ASN A 115 16.117 -4.796 -14.230 1.00 0.00 O ATOM 1899 CB ASN A 115 14.461 -6.156 -15.909 1.00 0.00 C ATOM 1900 CG ASN A 115 15.142 -7.419 -15.379 1.00 0.00 C ATOM 1901 OD1 ASN A 115 14.484 -8.322 -14.900 1.00 0.00 O ATOM 1902 ND2 ASN A 115 16.441 -7.522 -15.445 1.00 0.00 N ATOM 0 H ASN A 115 11.843 -4.640 -14.960 1.00 0.00 H new ATOM 0 HA ASN A 115 13.380 -6.070 -14.038 1.00 0.00 H new ATOM 0 HB2 ASN A 115 13.690 -6.422 -16.632 1.00 0.00 H new ATOM 0 HB3 ASN A 115 15.186 -5.531 -16.431 1.00 0.00 H new ATOM 0 HD21 ASN A 115 16.905 -8.360 -15.095 1.00 0.00 H new ATOM 0 HD22 ASN A 115 16.993 -6.764 -15.847 1.00 0.00 H new ATOM 1909 N LEU A 116 14.563 -3.669 -13.166 1.00 0.00 N ATOM 1910 CA LEU A 116 15.579 -2.852 -12.431 1.00 0.00 C ATOM 1911 C LEU A 116 16.367 -3.711 -11.446 1.00 0.00 C ATOM 1912 O LEU A 116 17.510 -3.430 -11.149 1.00 0.00 O ATOM 1913 CB LEU A 116 14.865 -1.745 -11.664 1.00 0.00 C ATOM 1914 CG LEU A 116 14.181 -0.834 -12.674 1.00 0.00 C ATOM 1915 CD1 LEU A 116 13.147 0.042 -11.965 1.00 0.00 C ATOM 1916 CD2 LEU A 116 15.225 0.056 -13.372 1.00 0.00 C ATOM 0 H LEU A 116 13.592 -3.448 -12.945 1.00 0.00 H new ATOM 0 HA LEU A 116 16.275 -2.430 -13.156 1.00 0.00 H new ATOM 0 HB2 LEU A 116 14.133 -2.169 -10.977 1.00 0.00 H new ATOM 0 HB3 LEU A 116 15.576 -1.179 -11.062 1.00 0.00 H new ATOM 0 HG LEU A 116 13.679 -1.448 -13.422 1.00 0.00 H new ATOM 0 HD11 LEU A 116 12.661 0.692 -12.692 1.00 0.00 H new ATOM 0 HD12 LEU A 116 12.400 -0.592 -11.487 1.00 0.00 H new ATOM 0 HD13 LEU A 116 13.643 0.651 -11.209 1.00 0.00 H new ATOM 0 HD21 LEU A 116 14.727 0.704 -14.093 1.00 0.00 H new ATOM 0 HD22 LEU A 116 15.738 0.666 -12.629 1.00 0.00 H new ATOM 0 HD23 LEU A 116 15.951 -0.572 -13.889 1.00 0.00 H new ATOM 1928 N SER A 117 15.772 -4.736 -10.913 1.00 0.00 N ATOM 1929 CA SER A 117 16.522 -5.567 -9.924 1.00 0.00 C ATOM 1930 C SER A 117 15.991 -7.003 -9.885 1.00 0.00 C ATOM 1931 O SER A 117 15.270 -7.441 -10.758 1.00 0.00 O ATOM 1932 CB SER A 117 16.391 -4.941 -8.535 1.00 0.00 C ATOM 1933 OG SER A 117 17.189 -5.673 -7.613 1.00 0.00 O ATOM 0 H SER A 117 14.817 -5.035 -11.111 1.00 0.00 H new ATOM 0 HA SER A 117 17.568 -5.598 -10.228 1.00 0.00 H new ATOM 0 HB2 SER A 117 16.709 -3.899 -8.562 1.00 0.00 H new ATOM 0 HB3 SER A 117 15.348 -4.948 -8.217 1.00 0.00 H new ATOM 0 HG SER A 117 18.009 -5.975 -8.057 1.00 0.00 H new ATOM 1939 N THR A 118 16.381 -7.744 -8.878 1.00 0.00 N ATOM 1940 CA THR A 118 15.946 -9.172 -8.765 1.00 0.00 C ATOM 1941 C THR A 118 15.315 -9.420 -7.391 1.00 0.00 C ATOM 1942 O THR A 118 15.636 -8.748 -6.432 1.00 0.00 O ATOM 1943 CB THR A 118 17.182 -10.065 -8.909 1.00 0.00 C ATOM 1944 OG1 THR A 118 18.131 -9.698 -7.919 1.00 0.00 O ATOM 1945 CG2 THR A 118 17.789 -9.887 -10.301 1.00 0.00 C ATOM 0 H THR A 118 16.986 -7.419 -8.124 1.00 0.00 H new ATOM 0 HA THR A 118 15.214 -9.395 -9.541 1.00 0.00 H new ATOM 0 HB THR A 118 16.900 -11.110 -8.779 1.00 0.00 H new ATOM 0 HG1 THR A 118 18.474 -8.800 -8.112 1.00 0.00 H new ATOM 0 HG21 THR A 118 18.668 -10.524 -10.399 1.00 0.00 H new ATOM 0 HG22 THR A 118 17.054 -10.164 -11.057 1.00 0.00 H new ATOM 0 HG23 THR A 118 18.078 -8.846 -10.441 1.00 0.00 H new ATOM 1953 N PRO A 119 14.434 -10.388 -7.284 1.00 0.00 N ATOM 1954 CA PRO A 119 13.776 -10.721 -5.989 1.00 0.00 C ATOM 1955 C PRO A 119 14.794 -10.937 -4.860 1.00 0.00 C ATOM 1956 O PRO A 119 14.583 -10.513 -3.743 1.00 0.00 O ATOM 1957 CB PRO A 119 12.989 -12.016 -6.272 1.00 0.00 C ATOM 1958 CG PRO A 119 13.413 -12.480 -7.632 1.00 0.00 C ATOM 1959 CD PRO A 119 13.956 -11.260 -8.369 1.00 0.00 C ATOM 0 HA PRO A 119 13.137 -9.906 -5.648 1.00 0.00 H new ATOM 0 HB2 PRO A 119 13.204 -12.774 -5.519 1.00 0.00 H new ATOM 0 HB3 PRO A 119 11.915 -11.832 -6.242 1.00 0.00 H new ATOM 0 HG2 PRO A 119 14.175 -13.255 -7.555 1.00 0.00 H new ATOM 0 HG3 PRO A 119 12.571 -12.914 -8.172 1.00 0.00 H new ATOM 0 HD2 PRO A 119 14.762 -11.529 -9.052 1.00 0.00 H new ATOM 0 HD3 PRO A 119 13.183 -10.774 -8.964 1.00 0.00 H new ATOM 1967 N ALA A 120 15.895 -11.592 -5.131 1.00 0.00 N ATOM 1968 CA ALA A 120 16.906 -11.821 -4.054 1.00 0.00 C ATOM 1969 C ALA A 120 17.443 -10.485 -3.561 1.00 0.00 C ATOM 1970 O ALA A 120 17.648 -10.296 -2.380 1.00 0.00 O ATOM 1971 CB ALA A 120 18.061 -12.665 -4.595 1.00 0.00 C ATOM 0 H ALA A 120 16.137 -11.976 -6.045 1.00 0.00 H new ATOM 0 HA ALA A 120 16.430 -12.349 -3.227 1.00 0.00 H new ATOM 0 HB1 ALA A 120 18.794 -12.828 -3.805 1.00 0.00 H new ATOM 0 HB2 ALA A 120 17.679 -13.626 -4.939 1.00 0.00 H new ATOM 0 HB3 ALA A 120 18.534 -12.143 -5.427 1.00 0.00 H new ATOM 1977 N GLU A 121 17.643 -9.539 -4.433 1.00 0.00 N ATOM 1978 CA GLU A 121 18.126 -8.229 -3.938 1.00 0.00 C ATOM 1979 C GLU A 121 17.009 -7.649 -3.082 1.00 0.00 C ATOM 1980 O GLU A 121 17.235 -7.128 -2.008 1.00 0.00 O ATOM 1981 CB GLU A 121 18.436 -7.302 -5.113 1.00 0.00 C ATOM 1982 CG GLU A 121 19.637 -7.846 -5.888 1.00 0.00 C ATOM 1983 CD GLU A 121 19.947 -6.921 -7.066 1.00 0.00 C ATOM 1984 OE1 GLU A 121 19.241 -7.000 -8.059 1.00 0.00 O ATOM 1985 OE2 GLU A 121 20.885 -6.148 -6.957 1.00 0.00 O ATOM 0 H GLU A 121 17.497 -9.614 -5.440 1.00 0.00 H new ATOM 0 HA GLU A 121 19.043 -8.339 -3.360 1.00 0.00 H new ATOM 0 HB2 GLU A 121 17.569 -7.227 -5.770 1.00 0.00 H new ATOM 0 HB3 GLU A 121 18.649 -6.296 -4.750 1.00 0.00 H new ATOM 0 HG2 GLU A 121 20.504 -7.919 -5.231 1.00 0.00 H new ATOM 0 HG3 GLU A 121 19.425 -8.853 -6.249 1.00 0.00 H new ATOM 1992 N LEU A 122 15.793 -7.760 -3.546 1.00 0.00 N ATOM 1993 CA LEU A 122 14.632 -7.250 -2.774 1.00 0.00 C ATOM 1994 C LEU A 122 14.470 -8.055 -1.482 1.00 0.00 C ATOM 1995 O LEU A 122 14.445 -7.507 -0.397 1.00 0.00 O ATOM 1996 CB LEU A 122 13.392 -7.428 -3.645 1.00 0.00 C ATOM 1997 CG LEU A 122 12.134 -7.160 -2.824 1.00 0.00 C ATOM 1998 CD1 LEU A 122 12.272 -5.819 -2.103 1.00 0.00 C ATOM 1999 CD2 LEU A 122 10.904 -7.134 -3.752 1.00 0.00 C ATOM 0 H LEU A 122 15.556 -8.189 -4.440 1.00 0.00 H new ATOM 0 HA LEU A 122 14.777 -6.202 -2.512 1.00 0.00 H new ATOM 0 HB2 LEU A 122 13.434 -6.747 -4.495 1.00 0.00 H new ATOM 0 HB3 LEU A 122 13.364 -8.440 -4.049 1.00 0.00 H new ATOM 0 HG LEU A 122 12.005 -7.952 -2.087 1.00 0.00 H new ATOM 0 HD11 LEU A 122 11.374 -5.627 -1.516 1.00 0.00 H new ATOM 0 HD12 LEU A 122 13.138 -5.849 -1.441 1.00 0.00 H new ATOM 0 HD13 LEU A 122 12.403 -5.023 -2.836 1.00 0.00 H new ATOM 0 HD21 LEU A 122 10.007 -6.942 -3.162 1.00 0.00 H new ATOM 0 HD22 LEU A 122 11.025 -6.346 -4.495 1.00 0.00 H new ATOM 0 HD23 LEU A 122 10.808 -8.096 -4.256 1.00 0.00 H new ATOM 2011 N GLN A 123 14.393 -9.354 -1.586 1.00 0.00 N ATOM 2012 CA GLN A 123 14.273 -10.195 -0.363 1.00 0.00 C ATOM 2013 C GLN A 123 15.450 -9.870 0.546 1.00 0.00 C ATOM 2014 O GLN A 123 15.303 -9.683 1.736 1.00 0.00 O ATOM 2015 CB GLN A 123 14.301 -11.674 -0.753 1.00 0.00 C ATOM 2016 CG GLN A 123 13.992 -12.529 0.475 1.00 0.00 C ATOM 2017 CD GLN A 123 12.526 -12.340 0.874 1.00 0.00 C ATOM 2018 OE1 GLN A 123 11.655 -12.296 0.027 1.00 0.00 O ATOM 2019 NE2 GLN A 123 12.212 -12.223 2.136 1.00 0.00 N ATOM 0 H GLN A 123 14.408 -9.869 -2.466 1.00 0.00 H new ATOM 0 HA GLN A 123 13.334 -9.992 0.153 1.00 0.00 H new ATOM 0 HB2 GLN A 123 13.570 -11.868 -1.538 1.00 0.00 H new ATOM 0 HB3 GLN A 123 15.279 -11.937 -1.156 1.00 0.00 H new ATOM 0 HG2 GLN A 123 14.188 -13.579 0.259 1.00 0.00 H new ATOM 0 HG3 GLN A 123 14.644 -12.246 1.301 1.00 0.00 H new ATOM 0 HE21 GLN A 123 12.941 -12.260 2.848 1.00 0.00 H new ATOM 0 HE22 GLN A 123 11.238 -12.095 2.409 1.00 0.00 H new ATOM 2028 N ALA A 124 16.624 -9.775 -0.005 1.00 0.00 N ATOM 2029 CA ALA A 124 17.790 -9.423 0.844 1.00 0.00 C ATOM 2030 C ALA A 124 17.516 -8.050 1.459 1.00 0.00 C ATOM 2031 O ALA A 124 17.866 -7.773 2.588 1.00 0.00 O ATOM 2032 CB ALA A 124 19.052 -9.361 -0.023 1.00 0.00 C ATOM 0 H ALA A 124 16.826 -9.924 -0.994 1.00 0.00 H new ATOM 0 HA ALA A 124 17.940 -10.168 1.625 1.00 0.00 H new ATOM 0 HB1 ALA A 124 19.909 -9.103 0.599 1.00 0.00 H new ATOM 0 HB2 ALA A 124 19.222 -10.332 -0.489 1.00 0.00 H new ATOM 0 HB3 ALA A 124 18.925 -8.604 -0.797 1.00 0.00 H new ATOM 2038 N ALA A 125 16.873 -7.198 0.710 1.00 0.00 N ATOM 2039 CA ALA A 125 16.540 -5.836 1.216 1.00 0.00 C ATOM 2040 C ALA A 125 15.462 -5.955 2.282 1.00 0.00 C ATOM 2041 O ALA A 125 15.445 -5.231 3.258 1.00 0.00 O ATOM 2042 CB ALA A 125 16.014 -4.978 0.070 1.00 0.00 C ATOM 0 H ALA A 125 16.560 -7.389 -0.242 1.00 0.00 H new ATOM 0 HA ALA A 125 17.434 -5.374 1.636 1.00 0.00 H new ATOM 0 HB1 ALA A 125 15.771 -3.983 0.442 1.00 0.00 H new ATOM 0 HB2 ALA A 125 16.776 -4.899 -0.705 1.00 0.00 H new ATOM 0 HB3 ALA A 125 15.118 -5.438 -0.347 1.00 0.00 H new ATOM 2048 N ILE A 126 14.560 -6.873 2.095 1.00 0.00 N ATOM 2049 CA ILE A 126 13.477 -7.059 3.079 1.00 0.00 C ATOM 2050 C ILE A 126 14.103 -7.383 4.434 1.00 0.00 C ATOM 2051 O ILE A 126 13.830 -6.743 5.428 1.00 0.00 O ATOM 2052 CB ILE A 126 12.617 -8.225 2.615 1.00 0.00 C ATOM 2053 CG1 ILE A 126 11.696 -7.767 1.482 1.00 0.00 C ATOM 2054 CG2 ILE A 126 11.783 -8.758 3.780 1.00 0.00 C ATOM 2055 CD1 ILE A 126 10.962 -8.976 0.890 1.00 0.00 C ATOM 0 H ILE A 126 14.531 -7.505 1.295 1.00 0.00 H new ATOM 0 HA ILE A 126 12.867 -6.160 3.169 1.00 0.00 H new ATOM 0 HB ILE A 126 13.265 -9.023 2.252 1.00 0.00 H new ATOM 0 HG12 ILE A 126 10.975 -7.040 1.858 1.00 0.00 H new ATOM 0 HG13 ILE A 126 12.278 -7.268 0.707 1.00 0.00 H new ATOM 0 HG21 ILE A 126 11.171 -9.592 3.438 1.00 0.00 H new ATOM 0 HG22 ILE A 126 12.445 -9.097 4.577 1.00 0.00 H new ATOM 0 HG23 ILE A 126 11.137 -7.965 4.158 1.00 0.00 H new ATOM 0 HD11 ILE A 126 10.307 -8.645 0.084 1.00 0.00 H new ATOM 0 HD12 ILE A 126 11.689 -9.687 0.498 1.00 0.00 H new ATOM 0 HD13 ILE A 126 10.367 -9.456 1.667 1.00 0.00 H new ATOM 2067 N ASP A 127 14.954 -8.367 4.471 1.00 0.00 N ATOM 2068 CA ASP A 127 15.616 -8.730 5.756 1.00 0.00 C ATOM 2069 C ASP A 127 16.548 -7.596 6.183 1.00 0.00 C ATOM 2070 O ASP A 127 16.678 -7.286 7.351 1.00 0.00 O ATOM 2071 CB ASP A 127 16.434 -10.009 5.574 1.00 0.00 C ATOM 2072 CG ASP A 127 15.496 -11.191 5.330 1.00 0.00 C ATOM 2073 OD1 ASP A 127 14.298 -11.012 5.480 1.00 0.00 O ATOM 2074 OD2 ASP A 127 15.991 -12.256 5.002 1.00 0.00 O ATOM 0 H ASP A 127 15.221 -8.937 3.668 1.00 0.00 H new ATOM 0 HA ASP A 127 14.855 -8.892 6.519 1.00 0.00 H new ATOM 0 HB2 ASP A 127 17.120 -9.897 4.734 1.00 0.00 H new ATOM 0 HB3 ASP A 127 17.042 -10.192 6.460 1.00 0.00 H new ATOM 2079 N GLY A 128 17.204 -6.985 5.236 1.00 0.00 N ATOM 2080 CA GLY A 128 18.143 -5.876 5.564 1.00 0.00 C ATOM 2081 C GLY A 128 17.394 -4.725 6.238 1.00 0.00 C ATOM 2082 O GLY A 128 17.955 -3.995 7.033 1.00 0.00 O ATOM 0 H GLY A 128 17.130 -7.208 4.243 1.00 0.00 H new ATOM 0 HA2 GLY A 128 18.931 -6.241 6.223 1.00 0.00 H new ATOM 0 HA3 GLY A 128 18.627 -5.520 4.655 1.00 0.00 H new ATOM 2086 N ASN A 129 16.141 -4.536 5.922 1.00 0.00 N ATOM 2087 CA ASN A 129 15.390 -3.407 6.543 1.00 0.00 C ATOM 2088 C ASN A 129 14.601 -3.894 7.764 1.00 0.00 C ATOM 2089 O ASN A 129 14.465 -3.187 8.743 1.00 0.00 O ATOM 2090 CB ASN A 129 14.429 -2.811 5.506 1.00 0.00 C ATOM 2091 CG ASN A 129 13.201 -3.710 5.347 1.00 0.00 C ATOM 2092 OD1 ASN A 129 12.925 -4.192 4.268 1.00 0.00 O ATOM 2093 ND2 ASN A 129 12.438 -3.946 6.378 1.00 0.00 N ATOM 0 H ASN A 129 15.609 -5.109 5.267 1.00 0.00 H new ATOM 0 HA ASN A 129 16.097 -2.645 6.871 1.00 0.00 H new ATOM 0 HB2 ASN A 129 14.120 -1.813 5.817 1.00 0.00 H new ATOM 0 HB3 ASN A 129 14.937 -2.704 4.548 1.00 0.00 H new ATOM 0 HD21 ASN A 129 11.611 -4.535 6.276 1.00 0.00 H new ATOM 0 HD22 ASN A 129 12.668 -3.542 7.286 1.00 0.00 H new ATOM 2100 N ARG A 130 14.068 -5.085 7.719 1.00 0.00 N ATOM 2101 CA ARG A 130 13.282 -5.584 8.883 1.00 0.00 C ATOM 2102 C ARG A 130 14.179 -5.717 10.109 1.00 0.00 C ATOM 2103 O ARG A 130 15.342 -6.050 10.016 1.00 0.00 O ATOM 2104 CB ARG A 130 12.659 -6.935 8.550 1.00 0.00 C ATOM 2105 CG ARG A 130 11.518 -6.724 7.556 1.00 0.00 C ATOM 2106 CD ARG A 130 10.780 -8.045 7.339 1.00 0.00 C ATOM 2107 NE ARG A 130 10.165 -8.488 8.625 1.00 0.00 N ATOM 2108 CZ ARG A 130 9.258 -9.428 8.628 1.00 0.00 C ATOM 2109 NH1 ARG A 130 8.882 -9.976 7.504 1.00 0.00 N ATOM 2110 NH2 ARG A 130 8.726 -9.818 9.754 1.00 0.00 N ATOM 0 H ARG A 130 14.142 -5.730 6.932 1.00 0.00 H new ATOM 0 HA ARG A 130 12.490 -4.868 9.102 1.00 0.00 H new ATOM 0 HB2 ARG A 130 13.410 -7.602 8.126 1.00 0.00 H new ATOM 0 HB3 ARG A 130 12.286 -7.411 9.457 1.00 0.00 H new ATOM 0 HG2 ARG A 130 10.829 -5.968 7.932 1.00 0.00 H new ATOM 0 HG3 ARG A 130 11.910 -6.355 6.609 1.00 0.00 H new ATOM 0 HD2 ARG A 130 10.009 -7.923 6.578 1.00 0.00 H new ATOM 0 HD3 ARG A 130 11.471 -8.804 6.973 1.00 0.00 H new ATOM 0 HE ARG A 130 10.453 -8.056 9.503 1.00 0.00 H new ATOM 0 HH11 ARG A 130 9.297 -9.670 6.624 1.00 0.00 H new ATOM 0 HH12 ARG A 130 8.174 -10.710 7.506 1.00 0.00 H new ATOM 0 HH21 ARG A 130 9.018 -9.389 10.632 1.00 0.00 H new ATOM 0 HH22 ARG A 130 8.018 -10.552 9.756 1.00 0.00 H new