USER MOD reduce.3.24.130724 H: found=0, std=0, add=845, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 850 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 9 TYR OH : rot 161:sc= -0.491! USER MOD Single : A 11 ASN : amide:sc= -0.0965 K(o=-0.096,f=-1.1) USER MOD Single : A 15 LYS NZ :NH3+ -157:sc= 0.845 (180deg=-0.292!) USER MOD Single : A 18 GLN : amide:sc= -1.37 K(o=-1.4,f=-0.51) USER MOD Single : A 19 LYS NZ :NH3+ -171:sc= -0.0124 (180deg=-0.0992) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ -170:sc= 1.2 (180deg=0.653) USER MOD Single : A 31 LYS NZ :NH3+ -169:sc=-0.00267 (180deg=-0.103) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ 163:sc= 1.2 (180deg=0.587) USER MOD Single : B 9 TYR OH : rot 168:sc= -0.43 USER MOD Single : B 11 ASN : amide:sc= -0.236 X(o=-0.24,f=-0.2) USER MOD Single : B 15 LYS NZ :NH3+ 166:sc= -0.0255 (180deg=-0.219) USER MOD Single : B 18 GLN : amide:sc= -3.59! K(o=-3.6!,f=0.082) USER MOD Single : B 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 29 LYS NZ :NH3+ 160:sc= 1.25 (180deg=0.909) USER MOD Single : B 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 46 SER OG : rot 180:sc= 0 USER MOD Single : B 57 THR OG1 : rot 180:sc= 0 USER MOD Single : B 59 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 60 SER OG : rot 180:sc= 0 USER MOD Single : B 61 SER OG : rot 180:sc= 0 USER MOD Single : B 64 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 65 HIS : no HD1:sc= -0.0374 X(o=-0.037,f=0) USER MOD Single : B 66 HIS : no HD1:sc= -0.328 X(o=-0.33,f=-0.68) USER MOD Single : B 67 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 68 HIS : no HD1:sc= -0.05 X(o=-0.05,f=-0.51) USER MOD Single : B 69 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 56 N ILE A 4 -7.387 0.798 3.349 1.00 0.00 N ATOM 57 CA ILE A 4 -6.908 -0.298 2.557 1.00 0.00 C ATOM 58 C ILE A 4 -7.821 -0.449 1.352 1.00 0.00 C ATOM 59 O ILE A 4 -9.047 -0.477 1.490 1.00 0.00 O ATOM 60 CB ILE A 4 -6.883 -1.623 3.332 1.00 0.00 C ATOM 61 CG1 ILE A 4 -8.179 -1.818 4.130 1.00 0.00 C ATOM 62 CG2 ILE A 4 -5.658 -1.711 4.233 1.00 0.00 C ATOM 63 CD1 ILE A 4 -8.152 -1.242 5.535 1.00 0.00 C ATOM 0 HA ILE A 4 -5.882 -0.076 2.262 1.00 0.00 H new ATOM 0 HB ILE A 4 -6.815 -2.434 2.607 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -9.001 -1.360 3.580 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -8.394 -2.885 4.193 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -5.668 -2.660 4.769 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -4.755 -1.646 3.626 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -5.674 -0.890 4.949 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -9.109 -1.427 6.023 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -7.355 -1.717 6.108 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -7.972 -0.168 5.485 1.00 0.00 H new ATOM 75 N ILE A 5 -7.240 -0.512 0.175 1.00 0.00 N ATOM 76 CA ILE A 5 -7.997 -0.620 -1.031 1.00 0.00 C ATOM 77 C ILE A 5 -8.217 -2.079 -1.380 1.00 0.00 C ATOM 78 O ILE A 5 -7.312 -2.892 -1.252 1.00 0.00 O ATOM 79 CB ILE A 5 -7.273 0.093 -2.183 1.00 0.00 C ATOM 80 CG1 ILE A 5 -5.759 -0.129 -2.100 1.00 0.00 C ATOM 81 CG2 ILE A 5 -7.599 1.576 -2.182 1.00 0.00 C ATOM 82 CD1 ILE A 5 -4.996 0.462 -3.269 1.00 0.00 C ATOM 0 H ILE A 5 -6.230 -0.489 0.037 1.00 0.00 H new ATOM 0 HA ILE A 5 -8.965 -0.143 -0.878 1.00 0.00 H new ATOM 0 HB ILE A 5 -7.625 -0.336 -3.121 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -5.386 0.309 -1.174 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -5.559 -1.199 -2.050 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -7.077 2.064 -3.005 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -8.674 1.712 -2.302 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -7.281 2.018 -1.238 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -3.931 0.267 -3.144 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -5.342 0.006 -4.197 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -5.166 1.538 -3.308 1.00 0.00 H new ATOM 94 N GLU A 6 -9.418 -2.419 -1.793 1.00 0.00 N ATOM 95 CA GLU A 6 -9.723 -3.794 -2.121 1.00 0.00 C ATOM 96 C GLU A 6 -9.665 -4.020 -3.626 1.00 0.00 C ATOM 97 O GLU A 6 -10.043 -3.147 -4.409 1.00 0.00 O ATOM 98 CB GLU A 6 -11.090 -4.174 -1.562 1.00 0.00 C ATOM 99 CG GLU A 6 -11.157 -4.090 -0.043 1.00 0.00 C ATOM 100 CD GLU A 6 -12.415 -4.711 0.527 1.00 0.00 C ATOM 101 OE1 GLU A 6 -12.496 -5.955 0.578 1.00 0.00 O ATOM 102 OE2 GLU A 6 -13.329 -3.960 0.932 1.00 0.00 O ATOM 0 H GLU A 6 -10.194 -1.768 -1.909 1.00 0.00 H new ATOM 0 HA GLU A 6 -8.971 -4.436 -1.663 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -11.847 -3.517 -1.990 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -11.335 -5.189 -1.875 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -10.287 -4.590 0.382 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -11.104 -3.044 0.261 1.00 0.00 H new ATOM 109 N ALA A 7 -9.163 -5.185 -4.014 1.00 0.00 N ATOM 110 CA ALA A 7 -9.018 -5.551 -5.413 1.00 0.00 C ATOM 111 C ALA A 7 -9.477 -6.994 -5.631 1.00 0.00 C ATOM 112 O ALA A 7 -9.633 -7.756 -4.674 1.00 0.00 O ATOM 113 CB ALA A 7 -7.563 -5.397 -5.839 1.00 0.00 C ATOM 0 H ALA A 7 -8.845 -5.904 -3.364 1.00 0.00 H new ATOM 0 HA ALA A 7 -9.639 -4.890 -6.018 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -7.460 -5.673 -6.889 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -7.252 -4.361 -5.704 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -6.935 -6.047 -5.230 1.00 0.00 H new ATOM 119 N VAL A 8 -9.704 -7.356 -6.882 1.00 0.00 N ATOM 120 CA VAL A 8 -10.049 -8.709 -7.247 1.00 0.00 C ATOM 121 C VAL A 8 -9.009 -9.291 -8.215 1.00 0.00 C ATOM 122 O VAL A 8 -8.691 -8.694 -9.244 1.00 0.00 O ATOM 123 CB VAL A 8 -11.453 -8.768 -7.872 1.00 0.00 C ATOM 124 CG1 VAL A 8 -12.525 -8.545 -6.813 1.00 0.00 C ATOM 125 CG2 VAL A 8 -11.606 -7.752 -9.000 1.00 0.00 C ATOM 0 H VAL A 8 -9.653 -6.713 -7.672 1.00 0.00 H new ATOM 0 HA VAL A 8 -10.053 -9.312 -6.339 1.00 0.00 H new ATOM 0 HB VAL A 8 -11.580 -9.764 -8.296 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -13.510 -8.591 -7.277 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -12.448 -9.318 -6.049 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -12.385 -7.566 -6.354 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -12.610 -7.822 -9.419 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -11.445 -6.747 -8.609 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -10.873 -7.960 -9.779 1.00 0.00 H new ATOM 135 N TYR A 9 -8.469 -10.445 -7.852 1.00 0.00 N ATOM 136 CA TYR A 9 -7.417 -11.110 -8.621 1.00 0.00 C ATOM 137 C TYR A 9 -8.003 -12.135 -9.573 1.00 0.00 C ATOM 138 O TYR A 9 -8.548 -13.155 -9.157 1.00 0.00 O ATOM 139 CB TYR A 9 -6.452 -11.772 -7.639 1.00 0.00 C ATOM 140 CG TYR A 9 -5.240 -12.436 -8.246 1.00 0.00 C ATOM 141 CD1 TYR A 9 -4.104 -11.702 -8.544 1.00 0.00 C ATOM 142 CD2 TYR A 9 -5.220 -13.802 -8.482 1.00 0.00 C ATOM 143 CE1 TYR A 9 -2.976 -12.308 -9.051 1.00 0.00 C ATOM 144 CE2 TYR A 9 -4.100 -14.417 -8.998 1.00 0.00 C ATOM 145 CZ TYR A 9 -2.977 -13.665 -9.282 1.00 0.00 C ATOM 146 OH TYR A 9 -1.843 -14.275 -9.776 1.00 0.00 O ATOM 0 H TYR A 9 -8.747 -10.952 -7.012 1.00 0.00 H new ATOM 0 HA TYR A 9 -6.886 -10.376 -9.227 1.00 0.00 H new ATOM 0 HB2 TYR A 9 -6.111 -11.017 -6.931 1.00 0.00 H new ATOM 0 HB3 TYR A 9 -7.003 -12.519 -7.068 1.00 0.00 H new ATOM 0 HD1 TYR A 9 -4.103 -10.635 -8.376 1.00 0.00 H new ATOM 0 HD2 TYR A 9 -6.096 -14.393 -8.258 1.00 0.00 H new ATOM 0 HE1 TYR A 9 -2.095 -11.721 -9.266 1.00 0.00 H new ATOM 0 HE2 TYR A 9 -4.100 -15.482 -9.179 1.00 0.00 H new ATOM 0 HH TYR A 9 -1.887 -15.238 -9.602 1.00 0.00 H new ATOM 156 N GLU A 10 -7.900 -11.823 -10.855 1.00 0.00 N ATOM 157 CA GLU A 10 -8.335 -12.695 -11.920 1.00 0.00 C ATOM 158 C GLU A 10 -7.231 -12.827 -12.962 1.00 0.00 C ATOM 159 O GLU A 10 -6.543 -11.854 -13.247 1.00 0.00 O ATOM 160 CB GLU A 10 -9.575 -12.113 -12.586 1.00 0.00 C ATOM 161 CG GLU A 10 -9.368 -10.716 -13.158 1.00 0.00 C ATOM 162 CD GLU A 10 -10.401 -10.350 -14.201 1.00 0.00 C ATOM 163 OE1 GLU A 10 -10.334 -10.890 -15.322 1.00 0.00 O ATOM 164 OE2 GLU A 10 -11.266 -9.499 -13.920 1.00 0.00 O ATOM 0 H GLU A 10 -7.505 -10.942 -11.184 1.00 0.00 H new ATOM 0 HA GLU A 10 -8.566 -13.675 -11.502 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -9.892 -12.780 -13.387 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -10.386 -12.081 -11.858 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -9.403 -9.988 -12.348 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -8.374 -10.653 -13.600 1.00 0.00 H new ATOM 171 N ASN A 11 -7.052 -14.026 -13.510 1.00 0.00 N ATOM 172 CA ASN A 11 -6.133 -14.245 -14.640 1.00 0.00 C ATOM 173 C ASN A 11 -4.690 -13.883 -14.282 1.00 0.00 C ATOM 174 O ASN A 11 -3.864 -13.634 -15.158 1.00 0.00 O ATOM 175 CB ASN A 11 -6.593 -13.408 -15.841 1.00 0.00 C ATOM 176 CG ASN A 11 -6.047 -13.903 -17.173 1.00 0.00 C ATOM 177 OD1 ASN A 11 -5.780 -15.092 -17.355 1.00 0.00 O ATOM 178 ND2 ASN A 11 -5.891 -12.988 -18.119 1.00 0.00 N ATOM 0 H ASN A 11 -7.531 -14.869 -13.193 1.00 0.00 H new ATOM 0 HA ASN A 11 -6.155 -15.306 -14.889 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -7.682 -13.412 -15.880 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -6.283 -12.374 -15.693 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -5.538 -13.259 -19.037 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -6.124 -12.013 -17.929 1.00 0.00 H new ATOM 185 N GLY A 12 -4.386 -13.866 -12.995 1.00 0.00 N ATOM 186 CA GLY A 12 -3.055 -13.485 -12.561 1.00 0.00 C ATOM 187 C GLY A 12 -2.933 -11.987 -12.363 1.00 0.00 C ATOM 188 O GLY A 12 -1.836 -11.452 -12.229 1.00 0.00 O ATOM 0 H GLY A 12 -5.032 -14.108 -12.244 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -2.817 -13.995 -11.628 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -2.324 -13.814 -13.299 1.00 0.00 H new ATOM 192 N VAL A 13 -4.073 -11.315 -12.344 1.00 0.00 N ATOM 193 CA VAL A 13 -4.115 -9.869 -12.220 1.00 0.00 C ATOM 194 C VAL A 13 -4.869 -9.463 -10.975 1.00 0.00 C ATOM 195 O VAL A 13 -5.854 -10.089 -10.634 1.00 0.00 O ATOM 196 CB VAL A 13 -4.880 -9.244 -13.384 1.00 0.00 C ATOM 197 CG1 VAL A 13 -4.691 -7.745 -13.412 1.00 0.00 C ATOM 198 CG2 VAL A 13 -4.499 -9.871 -14.720 1.00 0.00 C ATOM 0 H VAL A 13 -4.991 -11.755 -12.414 1.00 0.00 H new ATOM 0 HA VAL A 13 -3.079 -9.530 -12.194 1.00 0.00 H new ATOM 0 HB VAL A 13 -5.938 -9.451 -13.224 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -5.246 -7.324 -14.250 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -5.059 -7.314 -12.481 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -3.632 -7.514 -13.525 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -5.067 -9.396 -15.520 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -3.433 -9.729 -14.898 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -4.724 -10.937 -14.699 1.00 0.00 H new ATOM 208 N PHE A 14 -4.435 -8.408 -10.322 1.00 0.00 N ATOM 209 CA PHE A 14 -5.248 -7.786 -9.295 1.00 0.00 C ATOM 210 C PHE A 14 -5.866 -6.509 -9.859 1.00 0.00 C ATOM 211 O PHE A 14 -5.152 -5.566 -10.206 1.00 0.00 O ATOM 212 CB PHE A 14 -4.433 -7.416 -8.055 1.00 0.00 C ATOM 213 CG PHE A 14 -4.071 -8.542 -7.123 1.00 0.00 C ATOM 214 CD1 PHE A 14 -5.023 -9.093 -6.284 1.00 0.00 C ATOM 215 CD2 PHE A 14 -2.773 -9.024 -7.059 1.00 0.00 C ATOM 216 CE1 PHE A 14 -4.691 -10.107 -5.402 1.00 0.00 C ATOM 217 CE2 PHE A 14 -2.435 -10.040 -6.182 1.00 0.00 C ATOM 218 CZ PHE A 14 -3.396 -10.583 -5.352 1.00 0.00 C ATOM 0 H PHE A 14 -3.531 -7.964 -10.480 1.00 0.00 H new ATOM 0 HA PHE A 14 -6.011 -8.506 -8.999 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -3.511 -6.937 -8.384 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -4.994 -6.672 -7.489 1.00 0.00 H new ATOM 0 HD1 PHE A 14 -6.039 -8.727 -6.318 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -2.015 -8.601 -7.702 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -5.445 -10.526 -4.753 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -1.420 -10.408 -6.147 1.00 0.00 H new ATOM 0 HZ PHE A 14 -3.136 -11.376 -4.667 1.00 0.00 H new ATOM 228 N LYS A 15 -7.178 -6.489 -9.961 1.00 0.00 N ATOM 229 CA LYS A 15 -7.906 -5.303 -10.371 1.00 0.00 C ATOM 230 C LYS A 15 -8.604 -4.708 -9.170 1.00 0.00 C ATOM 231 O LYS A 15 -9.497 -5.340 -8.619 1.00 0.00 O ATOM 232 CB LYS A 15 -8.985 -5.659 -11.383 1.00 0.00 C ATOM 233 CG LYS A 15 -8.490 -6.185 -12.712 1.00 0.00 C ATOM 234 CD LYS A 15 -9.674 -6.551 -13.591 1.00 0.00 C ATOM 235 CE LYS A 15 -9.251 -7.128 -14.928 1.00 0.00 C ATOM 236 NZ LYS A 15 -10.419 -7.656 -15.682 1.00 0.00 N ATOM 0 H LYS A 15 -7.772 -7.294 -9.762 1.00 0.00 H new ATOM 0 HA LYS A 15 -7.194 -4.603 -10.809 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -9.641 -6.407 -10.939 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -9.591 -4.772 -11.567 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -7.877 -5.432 -13.207 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -7.857 -7.059 -12.555 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -10.300 -7.275 -13.069 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -10.285 -5.664 -13.759 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -8.753 -6.358 -15.517 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -8.527 -7.927 -14.769 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -10.096 -8.366 -16.370 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -11.090 -8.096 -15.020 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -10.889 -6.876 -16.184 1.00 0.00 H new ATOM 250 N PRO A 16 -8.240 -3.506 -8.730 1.00 0.00 N ATOM 251 CA PRO A 16 -8.896 -2.909 -7.580 1.00 0.00 C ATOM 252 C PRO A 16 -10.378 -2.661 -7.835 1.00 0.00 C ATOM 253 O PRO A 16 -10.858 -2.732 -8.969 1.00 0.00 O ATOM 254 CB PRO A 16 -8.157 -1.583 -7.383 1.00 0.00 C ATOM 255 CG PRO A 16 -7.479 -1.312 -8.682 1.00 0.00 C ATOM 256 CD PRO A 16 -7.194 -2.654 -9.294 1.00 0.00 C ATOM 0 HA PRO A 16 -8.856 -3.559 -6.706 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -8.850 -0.781 -7.126 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -7.435 -1.653 -6.570 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -8.114 -0.713 -9.335 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -6.558 -0.750 -8.530 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -7.246 -2.620 -10.382 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -6.198 -3.012 -9.033 1.00 0.00 H new ATOM 264 N LEU A 17 -11.089 -2.342 -6.778 1.00 0.00 N ATOM 265 CA LEU A 17 -12.483 -1.957 -6.877 1.00 0.00 C ATOM 266 C LEU A 17 -12.554 -0.455 -6.750 1.00 0.00 C ATOM 267 O LEU A 17 -13.612 0.164 -6.870 1.00 0.00 O ATOM 268 CB LEU A 17 -13.307 -2.632 -5.776 1.00 0.00 C ATOM 269 CG LEU A 17 -13.257 -4.162 -5.771 1.00 0.00 C ATOM 270 CD1 LEU A 17 -14.043 -4.714 -4.595 1.00 0.00 C ATOM 271 CD2 LEU A 17 -13.797 -4.721 -7.077 1.00 0.00 C ATOM 0 H LEU A 17 -10.721 -2.341 -5.827 1.00 0.00 H new ATOM 0 HA LEU A 17 -12.897 -2.275 -7.834 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -12.958 -2.270 -4.809 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -14.346 -2.319 -5.878 1.00 0.00 H new ATOM 0 HG LEU A 17 -12.216 -4.470 -5.670 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -13.997 -5.803 -4.606 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -13.614 -4.342 -3.664 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -15.082 -4.394 -4.669 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -13.753 -5.810 -7.053 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -14.831 -4.403 -7.209 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -13.195 -4.352 -7.907 1.00 0.00 H new ATOM 283 N GLN A 18 -11.386 0.110 -6.493 1.00 0.00 N ATOM 284 CA GLN A 18 -11.230 1.549 -6.345 1.00 0.00 C ATOM 285 C GLN A 18 -10.104 2.027 -7.256 1.00 0.00 C ATOM 286 O GLN A 18 -9.009 1.471 -7.229 1.00 0.00 O ATOM 287 CB GLN A 18 -10.902 1.894 -4.886 1.00 0.00 C ATOM 288 CG GLN A 18 -11.713 1.098 -3.878 1.00 0.00 C ATOM 289 CD GLN A 18 -11.335 1.400 -2.439 1.00 0.00 C ATOM 290 OE1 GLN A 18 -11.384 0.521 -1.579 1.00 0.00 O ATOM 291 NE2 GLN A 18 -10.988 2.646 -2.158 1.00 0.00 N ATOM 0 H GLN A 18 -10.519 -0.415 -6.381 1.00 0.00 H new ATOM 0 HA GLN A 18 -12.160 2.045 -6.622 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -9.841 1.716 -4.709 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -11.078 2.957 -4.724 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -12.772 1.312 -4.022 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -11.574 0.034 -4.068 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -10.959 3.347 -2.899 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -10.749 2.905 -1.201 1.00 0.00 H new ATOM 300 N LYS A 19 -10.376 3.031 -8.078 1.00 0.00 N ATOM 301 CA LYS A 19 -9.362 3.572 -8.963 1.00 0.00 C ATOM 302 C LYS A 19 -8.378 4.411 -8.171 1.00 0.00 C ATOM 303 O LYS A 19 -8.773 5.267 -7.381 1.00 0.00 O ATOM 304 CB LYS A 19 -9.991 4.414 -10.069 1.00 0.00 C ATOM 305 CG LYS A 19 -8.979 4.937 -11.074 1.00 0.00 C ATOM 306 CD LYS A 19 -9.620 5.867 -12.094 1.00 0.00 C ATOM 307 CE LYS A 19 -8.618 6.339 -13.141 1.00 0.00 C ATOM 308 NZ LYS A 19 -7.470 7.086 -12.549 1.00 0.00 N ATOM 0 H LYS A 19 -11.287 3.484 -8.148 1.00 0.00 H new ATOM 0 HA LYS A 19 -8.835 2.738 -9.427 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -10.737 3.816 -10.592 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -10.516 5.257 -9.620 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -8.185 5.467 -10.548 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -8.513 4.098 -11.590 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -10.445 5.352 -12.587 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -10.044 6.731 -11.582 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -8.240 5.477 -13.690 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -9.127 6.978 -13.863 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -6.904 7.512 -13.310 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -7.829 7.835 -11.923 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -6.876 6.432 -12.001 1.00 0.00 H new ATOM 322 N VAL A 20 -7.104 4.158 -8.392 1.00 0.00 N ATOM 323 CA VAL A 20 -6.055 4.846 -7.658 1.00 0.00 C ATOM 324 C VAL A 20 -5.107 5.517 -8.599 1.00 0.00 C ATOM 325 O VAL A 20 -4.730 4.970 -9.635 1.00 0.00 O ATOM 326 CB VAL A 20 -5.256 3.904 -6.734 1.00 0.00 C ATOM 327 CG1 VAL A 20 -4.544 4.698 -5.648 1.00 0.00 C ATOM 328 CG2 VAL A 20 -6.151 2.836 -6.122 1.00 0.00 C ATOM 0 H VAL A 20 -6.767 3.480 -9.075 1.00 0.00 H new ATOM 0 HA VAL A 20 -6.556 5.586 -7.034 1.00 0.00 H new ATOM 0 HB VAL A 20 -4.506 3.398 -7.341 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -3.986 4.017 -5.006 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -3.857 5.408 -6.108 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -5.279 5.238 -5.051 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -5.557 2.189 -5.477 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -6.936 3.312 -5.535 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -6.602 2.241 -6.916 1.00 0.00 H new ATOM 338 N ASP A 21 -4.745 6.718 -8.234 1.00 0.00 N ATOM 339 CA ASP A 21 -3.759 7.454 -8.971 1.00 0.00 C ATOM 340 C ASP A 21 -2.420 7.225 -8.330 1.00 0.00 C ATOM 341 O ASP A 21 -1.990 7.928 -7.416 1.00 0.00 O ATOM 342 CB ASP A 21 -4.112 8.925 -8.988 1.00 0.00 C ATOM 343 CG ASP A 21 -3.115 9.781 -9.747 1.00 0.00 C ATOM 344 OD1 ASP A 21 -2.997 9.614 -10.981 1.00 0.00 O ATOM 345 OD2 ASP A 21 -2.474 10.655 -9.119 1.00 0.00 O ATOM 0 H ASP A 21 -5.123 7.209 -7.424 1.00 0.00 H new ATOM 0 HA ASP A 21 -3.726 7.113 -10.006 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -5.098 9.048 -9.435 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -4.180 9.285 -7.962 1.00 0.00 H new ATOM 350 N LEU A 22 -1.819 6.177 -8.794 1.00 0.00 N ATOM 351 CA LEU A 22 -0.480 5.795 -8.400 1.00 0.00 C ATOM 352 C LEU A 22 0.447 5.722 -9.608 1.00 0.00 C ATOM 353 O LEU A 22 0.066 6.089 -10.719 1.00 0.00 O ATOM 354 CB LEU A 22 -0.522 4.446 -7.693 1.00 0.00 C ATOM 355 CG LEU A 22 -1.089 4.464 -6.276 1.00 0.00 C ATOM 356 CD1 LEU A 22 -1.122 3.059 -5.699 1.00 0.00 C ATOM 357 CD2 LEU A 22 -0.265 5.381 -5.386 1.00 0.00 C ATOM 0 H LEU A 22 -2.244 5.543 -9.471 1.00 0.00 H new ATOM 0 HA LEU A 22 -0.090 6.552 -7.720 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -1.116 3.758 -8.295 1.00 0.00 H new ATOM 0 HB3 LEU A 22 0.490 4.043 -7.655 1.00 0.00 H new ATOM 0 HG LEU A 22 -2.109 4.846 -6.318 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -1.529 3.090 -4.688 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -1.750 2.424 -6.324 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -0.111 2.654 -5.671 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -0.683 5.382 -4.379 1.00 0.00 H new ATOM 0 HD22 LEU A 22 0.765 5.025 -5.351 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -0.286 6.394 -5.789 1.00 0.00 H new ATOM 369 N LYS A 23 1.653 5.222 -9.386 1.00 0.00 N ATOM 370 CA LYS A 23 2.665 5.149 -10.427 1.00 0.00 C ATOM 371 C LYS A 23 2.718 3.760 -11.036 1.00 0.00 C ATOM 372 O LYS A 23 1.904 2.898 -10.707 1.00 0.00 O ATOM 373 CB LYS A 23 4.027 5.491 -9.839 1.00 0.00 C ATOM 374 CG LYS A 23 4.210 6.962 -9.529 1.00 0.00 C ATOM 375 CD LYS A 23 5.393 7.184 -8.604 1.00 0.00 C ATOM 376 CE LYS A 23 6.658 6.500 -9.108 1.00 0.00 C ATOM 377 NZ LYS A 23 7.743 6.531 -8.089 1.00 0.00 N ATOM 0 H LYS A 23 1.956 4.857 -8.483 1.00 0.00 H new ATOM 0 HA LYS A 23 2.405 5.863 -11.208 1.00 0.00 H new ATOM 0 HB2 LYS A 23 4.171 4.916 -8.924 1.00 0.00 H new ATOM 0 HB3 LYS A 23 4.803 5.178 -10.538 1.00 0.00 H new ATOM 0 HG2 LYS A 23 4.360 7.516 -10.456 1.00 0.00 H new ATOM 0 HG3 LYS A 23 3.304 7.354 -9.066 1.00 0.00 H new ATOM 0 HD2 LYS A 23 5.577 8.254 -8.503 1.00 0.00 H new ATOM 0 HD3 LYS A 23 5.150 6.807 -7.610 1.00 0.00 H new ATOM 0 HE2 LYS A 23 6.433 5.466 -9.369 1.00 0.00 H new ATOM 0 HE3 LYS A 23 7.000 6.992 -10.019 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 8.588 6.057 -8.467 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 7.974 7.518 -7.858 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 7.426 6.040 -7.229 1.00 0.00 H new ATOM 391 N GLU A 24 3.662 3.556 -11.945 1.00 0.00 N ATOM 392 CA GLU A 24 3.936 2.246 -12.469 1.00 0.00 C ATOM 393 C GLU A 24 4.968 1.550 -11.616 1.00 0.00 C ATOM 394 O GLU A 24 5.960 2.149 -11.194 1.00 0.00 O ATOM 395 CB GLU A 24 4.425 2.338 -13.905 1.00 0.00 C ATOM 396 CG GLU A 24 3.352 2.675 -14.927 1.00 0.00 C ATOM 397 CD GLU A 24 2.739 4.043 -14.734 1.00 0.00 C ATOM 398 OE1 GLU A 24 3.454 5.047 -14.927 1.00 0.00 O ATOM 399 OE2 GLU A 24 1.537 4.117 -14.407 1.00 0.00 O ATOM 0 H GLU A 24 4.250 4.295 -12.331 1.00 0.00 H new ATOM 0 HA GLU A 24 3.012 1.667 -12.452 1.00 0.00 H new ATOM 0 HB2 GLU A 24 5.208 3.095 -13.959 1.00 0.00 H new ATOM 0 HB3 GLU A 24 4.881 1.387 -14.179 1.00 0.00 H new ATOM 0 HG2 GLU A 24 3.783 2.617 -15.926 1.00 0.00 H new ATOM 0 HG3 GLU A 24 2.565 1.923 -14.876 1.00 0.00 H new ATOM 406 N GLY A 25 4.715 0.278 -11.392 1.00 0.00 N ATOM 407 CA GLY A 25 5.445 -0.479 -10.416 1.00 0.00 C ATOM 408 C GLY A 25 5.475 0.250 -9.105 1.00 0.00 C ATOM 409 O GLY A 25 6.526 0.671 -8.622 1.00 0.00 O ATOM 0 H GLY A 25 3.997 -0.253 -11.884 1.00 0.00 H new ATOM 0 HA2 GLY A 25 4.983 -1.457 -10.285 1.00 0.00 H new ATOM 0 HA3 GLY A 25 6.462 -0.652 -10.767 1.00 0.00 H new ATOM 413 N GLU A 26 4.303 0.389 -8.529 1.00 0.00 N ATOM 414 CA GLU A 26 4.166 0.892 -7.194 1.00 0.00 C ATOM 415 C GLU A 26 4.130 -0.278 -6.214 1.00 0.00 C ATOM 416 O GLU A 26 3.361 -1.224 -6.400 1.00 0.00 O ATOM 417 CB GLU A 26 2.898 1.729 -7.118 1.00 0.00 C ATOM 418 CG GLU A 26 2.741 2.453 -5.815 1.00 0.00 C ATOM 419 CD GLU A 26 3.914 3.362 -5.516 1.00 0.00 C ATOM 420 OE1 GLU A 26 4.911 2.882 -4.930 1.00 0.00 O ATOM 421 OE2 GLU A 26 3.859 4.552 -5.884 1.00 0.00 O ATOM 0 H GLU A 26 3.419 0.154 -8.980 1.00 0.00 H new ATOM 0 HA GLU A 26 5.014 1.523 -6.927 1.00 0.00 H new ATOM 0 HB2 GLU A 26 2.901 2.455 -7.931 1.00 0.00 H new ATOM 0 HB3 GLU A 26 2.034 1.082 -7.272 1.00 0.00 H new ATOM 0 HG2 GLU A 26 1.824 3.042 -5.838 1.00 0.00 H new ATOM 0 HG3 GLU A 26 2.633 1.727 -5.009 1.00 0.00 H new ATOM 428 N ARG A 27 4.977 -0.224 -5.190 1.00 0.00 N ATOM 429 CA ARG A 27 5.131 -1.347 -4.273 1.00 0.00 C ATOM 430 C ARG A 27 4.044 -1.361 -3.225 1.00 0.00 C ATOM 431 O ARG A 27 3.935 -0.477 -2.359 1.00 0.00 O ATOM 432 CB ARG A 27 6.498 -1.353 -3.605 1.00 0.00 C ATOM 433 CG ARG A 27 7.600 -1.986 -4.447 1.00 0.00 C ATOM 434 CD ARG A 27 7.741 -1.315 -5.801 1.00 0.00 C ATOM 435 NE ARG A 27 8.743 -1.972 -6.638 1.00 0.00 N ATOM 436 CZ ARG A 27 9.444 -1.359 -7.588 1.00 0.00 C ATOM 437 NH1 ARG A 27 9.287 -0.062 -7.808 1.00 0.00 N ATOM 438 NH2 ARG A 27 10.301 -2.053 -8.322 1.00 0.00 N ATOM 0 H ARG A 27 5.564 0.582 -4.976 1.00 0.00 H new ATOM 0 HA ARG A 27 5.044 -2.251 -4.875 1.00 0.00 H new ATOM 0 HB2 ARG A 27 6.780 -0.327 -3.369 1.00 0.00 H new ATOM 0 HB3 ARG A 27 6.426 -1.889 -2.659 1.00 0.00 H new ATOM 0 HG2 ARG A 27 8.547 -1.922 -3.911 1.00 0.00 H new ATOM 0 HG3 ARG A 27 7.384 -3.045 -4.588 1.00 0.00 H new ATOM 0 HD2 ARG A 27 6.779 -1.326 -6.312 1.00 0.00 H new ATOM 0 HD3 ARG A 27 8.016 -0.270 -5.660 1.00 0.00 H new ATOM 0 HE ARG A 27 8.916 -2.965 -6.484 1.00 0.00 H new ATOM 0 HH11 ARG A 27 8.625 0.474 -7.247 1.00 0.00 H new ATOM 0 HH12 ARG A 27 9.828 0.401 -8.538 1.00 0.00 H new ATOM 0 HH21 ARG A 27 10.421 -3.052 -8.157 1.00 0.00 H new ATOM 0 HH22 ARG A 27 10.841 -1.588 -9.052 1.00 0.00 H new ATOM 452 N VAL A 28 3.263 -2.398 -3.320 1.00 0.00 N ATOM 453 CA VAL A 28 2.127 -2.608 -2.449 1.00 0.00 C ATOM 454 C VAL A 28 2.146 -4.025 -1.900 1.00 0.00 C ATOM 455 O VAL A 28 2.860 -4.893 -2.418 1.00 0.00 O ATOM 456 CB VAL A 28 0.794 -2.378 -3.193 1.00 0.00 C ATOM 457 CG1 VAL A 28 0.687 -0.947 -3.690 1.00 0.00 C ATOM 458 CG2 VAL A 28 0.656 -3.353 -4.354 1.00 0.00 C ATOM 0 H VAL A 28 3.393 -3.136 -4.012 1.00 0.00 H new ATOM 0 HA VAL A 28 2.201 -1.888 -1.634 1.00 0.00 H new ATOM 0 HB VAL A 28 -0.019 -2.555 -2.489 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -0.261 -0.812 -4.210 1.00 0.00 H new ATOM 0 HG12 VAL A 28 0.736 -0.263 -2.843 1.00 0.00 H new ATOM 0 HG13 VAL A 28 1.509 -0.737 -4.374 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -0.289 -3.176 -4.867 1.00 0.00 H new ATOM 0 HG22 VAL A 28 1.480 -3.207 -5.052 1.00 0.00 H new ATOM 0 HG23 VAL A 28 0.678 -4.375 -3.975 1.00 0.00 H new ATOM 468 N LYS A 29 1.369 -4.254 -0.858 1.00 0.00 N ATOM 469 CA LYS A 29 1.241 -5.562 -0.279 1.00 0.00 C ATOM 470 C LYS A 29 -0.199 -6.020 -0.344 1.00 0.00 C ATOM 471 O LYS A 29 -1.129 -5.227 -0.190 1.00 0.00 O ATOM 472 CB LYS A 29 1.730 -5.557 1.157 1.00 0.00 C ATOM 473 CG LYS A 29 3.204 -5.241 1.268 1.00 0.00 C ATOM 474 CD LYS A 29 3.767 -5.662 2.605 1.00 0.00 C ATOM 475 CE LYS A 29 5.234 -5.291 2.719 1.00 0.00 C ATOM 476 NZ LYS A 29 6.013 -5.751 1.533 1.00 0.00 N ATOM 0 H LYS A 29 0.813 -3.535 -0.396 1.00 0.00 H new ATOM 0 HA LYS A 29 1.857 -6.258 -0.849 1.00 0.00 H new ATOM 0 HB2 LYS A 29 1.161 -4.823 1.728 1.00 0.00 H new ATOM 0 HB3 LYS A 29 1.536 -6.531 1.606 1.00 0.00 H new ATOM 0 HG2 LYS A 29 3.746 -5.748 0.469 1.00 0.00 H new ATOM 0 HG3 LYS A 29 3.358 -4.171 1.129 1.00 0.00 H new ATOM 0 HD2 LYS A 29 3.204 -5.185 3.407 1.00 0.00 H new ATOM 0 HD3 LYS A 29 3.650 -6.738 2.730 1.00 0.00 H new ATOM 0 HE2 LYS A 29 5.329 -4.210 2.820 1.00 0.00 H new ATOM 0 HE3 LYS A 29 5.652 -5.734 3.623 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 7.030 -5.634 1.719 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 5.808 -6.754 1.351 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 5.745 -5.186 0.702 1.00 0.00 H new ATOM 490 N ILE A 30 -0.360 -7.299 -0.585 1.00 0.00 N ATOM 491 CA ILE A 30 -1.665 -7.915 -0.680 1.00 0.00 C ATOM 492 C ILE A 30 -1.848 -8.811 0.514 1.00 0.00 C ATOM 493 O ILE A 30 -0.915 -9.489 0.942 1.00 0.00 O ATOM 494 CB ILE A 30 -1.831 -8.787 -1.939 1.00 0.00 C ATOM 495 CG1 ILE A 30 -1.046 -8.223 -3.135 1.00 0.00 C ATOM 496 CG2 ILE A 30 -3.309 -8.927 -2.278 1.00 0.00 C ATOM 497 CD1 ILE A 30 -1.517 -6.870 -3.615 1.00 0.00 C ATOM 0 H ILE A 30 0.415 -7.948 -0.722 1.00 0.00 H new ATOM 0 HA ILE A 30 -2.400 -7.111 -0.726 1.00 0.00 H new ATOM 0 HB ILE A 30 -1.418 -9.773 -1.724 1.00 0.00 H new ATOM 0 HG12 ILE A 30 0.006 -8.150 -2.860 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -1.111 -8.930 -3.962 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -3.421 -9.545 -3.169 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -3.831 -9.396 -1.444 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -3.735 -7.941 -2.464 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -0.907 -6.551 -4.460 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -2.560 -6.937 -3.925 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -1.425 -6.145 -2.807 1.00 0.00 H new ATOM 509 N LYS A 31 -3.034 -8.811 1.050 1.00 0.00 N ATOM 510 CA LYS A 31 -3.345 -9.638 2.168 1.00 0.00 C ATOM 511 C LYS A 31 -4.787 -10.077 2.109 1.00 0.00 C ATOM 512 O LYS A 31 -5.604 -9.520 1.371 1.00 0.00 O ATOM 513 CB LYS A 31 -3.091 -8.891 3.463 1.00 0.00 C ATOM 514 CG LYS A 31 -3.843 -7.583 3.562 1.00 0.00 C ATOM 515 CD LYS A 31 -3.581 -6.889 4.883 1.00 0.00 C ATOM 516 CE LYS A 31 -4.205 -7.634 6.051 1.00 0.00 C ATOM 517 NZ LYS A 31 -5.689 -7.523 6.037 1.00 0.00 N ATOM 0 H LYS A 31 -3.809 -8.236 0.721 1.00 0.00 H new ATOM 0 HA LYS A 31 -2.703 -10.518 2.134 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -3.373 -9.528 4.302 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -2.023 -8.695 3.557 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -3.547 -6.929 2.742 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -4.912 -7.768 3.453 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -2.506 -6.803 5.040 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -3.979 -5.875 4.845 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -3.917 -8.684 6.010 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -3.818 -7.234 6.988 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -6.072 -7.877 6.937 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -5.961 -6.527 5.913 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -6.072 -8.087 5.252 1.00 0.00 H new ATOM 531 N LEU A 32 -5.084 -11.058 2.916 1.00 0.00 N ATOM 532 CA LEU A 32 -6.408 -11.602 3.022 1.00 0.00 C ATOM 533 C LEU A 32 -6.918 -11.286 4.406 1.00 0.00 C ATOM 534 O LEU A 32 -6.213 -11.503 5.393 1.00 0.00 O ATOM 535 CB LEU A 32 -6.373 -13.102 2.750 1.00 0.00 C ATOM 536 CG LEU A 32 -6.027 -13.454 1.302 1.00 0.00 C ATOM 537 CD1 LEU A 32 -5.676 -14.921 1.159 1.00 0.00 C ATOM 538 CD2 LEU A 32 -7.189 -13.101 0.391 1.00 0.00 C ATOM 0 H LEU A 32 -4.402 -11.508 3.527 1.00 0.00 H new ATOM 0 HA LEU A 32 -7.081 -11.164 2.285 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -5.642 -13.566 3.412 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -7.344 -13.530 2.997 1.00 0.00 H new ATOM 0 HG LEU A 32 -5.152 -12.872 1.012 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -5.435 -15.138 0.118 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -4.815 -15.152 1.786 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -6.525 -15.530 1.470 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -6.935 -13.355 -0.638 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -8.073 -13.662 0.695 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -7.395 -12.033 0.461 1.00 0.00 H new ATOM 606 N VAL A 36 -8.342 -9.473 14.736 1.00 0.00 N ATOM 607 CA VAL A 36 -7.303 -9.121 15.685 1.00 0.00 C ATOM 608 C VAL A 36 -7.374 -10.027 16.908 1.00 0.00 C ATOM 609 O VAL A 36 -8.458 -10.427 17.341 1.00 0.00 O ATOM 610 CB VAL A 36 -7.408 -7.639 16.108 1.00 0.00 C ATOM 611 CG1 VAL A 36 -8.772 -7.330 16.702 1.00 0.00 C ATOM 612 CG2 VAL A 36 -6.308 -7.260 17.089 1.00 0.00 C ATOM 0 HA VAL A 36 -6.340 -9.263 15.195 1.00 0.00 H new ATOM 0 HB VAL A 36 -7.282 -7.039 15.207 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -8.814 -6.279 16.990 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -9.546 -7.535 15.962 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -8.936 -7.954 17.581 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -6.412 -6.211 17.365 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -6.387 -7.880 17.982 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -5.335 -7.418 16.623 1.00 0.00 H new ATOM 622 N GLU A 37 -6.219 -10.357 17.446 1.00 0.00 N ATOM 623 CA GLU A 37 -6.128 -11.239 18.586 1.00 0.00 C ATOM 624 C GLU A 37 -6.283 -10.468 19.893 1.00 0.00 C ATOM 625 O GLU A 37 -5.658 -9.422 20.086 1.00 0.00 O ATOM 626 CB GLU A 37 -4.792 -11.971 18.553 1.00 0.00 C ATOM 627 CG GLU A 37 -4.677 -12.967 17.411 1.00 0.00 C ATOM 628 CD GLU A 37 -5.728 -14.056 17.489 1.00 0.00 C ATOM 629 OE1 GLU A 37 -6.835 -13.863 16.951 1.00 0.00 O ATOM 630 OE2 GLU A 37 -5.452 -15.108 18.103 1.00 0.00 O ATOM 0 H GLU A 37 -5.319 -10.021 17.104 1.00 0.00 H new ATOM 0 HA GLU A 37 -6.940 -11.964 18.534 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -3.988 -11.240 18.470 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -4.650 -12.495 19.498 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -4.773 -12.440 16.462 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -3.686 -13.420 17.426 1.00 0.00 H new ATOM 637 N PRO A 38 -7.144 -10.959 20.794 1.00 0.00 N ATOM 638 CA PRO A 38 -7.346 -10.363 22.109 1.00 0.00 C ATOM 639 C PRO A 38 -6.247 -10.766 23.091 1.00 0.00 C ATOM 640 O PRO A 38 -5.213 -11.314 22.699 1.00 0.00 O ATOM 641 CB PRO A 38 -8.708 -10.919 22.562 1.00 0.00 C ATOM 642 CG PRO A 38 -9.210 -11.765 21.434 1.00 0.00 C ATOM 643 CD PRO A 38 -8.009 -12.123 20.609 1.00 0.00 C ATOM 0 HA PRO A 38 -7.318 -9.274 22.072 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -8.604 -11.507 23.474 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -9.405 -10.110 22.782 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -9.704 -12.661 21.810 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -9.944 -11.222 20.838 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -7.535 -13.041 20.958 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -8.267 -12.275 19.561 1.00 0.00 H new ATOM 651 N ILE A 39 -6.478 -10.504 24.363 1.00 0.00 N ATOM 652 CA ILE A 39 -5.504 -10.798 25.393 1.00 0.00 C ATOM 653 C ILE A 39 -5.859 -12.077 26.142 1.00 0.00 C ATOM 654 O ILE A 39 -6.954 -12.619 25.982 1.00 0.00 O ATOM 655 CB ILE A 39 -5.394 -9.638 26.398 1.00 0.00 C ATOM 656 CG1 ILE A 39 -6.775 -9.272 26.956 1.00 0.00 C ATOM 657 CG2 ILE A 39 -4.735 -8.430 25.746 1.00 0.00 C ATOM 658 CD1 ILE A 39 -6.742 -8.170 27.993 1.00 0.00 C ATOM 0 H ILE A 39 -7.341 -10.084 24.709 1.00 0.00 H new ATOM 0 HA ILE A 39 -4.544 -10.933 24.895 1.00 0.00 H new ATOM 0 HB ILE A 39 -4.769 -9.961 27.230 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -7.419 -8.964 26.133 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -7.225 -10.161 27.398 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -4.665 -7.619 26.470 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -3.735 -8.700 25.406 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -5.332 -8.105 24.894 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -7.755 -7.967 28.340 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -6.125 -8.482 28.836 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -6.322 -7.267 27.551 1.00 0.00 H new ATOM 670 N ASP A 40 -4.919 -12.559 26.940 1.00 0.00 N ATOM 671 CA ASP A 40 -5.125 -13.742 27.762 1.00 0.00 C ATOM 672 C ASP A 40 -4.297 -13.641 29.037 1.00 0.00 C ATOM 673 O ASP A 40 -3.175 -13.137 29.012 1.00 0.00 O ATOM 674 CB ASP A 40 -4.745 -15.003 26.985 1.00 0.00 C ATOM 675 CG ASP A 40 -4.896 -16.263 27.814 1.00 0.00 C ATOM 676 OD1 ASP A 40 -6.032 -16.572 28.237 1.00 0.00 O ATOM 677 OD2 ASP A 40 -3.876 -16.944 28.053 1.00 0.00 O ATOM 0 H ASP A 40 -3.993 -12.142 27.036 1.00 0.00 H new ATOM 0 HA ASP A 40 -6.180 -13.804 28.029 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -5.370 -15.080 26.096 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -3.713 -14.918 26.643 1.00 0.00 H new ATOM 682 N LEU A 41 -4.852 -14.109 30.145 1.00 0.00 N ATOM 683 CA LEU A 41 -4.171 -14.052 31.430 1.00 0.00 C ATOM 684 C LEU A 41 -4.077 -15.449 32.030 1.00 0.00 C ATOM 685 O LEU A 41 -4.891 -16.319 31.719 1.00 0.00 O ATOM 686 CB LEU A 41 -4.917 -13.110 32.383 1.00 0.00 C ATOM 687 CG LEU A 41 -4.231 -12.861 33.732 1.00 0.00 C ATOM 688 CD1 LEU A 41 -2.894 -12.161 33.532 1.00 0.00 C ATOM 689 CD2 LEU A 41 -5.131 -12.046 34.647 1.00 0.00 C ATOM 0 H LEU A 41 -5.778 -14.535 30.180 1.00 0.00 H new ATOM 0 HA LEU A 41 -3.163 -13.666 31.280 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -5.057 -12.151 31.883 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -5.909 -13.520 32.569 1.00 0.00 H new ATOM 0 HG LEU A 41 -4.045 -13.825 34.205 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -2.423 -11.993 34.500 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -2.246 -12.784 32.916 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -3.055 -11.204 33.036 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -4.627 -11.880 35.599 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -5.351 -11.086 34.180 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -6.061 -12.587 34.819 1.00 0.00 H new ATOM 701 N GLY A 42 -3.080 -15.668 32.872 1.00 0.00 N ATOM 702 CA GLY A 42 -2.923 -16.958 33.499 1.00 0.00 C ATOM 703 C GLY A 42 -3.483 -16.975 34.904 1.00 0.00 C ATOM 704 O GLY A 42 -4.501 -16.337 35.186 1.00 0.00 O ATOM 0 H GLY A 42 -2.378 -14.975 33.131 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -3.425 -17.717 32.899 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -1.866 -17.222 33.527 1.00 0.00 H new ATOM 708 N GLU A 43 -2.813 -17.694 35.787 1.00 0.00 N ATOM 709 CA GLU A 43 -3.255 -17.840 37.158 1.00 0.00 C ATOM 710 C GLU A 43 -2.302 -17.131 38.119 1.00 0.00 C ATOM 711 O GLU A 43 -1.098 -17.058 37.865 1.00 0.00 O ATOM 712 CB GLU A 43 -3.338 -19.324 37.514 1.00 0.00 C ATOM 713 CG GLU A 43 -2.082 -20.107 37.159 1.00 0.00 C ATOM 714 CD GLU A 43 -2.106 -21.524 37.686 1.00 0.00 C ATOM 715 OE1 GLU A 43 -2.628 -22.419 36.986 1.00 0.00 O ATOM 716 OE2 GLU A 43 -1.584 -21.755 38.796 1.00 0.00 O ATOM 0 H GLU A 43 -1.949 -18.191 35.572 1.00 0.00 H new ATOM 0 HA GLU A 43 -4.240 -17.383 37.254 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -3.528 -19.423 38.583 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -4.190 -19.766 36.997 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -1.967 -20.129 36.075 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -1.211 -19.589 37.561 1.00 0.00 H new ATOM 723 N PRO A 44 -2.836 -16.589 39.224 1.00 0.00 N ATOM 724 CA PRO A 44 -2.031 -15.974 40.284 1.00 0.00 C ATOM 725 C PRO A 44 -1.185 -17.014 41.015 1.00 0.00 C ATOM 726 O PRO A 44 -1.356 -18.222 40.808 1.00 0.00 O ATOM 727 CB PRO A 44 -3.073 -15.368 41.236 1.00 0.00 C ATOM 728 CG PRO A 44 -4.349 -15.353 40.467 1.00 0.00 C ATOM 729 CD PRO A 44 -4.270 -16.516 39.521 1.00 0.00 C ATOM 0 HA PRO A 44 -1.329 -15.238 39.892 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -3.169 -15.963 42.144 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -2.787 -14.362 41.543 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -5.207 -15.447 41.132 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -4.468 -14.415 39.925 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -4.637 -17.435 39.977 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -4.862 -16.348 38.622 1.00 0.00 H new ATOM 737 N VAL A 45 -0.277 -16.554 41.871 1.00 0.00 N ATOM 738 CA VAL A 45 0.597 -17.460 42.606 1.00 0.00 C ATOM 739 C VAL A 45 -0.211 -18.256 43.630 1.00 0.00 C ATOM 740 O VAL A 45 -1.257 -17.803 44.099 1.00 0.00 O ATOM 741 CB VAL A 45 1.732 -16.703 43.330 1.00 0.00 C ATOM 742 CG1 VAL A 45 2.808 -17.660 43.813 1.00 0.00 C ATOM 743 CG2 VAL A 45 2.328 -15.629 42.433 1.00 0.00 C ATOM 0 H VAL A 45 -0.128 -15.565 42.071 1.00 0.00 H new ATOM 0 HA VAL A 45 1.047 -18.136 41.879 1.00 0.00 H new ATOM 0 HB VAL A 45 1.301 -16.214 44.204 1.00 0.00 H new ATOM 0 HG11 VAL A 45 3.594 -17.099 44.319 1.00 0.00 H new ATOM 0 HG12 VAL A 45 2.371 -18.378 44.507 1.00 0.00 H new ATOM 0 HG13 VAL A 45 3.232 -18.191 42.961 1.00 0.00 H new ATOM 0 HG21 VAL A 45 3.125 -15.111 42.966 1.00 0.00 H new ATOM 0 HG22 VAL A 45 2.734 -16.091 41.533 1.00 0.00 H new ATOM 0 HG23 VAL A 45 1.553 -14.915 42.156 1.00 0.00 H new ATOM 753 N SER A 46 0.271 -19.439 43.969 1.00 0.00 N ATOM 754 CA SER A 46 -0.428 -20.309 44.892 1.00 0.00 C ATOM 755 C SER A 46 0.437 -20.664 46.091 1.00 0.00 C ATOM 756 O SER A 46 1.664 -20.518 46.064 1.00 0.00 O ATOM 757 CB SER A 46 -0.872 -21.579 44.173 1.00 0.00 C ATOM 758 OG SER A 46 0.089 -21.987 43.208 1.00 0.00 O ATOM 0 H SER A 46 1.149 -19.819 43.615 1.00 0.00 H new ATOM 0 HA SER A 46 -1.303 -19.774 45.260 1.00 0.00 H new ATOM 0 HB2 SER A 46 -1.023 -22.377 44.900 1.00 0.00 H new ATOM 0 HB3 SER A 46 -1.831 -21.407 43.685 1.00 0.00 H new ATOM 0 HG SER A 46 -0.220 -22.804 42.764 1.00 0.00 H new ATOM 764 N VAL A 47 -0.222 -21.132 47.139 1.00 0.00 N ATOM 765 CA VAL A 47 0.445 -21.528 48.373 1.00 0.00 C ATOM 766 C VAL A 47 -0.047 -22.905 48.803 1.00 0.00 C ATOM 767 O VAL A 47 -1.249 -23.183 48.754 1.00 0.00 O ATOM 768 CB VAL A 47 0.190 -20.516 49.517 1.00 0.00 C ATOM 769 CG1 VAL A 47 0.937 -20.916 50.779 1.00 0.00 C ATOM 770 CG2 VAL A 47 0.577 -19.112 49.090 1.00 0.00 C ATOM 0 H VAL A 47 -1.235 -21.249 47.160 1.00 0.00 H new ATOM 0 HA VAL A 47 1.517 -21.553 48.175 1.00 0.00 H new ATOM 0 HB VAL A 47 -0.877 -20.526 49.739 1.00 0.00 H new ATOM 0 HG11 VAL A 47 0.739 -20.187 51.565 1.00 0.00 H new ATOM 0 HG12 VAL A 47 0.601 -21.901 51.104 1.00 0.00 H new ATOM 0 HG13 VAL A 47 2.007 -20.947 50.574 1.00 0.00 H new ATOM 0 HG21 VAL A 47 0.389 -18.418 49.909 1.00 0.00 H new ATOM 0 HG22 VAL A 47 1.635 -19.089 48.830 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -0.015 -18.819 48.223 1.00 0.00 H new ATOM 780 N GLU A 48 0.874 -23.769 49.205 1.00 0.00 N ATOM 781 CA GLU A 48 0.523 -25.126 49.587 1.00 0.00 C ATOM 782 C GLU A 48 0.636 -25.329 51.097 1.00 0.00 C ATOM 783 O GLU A 48 1.618 -24.937 51.724 1.00 0.00 O ATOM 784 CB GLU A 48 1.387 -26.156 48.845 1.00 0.00 C ATOM 785 CG GLU A 48 2.891 -25.990 49.032 1.00 0.00 C ATOM 786 CD GLU A 48 3.468 -24.850 48.213 1.00 0.00 C ATOM 787 OE1 GLU A 48 3.745 -25.056 47.017 1.00 0.00 O ATOM 788 OE2 GLU A 48 3.665 -23.749 48.767 1.00 0.00 O ATOM 0 H GLU A 48 1.868 -23.553 49.275 1.00 0.00 H new ATOM 0 HA GLU A 48 -0.517 -25.280 49.300 1.00 0.00 H new ATOM 0 HB2 GLU A 48 1.103 -27.154 49.178 1.00 0.00 H new ATOM 0 HB3 GLU A 48 1.160 -26.099 47.780 1.00 0.00 H new ATOM 0 HG2 GLU A 48 3.103 -25.816 50.087 1.00 0.00 H new ATOM 0 HG3 GLU A 48 3.391 -26.918 48.755 1.00 0.00 H new ATOM 795 N GLU A 49 -0.389 -25.950 51.662 1.00 0.00 N ATOM 796 CA GLU A 49 -0.421 -26.285 53.085 1.00 0.00 C ATOM 797 C GLU A 49 0.371 -27.556 53.349 1.00 0.00 C ATOM 798 O GLU A 49 0.762 -27.838 54.483 1.00 0.00 O ATOM 799 CB GLU A 49 -1.856 -26.437 53.607 1.00 0.00 C ATOM 800 CG GLU A 49 -2.729 -27.385 52.796 1.00 0.00 C ATOM 801 CD GLU A 49 -3.241 -26.747 51.522 1.00 0.00 C ATOM 802 OE1 GLU A 49 -4.265 -26.040 51.583 1.00 0.00 O ATOM 803 OE2 GLU A 49 -2.613 -26.928 50.460 1.00 0.00 O ATOM 0 H GLU A 49 -1.223 -26.237 51.150 1.00 0.00 H new ATOM 0 HA GLU A 49 0.039 -25.457 53.624 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -1.818 -26.791 54.637 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -2.328 -25.455 53.624 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -2.157 -28.279 52.548 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -3.575 -27.706 53.404 1.00 0.00 H new ATOM 810 N ILE A 50 0.556 -28.345 52.298 1.00 0.00 N ATOM 811 CA ILE A 50 1.315 -29.590 52.380 1.00 0.00 C ATOM 812 C ILE A 50 2.773 -29.292 52.741 1.00 0.00 C ATOM 813 O ILE A 50 3.540 -30.178 53.121 1.00 0.00 O ATOM 814 CB ILE A 50 1.257 -30.365 51.040 1.00 0.00 C ATOM 815 CG1 ILE A 50 -0.189 -30.459 50.537 1.00 0.00 C ATOM 816 CG2 ILE A 50 1.851 -31.757 51.197 1.00 0.00 C ATOM 817 CD1 ILE A 50 -0.325 -31.128 49.184 1.00 0.00 C ATOM 0 H ILE A 50 0.187 -28.143 51.369 1.00 0.00 H new ATOM 0 HA ILE A 50 0.867 -30.210 53.157 1.00 0.00 H new ATOM 0 HB ILE A 50 1.848 -29.819 50.305 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -0.782 -31.011 51.266 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -0.609 -29.455 50.479 1.00 0.00 H new ATOM 0 HG21 ILE A 50 1.800 -32.284 50.244 1.00 0.00 H new ATOM 0 HG22 ILE A 50 2.891 -31.675 51.511 1.00 0.00 H new ATOM 0 HG23 ILE A 50 1.287 -32.310 51.948 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -1.376 -31.157 48.896 1.00 0.00 H new ATOM 0 HD12 ILE A 50 0.239 -30.564 48.441 1.00 0.00 H new ATOM 0 HD13 ILE A 50 0.064 -32.145 49.240 1.00 0.00 H new ATOM 829 N LYS A 51 3.133 -28.027 52.630 1.00 0.00 N ATOM 830 CA LYS A 51 4.443 -27.555 53.050 1.00 0.00 C ATOM 831 C LYS A 51 4.349 -27.053 54.486 1.00 0.00 C ATOM 832 O LYS A 51 3.442 -26.290 54.820 1.00 0.00 O ATOM 833 CB LYS A 51 4.903 -26.433 52.115 1.00 0.00 C ATOM 834 CG LYS A 51 6.252 -25.819 52.463 1.00 0.00 C ATOM 835 CD LYS A 51 6.526 -24.606 51.590 1.00 0.00 C ATOM 836 CE LYS A 51 6.599 -24.982 50.120 1.00 0.00 C ATOM 837 NZ LYS A 51 6.399 -23.802 49.241 1.00 0.00 N ATOM 0 H LYS A 51 2.530 -27.299 52.248 1.00 0.00 H new ATOM 0 HA LYS A 51 5.170 -28.365 53.003 1.00 0.00 H new ATOM 0 HB2 LYS A 51 4.950 -26.824 51.098 1.00 0.00 H new ATOM 0 HB3 LYS A 51 4.150 -25.645 52.119 1.00 0.00 H new ATOM 0 HG2 LYS A 51 6.266 -25.529 53.514 1.00 0.00 H new ATOM 0 HG3 LYS A 51 7.041 -26.559 52.326 1.00 0.00 H new ATOM 0 HD2 LYS A 51 5.741 -23.865 51.738 1.00 0.00 H new ATOM 0 HD3 LYS A 51 7.464 -24.142 51.895 1.00 0.00 H new ATOM 0 HE2 LYS A 51 7.568 -25.434 49.908 1.00 0.00 H new ATOM 0 HE3 LYS A 51 5.841 -25.734 49.898 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 6.733 -24.023 48.281 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 5.388 -23.561 49.208 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 6.936 -22.994 49.617 1.00 0.00 H new ATOM 1211 N ILE B 4 2.068 -11.373 3.737 1.00 0.00 N ATOM 1212 CA ILE B 4 1.825 -10.371 2.736 1.00 0.00 C ATOM 1213 C ILE B 4 2.310 -10.858 1.384 1.00 0.00 C ATOM 1214 O ILE B 4 3.297 -11.591 1.293 1.00 0.00 O ATOM 1215 CB ILE B 4 2.541 -9.047 3.051 1.00 0.00 C ATOM 1216 CG1 ILE B 4 4.041 -9.258 3.286 1.00 0.00 C ATOM 1217 CG2 ILE B 4 1.899 -8.338 4.229 1.00 0.00 C ATOM 1218 CD1 ILE B 4 4.428 -9.757 4.668 1.00 0.00 C ATOM 0 HA ILE B 4 0.750 -10.194 2.725 1.00 0.00 H new ATOM 0 HB ILE B 4 2.433 -8.406 2.176 1.00 0.00 H new ATOM 0 HG12 ILE B 4 4.409 -9.969 2.547 1.00 0.00 H new ATOM 0 HG13 ILE B 4 4.555 -8.314 3.104 1.00 0.00 H new ATOM 0 HG21 ILE B 4 2.429 -7.406 4.425 1.00 0.00 H new ATOM 0 HG22 ILE B 4 0.856 -8.121 3.999 1.00 0.00 H new ATOM 0 HG23 ILE B 4 1.950 -8.977 5.110 1.00 0.00 H new ATOM 0 HD11 ILE B 4 5.511 -9.871 4.724 1.00 0.00 H new ATOM 0 HD12 ILE B 4 4.100 -9.039 5.419 1.00 0.00 H new ATOM 0 HD13 ILE B 4 3.952 -10.720 4.854 1.00 0.00 H new ATOM 1230 N ILE B 5 1.591 -10.494 0.344 1.00 0.00 N ATOM 1231 CA ILE B 5 2.052 -10.734 -1.007 1.00 0.00 C ATOM 1232 C ILE B 5 2.547 -9.423 -1.589 1.00 0.00 C ATOM 1233 O ILE B 5 2.000 -8.366 -1.298 1.00 0.00 O ATOM 1234 CB ILE B 5 0.942 -11.288 -1.918 1.00 0.00 C ATOM 1235 CG1 ILE B 5 0.128 -12.359 -1.189 1.00 0.00 C ATOM 1236 CG2 ILE B 5 1.539 -11.861 -3.195 1.00 0.00 C ATOM 1237 CD1 ILE B 5 -1.022 -12.902 -2.005 1.00 0.00 C ATOM 0 H ILE B 5 0.685 -10.031 0.408 1.00 0.00 H new ATOM 0 HA ILE B 5 2.846 -11.479 -0.960 1.00 0.00 H new ATOM 0 HB ILE B 5 0.275 -10.467 -2.181 1.00 0.00 H new ATOM 0 HG12 ILE B 5 0.788 -13.182 -0.914 1.00 0.00 H new ATOM 0 HG13 ILE B 5 -0.261 -11.939 -0.261 1.00 0.00 H new ATOM 0 HG21 ILE B 5 0.741 -12.248 -3.828 1.00 0.00 H new ATOM 0 HG22 ILE B 5 2.077 -11.078 -3.729 1.00 0.00 H new ATOM 0 HG23 ILE B 5 2.227 -12.668 -2.945 1.00 0.00 H new ATOM 0 HD11 ILE B 5 -1.555 -13.656 -1.426 1.00 0.00 H new ATOM 0 HD12 ILE B 5 -1.704 -12.090 -2.258 1.00 0.00 H new ATOM 0 HD13 ILE B 5 -0.638 -13.352 -2.921 1.00 0.00 H new ATOM 1249 N GLU B 6 3.573 -9.488 -2.398 1.00 0.00 N ATOM 1250 CA GLU B 6 4.125 -8.294 -3.001 1.00 0.00 C ATOM 1251 C GLU B 6 3.747 -8.219 -4.471 1.00 0.00 C ATOM 1252 O GLU B 6 3.891 -9.191 -5.224 1.00 0.00 O ATOM 1253 CB GLU B 6 5.644 -8.237 -2.831 1.00 0.00 C ATOM 1254 CG GLU B 6 6.099 -7.718 -1.472 1.00 0.00 C ATOM 1255 CD GLU B 6 5.761 -8.642 -0.324 1.00 0.00 C ATOM 1256 OE1 GLU B 6 6.031 -9.856 -0.434 1.00 0.00 O ATOM 1257 OE2 GLU B 6 5.237 -8.149 0.694 1.00 0.00 O ATOM 0 H GLU B 6 4.046 -10.354 -2.657 1.00 0.00 H new ATOM 0 HA GLU B 6 3.701 -7.431 -2.488 1.00 0.00 H new ATOM 0 HB2 GLU B 6 6.053 -9.236 -2.982 1.00 0.00 H new ATOM 0 HB3 GLU B 6 6.062 -7.600 -3.610 1.00 0.00 H new ATOM 0 HG2 GLU B 6 7.177 -7.561 -1.495 1.00 0.00 H new ATOM 0 HG3 GLU B 6 5.640 -6.746 -1.292 1.00 0.00 H new ATOM 1264 N ALA B 7 3.247 -7.064 -4.862 1.00 0.00 N ATOM 1265 CA ALA B 7 2.812 -6.822 -6.224 1.00 0.00 C ATOM 1266 C ALA B 7 3.211 -5.413 -6.646 1.00 0.00 C ATOM 1267 O ALA B 7 3.395 -4.534 -5.800 1.00 0.00 O ATOM 1268 CB ALA B 7 1.303 -6.989 -6.322 1.00 0.00 C ATOM 0 H ALA B 7 3.130 -6.263 -4.241 1.00 0.00 H new ATOM 0 HA ALA B 7 3.290 -7.542 -6.888 1.00 0.00 H new ATOM 0 HB1 ALA B 7 0.983 -6.806 -7.348 1.00 0.00 H new ATOM 0 HB2 ALA B 7 1.030 -8.004 -6.032 1.00 0.00 H new ATOM 0 HB3 ALA B 7 0.814 -6.277 -5.657 1.00 0.00 H new ATOM 1274 N VAL B 8 3.362 -5.206 -7.943 1.00 0.00 N ATOM 1275 CA VAL B 8 3.656 -3.903 -8.487 1.00 0.00 C ATOM 1276 C VAL B 8 2.466 -3.360 -9.276 1.00 0.00 C ATOM 1277 O VAL B 8 2.044 -3.934 -10.281 1.00 0.00 O ATOM 1278 CB VAL B 8 4.917 -3.930 -9.378 1.00 0.00 C ATOM 1279 CG1 VAL B 8 6.177 -3.974 -8.522 1.00 0.00 C ATOM 1280 CG2 VAL B 8 4.889 -5.104 -10.351 1.00 0.00 C ATOM 0 H VAL B 8 3.283 -5.942 -8.645 1.00 0.00 H new ATOM 0 HA VAL B 8 3.851 -3.239 -7.645 1.00 0.00 H new ATOM 0 HB VAL B 8 4.927 -3.012 -9.966 1.00 0.00 H new ATOM 0 HG11 VAL B 8 7.055 -3.993 -9.168 1.00 0.00 H new ATOM 0 HG12 VAL B 8 6.214 -3.091 -7.884 1.00 0.00 H new ATOM 0 HG13 VAL B 8 6.164 -4.870 -7.901 1.00 0.00 H new ATOM 0 HG21 VAL B 8 5.792 -5.092 -10.962 1.00 0.00 H new ATOM 0 HG22 VAL B 8 4.842 -6.039 -9.792 1.00 0.00 H new ATOM 0 HG23 VAL B 8 4.014 -5.022 -10.995 1.00 0.00 H new ATOM 1290 N TYR B 9 1.905 -2.274 -8.779 1.00 0.00 N ATOM 1291 CA TYR B 9 0.821 -1.565 -9.447 1.00 0.00 C ATOM 1292 C TYR B 9 1.382 -0.781 -10.617 1.00 0.00 C ATOM 1293 O TYR B 9 2.141 0.161 -10.439 1.00 0.00 O ATOM 1294 CB TYR B 9 0.158 -0.640 -8.421 1.00 0.00 C ATOM 1295 CG TYR B 9 -1.154 -0.009 -8.825 1.00 0.00 C ATOM 1296 CD1 TYR B 9 -2.310 -0.765 -8.921 1.00 0.00 C ATOM 1297 CD2 TYR B 9 -1.246 1.356 -9.066 1.00 0.00 C ATOM 1298 CE1 TYR B 9 -3.516 -0.190 -9.248 1.00 0.00 C ATOM 1299 CE2 TYR B 9 -2.455 1.942 -9.386 1.00 0.00 C ATOM 1300 CZ TYR B 9 -3.587 1.164 -9.475 1.00 0.00 C ATOM 1301 OH TYR B 9 -4.796 1.735 -9.789 1.00 0.00 O ATOM 0 H TYR B 9 2.188 -1.853 -7.894 1.00 0.00 H new ATOM 0 HA TYR B 9 0.076 -2.259 -9.837 1.00 0.00 H new ATOM 0 HB2 TYR B 9 -0.005 -1.209 -7.506 1.00 0.00 H new ATOM 0 HB3 TYR B 9 0.860 0.158 -8.179 1.00 0.00 H new ATOM 0 HD1 TYR B 9 -2.264 -1.828 -8.735 1.00 0.00 H new ATOM 0 HD2 TYR B 9 -0.359 1.968 -9.002 1.00 0.00 H new ATOM 0 HE1 TYR B 9 -4.404 -0.800 -9.326 1.00 0.00 H new ATOM 0 HE2 TYR B 9 -2.512 3.005 -9.566 1.00 0.00 H new ATOM 0 HH TYR B 9 -4.723 2.710 -9.727 1.00 0.00 H new ATOM 1311 N GLU B 10 1.032 -1.212 -11.812 1.00 0.00 N ATOM 1312 CA GLU B 10 1.497 -0.574 -13.023 1.00 0.00 C ATOM 1313 C GLU B 10 0.331 -0.066 -13.841 1.00 0.00 C ATOM 1314 O GLU B 10 -0.520 -0.836 -14.275 1.00 0.00 O ATOM 1315 CB GLU B 10 2.333 -1.534 -13.857 1.00 0.00 C ATOM 1316 CG GLU B 10 2.845 -0.929 -15.155 1.00 0.00 C ATOM 1317 CD GLU B 10 3.649 -1.908 -15.988 1.00 0.00 C ATOM 1318 OE1 GLU B 10 3.048 -2.838 -16.569 1.00 0.00 O ATOM 1319 OE2 GLU B 10 4.886 -1.744 -16.078 1.00 0.00 O ATOM 0 H GLU B 10 0.419 -2.012 -11.969 1.00 0.00 H new ATOM 0 HA GLU B 10 2.121 0.272 -12.734 1.00 0.00 H new ATOM 0 HB2 GLU B 10 3.183 -1.872 -13.264 1.00 0.00 H new ATOM 0 HB3 GLU B 10 1.735 -2.416 -14.088 1.00 0.00 H new ATOM 0 HG2 GLU B 10 1.999 -0.571 -15.741 1.00 0.00 H new ATOM 0 HG3 GLU B 10 3.464 -0.061 -14.926 1.00 0.00 H new ATOM 1326 N ASN B 11 0.297 1.240 -14.001 1.00 0.00 N ATOM 1327 CA ASN B 11 -0.662 1.924 -14.877 1.00 0.00 C ATOM 1328 C ASN B 11 -2.113 1.719 -14.444 1.00 0.00 C ATOM 1329 O ASN B 11 -3.040 1.942 -15.225 1.00 0.00 O ATOM 1330 CB ASN B 11 -0.483 1.446 -16.319 1.00 0.00 C ATOM 1331 CG ASN B 11 -0.451 2.589 -17.324 1.00 0.00 C ATOM 1332 OD1 ASN B 11 -0.951 2.459 -18.441 1.00 0.00 O ATOM 1333 ND2 ASN B 11 0.161 3.710 -16.957 1.00 0.00 N ATOM 0 H ASN B 11 0.938 1.875 -13.525 1.00 0.00 H new ATOM 0 HA ASN B 11 -0.452 2.991 -14.804 1.00 0.00 H new ATOM 0 HB2 ASN B 11 0.443 0.876 -16.395 1.00 0.00 H new ATOM 0 HB3 ASN B 11 -1.297 0.767 -16.575 1.00 0.00 H new ATOM 0 HD21 ASN B 11 0.226 4.492 -17.608 1.00 0.00 H new ATOM 0 HD22 ASN B 11 0.566 3.788 -16.024 1.00 0.00 H new ATOM 1340 N GLY B 12 -2.315 1.337 -13.196 1.00 0.00 N ATOM 1341 CA GLY B 12 -3.663 1.102 -12.716 1.00 0.00 C ATOM 1342 C GLY B 12 -3.937 -0.367 -12.476 1.00 0.00 C ATOM 1343 O GLY B 12 -5.063 -0.756 -12.160 1.00 0.00 O ATOM 0 H GLY B 12 -1.577 1.185 -12.508 1.00 0.00 H new ATOM 0 HA2 GLY B 12 -3.818 1.655 -11.790 1.00 0.00 H new ATOM 0 HA3 GLY B 12 -4.378 1.489 -13.442 1.00 0.00 H new ATOM 1347 N VAL B 13 -2.902 -1.183 -12.622 1.00 0.00 N ATOM 1348 CA VAL B 13 -3.030 -2.630 -12.444 1.00 0.00 C ATOM 1349 C VAL B 13 -2.158 -3.111 -11.300 1.00 0.00 C ATOM 1350 O VAL B 13 -1.052 -2.637 -11.149 1.00 0.00 O ATOM 1351 CB VAL B 13 -2.538 -3.379 -13.684 1.00 0.00 C ATOM 1352 CG1 VAL B 13 -3.034 -4.812 -13.674 1.00 0.00 C ATOM 1353 CG2 VAL B 13 -2.944 -2.668 -14.971 1.00 0.00 C ATOM 0 H VAL B 13 -1.962 -0.871 -12.864 1.00 0.00 H new ATOM 0 HA VAL B 13 -4.085 -2.825 -12.253 1.00 0.00 H new ATOM 0 HB VAL B 13 -1.449 -3.392 -13.652 1.00 0.00 H new ATOM 0 HG11 VAL B 13 -2.674 -5.328 -14.564 1.00 0.00 H new ATOM 0 HG12 VAL B 13 -2.662 -5.320 -12.784 1.00 0.00 H new ATOM 0 HG13 VAL B 13 -4.124 -4.820 -13.667 1.00 0.00 H new ATOM 0 HG21 VAL B 13 -2.576 -3.231 -15.829 1.00 0.00 H new ATOM 0 HG22 VAL B 13 -4.031 -2.599 -15.021 1.00 0.00 H new ATOM 0 HG23 VAL B 13 -2.516 -1.666 -14.984 1.00 0.00 H new ATOM 1363 N PHE B 14 -2.623 -4.069 -10.522 1.00 0.00 N ATOM 1364 CA PHE B 14 -1.754 -4.697 -9.539 1.00 0.00 C ATOM 1365 C PHE B 14 -1.209 -6.009 -10.100 1.00 0.00 C ATOM 1366 O PHE B 14 -1.969 -6.936 -10.387 1.00 0.00 O ATOM 1367 CB PHE B 14 -2.491 -4.977 -8.229 1.00 0.00 C ATOM 1368 CG PHE B 14 -2.846 -3.768 -7.410 1.00 0.00 C ATOM 1369 CD1 PHE B 14 -1.879 -3.111 -6.673 1.00 0.00 C ATOM 1370 CD2 PHE B 14 -4.154 -3.309 -7.355 1.00 0.00 C ATOM 1371 CE1 PHE B 14 -2.205 -2.017 -5.894 1.00 0.00 C ATOM 1372 CE2 PHE B 14 -4.485 -2.212 -6.580 1.00 0.00 C ATOM 1373 CZ PHE B 14 -3.508 -1.566 -5.847 1.00 0.00 C ATOM 0 H PHE B 14 -3.578 -4.426 -10.547 1.00 0.00 H new ATOM 0 HA PHE B 14 -0.937 -4.007 -9.328 1.00 0.00 H new ATOM 0 HB2 PHE B 14 -3.408 -5.520 -8.458 1.00 0.00 H new ATOM 0 HB3 PHE B 14 -1.873 -5.637 -7.620 1.00 0.00 H new ATOM 0 HD1 PHE B 14 -0.856 -3.457 -6.706 1.00 0.00 H new ATOM 0 HD2 PHE B 14 -4.922 -3.813 -7.923 1.00 0.00 H new ATOM 0 HE1 PHE B 14 -1.439 -1.515 -5.322 1.00 0.00 H new ATOM 0 HE2 PHE B 14 -5.506 -1.861 -6.548 1.00 0.00 H new ATOM 0 HZ PHE B 14 -3.764 -0.711 -5.239 1.00 0.00 H new ATOM 1383 N LYS B 15 0.100 -6.074 -10.268 1.00 0.00 N ATOM 1384 CA LYS B 15 0.756 -7.268 -10.776 1.00 0.00 C ATOM 1385 C LYS B 15 1.709 -7.838 -9.744 1.00 0.00 C ATOM 1386 O LYS B 15 2.727 -7.227 -9.440 1.00 0.00 O ATOM 1387 CB LYS B 15 1.539 -6.929 -12.038 1.00 0.00 C ATOM 1388 CG LYS B 15 0.671 -6.559 -13.225 1.00 0.00 C ATOM 1389 CD LYS B 15 -0.129 -7.749 -13.734 1.00 0.00 C ATOM 1390 CE LYS B 15 -0.984 -7.378 -14.938 1.00 0.00 C ATOM 1391 NZ LYS B 15 -0.160 -6.918 -16.087 1.00 0.00 N ATOM 0 H LYS B 15 0.736 -5.305 -10.058 1.00 0.00 H new ATOM 0 HA LYS B 15 -0.011 -8.009 -11.000 1.00 0.00 H new ATOM 0 HB2 LYS B 15 2.213 -6.100 -11.822 1.00 0.00 H new ATOM 0 HB3 LYS B 15 2.160 -7.783 -12.308 1.00 0.00 H new ATOM 0 HG2 LYS B 15 -0.011 -5.758 -12.941 1.00 0.00 H new ATOM 0 HG3 LYS B 15 1.299 -6.173 -14.028 1.00 0.00 H new ATOM 0 HD2 LYS B 15 0.552 -8.556 -14.006 1.00 0.00 H new ATOM 0 HD3 LYS B 15 -0.768 -8.126 -12.936 1.00 0.00 H new ATOM 0 HE2 LYS B 15 -1.578 -8.241 -15.240 1.00 0.00 H new ATOM 0 HE3 LYS B 15 -1.684 -6.592 -14.657 1.00 0.00 H new ATOM 0 HZ1 LYS B 15 -0.743 -6.903 -16.948 1.00 0.00 H new ATOM 0 HZ2 LYS B 15 0.199 -5.961 -15.895 1.00 0.00 H new ATOM 0 HZ3 LYS B 15 0.641 -7.568 -16.222 1.00 0.00 H new ATOM 1405 N PRO B 16 1.405 -9.011 -9.178 1.00 0.00 N ATOM 1406 CA PRO B 16 2.286 -9.628 -8.194 1.00 0.00 C ATOM 1407 C PRO B 16 3.661 -9.922 -8.767 1.00 0.00 C ATOM 1408 O PRO B 16 3.873 -9.895 -9.979 1.00 0.00 O ATOM 1409 CB PRO B 16 1.572 -10.934 -7.828 1.00 0.00 C ATOM 1410 CG PRO B 16 0.581 -11.167 -8.920 1.00 0.00 C ATOM 1411 CD PRO B 16 0.205 -9.811 -9.442 1.00 0.00 C ATOM 0 HA PRO B 16 2.459 -8.974 -7.339 1.00 0.00 H new ATOM 0 HB2 PRO B 16 2.279 -11.761 -7.757 1.00 0.00 H new ATOM 0 HB3 PRO B 16 1.077 -10.853 -6.860 1.00 0.00 H new ATOM 0 HG2 PRO B 16 1.010 -11.783 -9.710 1.00 0.00 H new ATOM 0 HG3 PRO B 16 -0.295 -11.696 -8.544 1.00 0.00 H new ATOM 0 HD2 PRO B 16 -0.035 -9.840 -10.505 1.00 0.00 H new ATOM 0 HD3 PRO B 16 -0.669 -9.409 -8.929 1.00 0.00 H new ATOM 1419 N LEU B 17 4.575 -10.245 -7.884 1.00 0.00 N ATOM 1420 CA LEU B 17 5.922 -10.622 -8.284 1.00 0.00 C ATOM 1421 C LEU B 17 6.112 -12.086 -7.985 1.00 0.00 C ATOM 1422 O LEU B 17 6.944 -12.765 -8.580 1.00 0.00 O ATOM 1423 CB LEU B 17 6.995 -9.800 -7.554 1.00 0.00 C ATOM 1424 CG LEU B 17 7.087 -8.321 -7.940 1.00 0.00 C ATOM 1425 CD1 LEU B 17 5.975 -7.518 -7.294 1.00 0.00 C ATOM 1426 CD2 LEU B 17 8.445 -7.758 -7.551 1.00 0.00 C ATOM 0 H LEU B 17 4.415 -10.256 -6.877 1.00 0.00 H new ATOM 0 HA LEU B 17 6.036 -10.422 -9.350 1.00 0.00 H new ATOM 0 HB2 LEU B 17 6.807 -9.864 -6.482 1.00 0.00 H new ATOM 0 HB3 LEU B 17 7.965 -10.263 -7.735 1.00 0.00 H new ATOM 0 HG LEU B 17 6.972 -8.245 -9.021 1.00 0.00 H new ATOM 0 HD11 LEU B 17 6.065 -6.472 -7.586 1.00 0.00 H new ATOM 0 HD12 LEU B 17 5.010 -7.904 -7.622 1.00 0.00 H new ATOM 0 HD13 LEU B 17 6.049 -7.600 -6.210 1.00 0.00 H new ATOM 0 HD21 LEU B 17 8.497 -6.706 -7.831 1.00 0.00 H new ATOM 0 HD22 LEU B 17 8.584 -7.854 -6.474 1.00 0.00 H new ATOM 0 HD23 LEU B 17 9.230 -8.310 -8.068 1.00 0.00 H new ATOM 1438 N GLN B 18 5.289 -12.565 -7.070 1.00 0.00 N ATOM 1439 CA GLN B 18 5.374 -13.956 -6.625 1.00 0.00 C ATOM 1440 C GLN B 18 4.124 -14.722 -6.995 1.00 0.00 C ATOM 1441 O GLN B 18 3.986 -15.912 -6.709 1.00 0.00 O ATOM 1442 CB GLN B 18 5.609 -14.006 -5.127 1.00 0.00 C ATOM 1443 CG GLN B 18 4.942 -12.876 -4.359 1.00 0.00 C ATOM 1444 CD GLN B 18 5.200 -12.947 -2.868 1.00 0.00 C ATOM 1445 OE1 GLN B 18 5.267 -14.023 -2.277 1.00 0.00 O ATOM 1446 NE2 GLN B 18 5.398 -11.789 -2.265 1.00 0.00 N ATOM 0 H GLN B 18 4.555 -12.019 -6.618 1.00 0.00 H new ATOM 0 HA GLN B 18 6.215 -14.430 -7.130 1.00 0.00 H new ATOM 0 HB2 GLN B 18 5.242 -14.958 -4.744 1.00 0.00 H new ATOM 0 HB3 GLN B 18 6.682 -13.977 -4.937 1.00 0.00 H new ATOM 0 HG2 GLN B 18 5.303 -11.921 -4.740 1.00 0.00 H new ATOM 0 HG3 GLN B 18 3.867 -12.905 -4.539 1.00 0.00 H new ATOM 0 HE21 GLN B 18 5.332 -10.920 -2.795 1.00 0.00 H new ATOM 0 HE22 GLN B 18 5.617 -11.763 -1.269 1.00 0.00 H new ATOM 1455 N LYS B 19 3.271 -14.014 -7.695 1.00 0.00 N ATOM 1456 CA LYS B 19 1.987 -14.500 -8.160 1.00 0.00 C ATOM 1457 C LYS B 19 1.093 -15.035 -7.038 1.00 0.00 C ATOM 1458 O LYS B 19 1.516 -15.207 -5.893 1.00 0.00 O ATOM 1459 CB LYS B 19 2.201 -15.539 -9.243 1.00 0.00 C ATOM 1460 CG LYS B 19 2.747 -14.951 -10.534 1.00 0.00 C ATOM 1461 CD LYS B 19 3.027 -16.021 -11.573 1.00 0.00 C ATOM 1462 CE LYS B 19 4.290 -16.805 -11.250 1.00 0.00 C ATOM 1463 NZ LYS B 19 4.611 -17.790 -12.313 1.00 0.00 N ATOM 0 H LYS B 19 3.455 -13.049 -7.968 1.00 0.00 H new ATOM 0 HA LYS B 19 1.447 -13.648 -8.573 1.00 0.00 H new ATOM 0 HB2 LYS B 19 2.891 -16.300 -8.877 1.00 0.00 H new ATOM 0 HB3 LYS B 19 1.255 -16.039 -9.450 1.00 0.00 H new ATOM 0 HG2 LYS B 19 2.032 -14.233 -10.936 1.00 0.00 H new ATOM 0 HG3 LYS B 19 3.665 -14.402 -10.323 1.00 0.00 H new ATOM 0 HD2 LYS B 19 2.179 -16.704 -11.629 1.00 0.00 H new ATOM 0 HD3 LYS B 19 3.128 -15.557 -12.554 1.00 0.00 H new ATOM 0 HE2 LYS B 19 5.125 -16.115 -11.128 1.00 0.00 H new ATOM 0 HE3 LYS B 19 4.164 -17.323 -10.300 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 5.478 -18.305 -12.058 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 3.824 -18.463 -12.412 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 4.756 -17.293 -13.215 1.00 0.00 H new ATOM 1477 N VAL B 20 -0.170 -15.249 -7.378 1.00 0.00 N ATOM 1478 CA VAL B 20 -1.182 -15.661 -6.413 1.00 0.00 C ATOM 1479 C VAL B 20 -2.146 -16.612 -7.062 1.00 0.00 C ATOM 1480 O VAL B 20 -2.304 -16.617 -8.278 1.00 0.00 O ATOM 1481 CB VAL B 20 -1.974 -14.448 -5.861 1.00 0.00 C ATOM 1482 CG1 VAL B 20 -2.716 -14.824 -4.593 1.00 0.00 C ATOM 1483 CG2 VAL B 20 -1.071 -13.255 -5.603 1.00 0.00 C ATOM 0 H VAL B 20 -0.523 -15.142 -8.329 1.00 0.00 H new ATOM 0 HA VAL B 20 -0.667 -16.146 -5.584 1.00 0.00 H new ATOM 0 HB VAL B 20 -2.697 -14.161 -6.624 1.00 0.00 H new ATOM 0 HG11 VAL B 20 -3.265 -13.958 -4.222 1.00 0.00 H new ATOM 0 HG12 VAL B 20 -3.415 -15.633 -4.807 1.00 0.00 H new ATOM 0 HG13 VAL B 20 -2.002 -15.151 -3.837 1.00 0.00 H new ATOM 0 HG21 VAL B 20 -1.664 -12.426 -5.217 1.00 0.00 H new ATOM 0 HG22 VAL B 20 -0.309 -13.527 -4.873 1.00 0.00 H new ATOM 0 HG23 VAL B 20 -0.590 -12.954 -6.534 1.00 0.00 H new ATOM 1493 N ASP B 21 -2.755 -17.446 -6.251 1.00 0.00 N ATOM 1494 CA ASP B 21 -3.833 -18.265 -6.720 1.00 0.00 C ATOM 1495 C ASP B 21 -4.942 -18.269 -5.705 1.00 0.00 C ATOM 1496 O ASP B 21 -5.010 -19.087 -4.783 1.00 0.00 O ATOM 1497 CB ASP B 21 -3.343 -19.661 -6.988 1.00 0.00 C ATOM 1498 CG ASP B 21 -4.411 -20.562 -7.584 1.00 0.00 C ATOM 1499 OD1 ASP B 21 -4.560 -20.573 -8.822 1.00 0.00 O ATOM 1500 OD2 ASP B 21 -5.100 -21.274 -6.822 1.00 0.00 O ATOM 0 H ASP B 21 -2.518 -17.570 -5.267 1.00 0.00 H new ATOM 0 HA ASP B 21 -4.219 -17.857 -7.654 1.00 0.00 H new ATOM 0 HB2 ASP B 21 -2.492 -19.617 -7.668 1.00 0.00 H new ATOM 0 HB3 ASP B 21 -2.984 -20.099 -6.057 1.00 0.00 H new ATOM 1505 N LEU B 22 -5.758 -17.277 -5.870 1.00 0.00 N ATOM 1506 CA LEU B 22 -7.045 -17.190 -5.225 1.00 0.00 C ATOM 1507 C LEU B 22 -8.117 -16.809 -6.239 1.00 0.00 C ATOM 1508 O LEU B 22 -8.214 -15.660 -6.658 1.00 0.00 O ATOM 1509 CB LEU B 22 -7.009 -16.221 -4.039 1.00 0.00 C ATOM 1510 CG LEU B 22 -6.001 -15.068 -4.107 1.00 0.00 C ATOM 1511 CD1 LEU B 22 -6.501 -13.938 -4.990 1.00 0.00 C ATOM 1512 CD2 LEU B 22 -5.706 -14.552 -2.709 1.00 0.00 C ATOM 0 H LEU B 22 -5.549 -16.480 -6.471 1.00 0.00 H new ATOM 0 HA LEU B 22 -7.298 -18.170 -4.821 1.00 0.00 H new ATOM 0 HB2 LEU B 22 -8.005 -15.793 -3.922 1.00 0.00 H new ATOM 0 HB3 LEU B 22 -6.802 -16.798 -3.138 1.00 0.00 H new ATOM 0 HG LEU B 22 -5.083 -15.452 -4.551 1.00 0.00 H new ATOM 0 HD11 LEU B 22 -5.760 -13.139 -5.013 1.00 0.00 H new ATOM 0 HD12 LEU B 22 -6.664 -14.311 -6.001 1.00 0.00 H new ATOM 0 HD13 LEU B 22 -7.438 -13.551 -4.590 1.00 0.00 H new ATOM 0 HD21 LEU B 22 -4.989 -13.733 -2.767 1.00 0.00 H new ATOM 0 HD22 LEU B 22 -6.628 -14.195 -2.251 1.00 0.00 H new ATOM 0 HD23 LEU B 22 -5.289 -15.357 -2.104 1.00 0.00 H new ATOM 1524 N LYS B 23 -8.907 -17.814 -6.610 1.00 0.00 N ATOM 1525 CA LYS B 23 -9.932 -17.747 -7.649 1.00 0.00 C ATOM 1526 C LYS B 23 -9.585 -16.824 -8.822 1.00 0.00 C ATOM 1527 O LYS B 23 -8.424 -16.507 -9.094 1.00 0.00 O ATOM 1528 CB LYS B 23 -11.251 -17.304 -7.026 1.00 0.00 C ATOM 1529 CG LYS B 23 -11.769 -18.217 -5.928 1.00 0.00 C ATOM 1530 CD LYS B 23 -13.058 -17.673 -5.347 1.00 0.00 C ATOM 1531 CE LYS B 23 -13.612 -18.564 -4.248 1.00 0.00 C ATOM 1532 NZ LYS B 23 -14.882 -18.019 -3.699 1.00 0.00 N ATOM 0 H LYS B 23 -8.848 -18.736 -6.177 1.00 0.00 H new ATOM 0 HA LYS B 23 -10.006 -18.750 -8.069 1.00 0.00 H new ATOM 0 HB2 LYS B 23 -11.126 -16.301 -6.618 1.00 0.00 H new ATOM 0 HB3 LYS B 23 -12.004 -17.237 -7.811 1.00 0.00 H new ATOM 0 HG2 LYS B 23 -11.937 -19.217 -6.328 1.00 0.00 H new ATOM 0 HG3 LYS B 23 -11.020 -18.310 -5.142 1.00 0.00 H new ATOM 0 HD2 LYS B 23 -12.882 -16.674 -4.948 1.00 0.00 H new ATOM 0 HD3 LYS B 23 -13.799 -17.574 -6.140 1.00 0.00 H new ATOM 0 HE2 LYS B 23 -13.784 -19.566 -4.641 1.00 0.00 H new ATOM 0 HE3 LYS B 23 -12.878 -18.657 -3.448 1.00 0.00 H new ATOM 0 HZ1 LYS B 23 -15.235 -18.649 -2.951 1.00 0.00 H new ATOM 0 HZ2 LYS B 23 -14.711 -17.073 -3.303 1.00 0.00 H new ATOM 0 HZ3 LYS B 23 -15.589 -17.953 -4.459 1.00 0.00 H new ATOM 1546 N GLU B 24 -10.618 -16.485 -9.570 1.00 0.00 N ATOM 1547 CA GLU B 24 -10.588 -15.376 -10.479 1.00 0.00 C ATOM 1548 C GLU B 24 -11.581 -14.341 -10.012 1.00 0.00 C ATOM 1549 O GLU B 24 -12.757 -14.630 -9.789 1.00 0.00 O ATOM 1550 CB GLU B 24 -10.877 -15.814 -11.910 1.00 0.00 C ATOM 1551 CG GLU B 24 -11.343 -17.255 -12.065 1.00 0.00 C ATOM 1552 CD GLU B 24 -12.700 -17.531 -11.441 1.00 0.00 C ATOM 1553 OE1 GLU B 24 -13.730 -17.324 -12.118 1.00 0.00 O ATOM 1554 OE2 GLU B 24 -12.742 -17.975 -10.273 1.00 0.00 O ATOM 0 H GLU B 24 -11.508 -16.984 -9.557 1.00 0.00 H new ATOM 0 HA GLU B 24 -9.587 -14.945 -10.484 1.00 0.00 H new ATOM 0 HB2 GLU B 24 -11.639 -15.156 -12.328 1.00 0.00 H new ATOM 0 HB3 GLU B 24 -9.974 -15.675 -12.505 1.00 0.00 H new ATOM 0 HG2 GLU B 24 -11.385 -17.501 -13.126 1.00 0.00 H new ATOM 0 HG3 GLU B 24 -10.604 -17.917 -11.613 1.00 0.00 H new ATOM 1561 N GLY B 25 -11.083 -13.140 -9.877 1.00 0.00 N ATOM 1562 CA GLY B 25 -11.759 -12.118 -9.132 1.00 0.00 C ATOM 1563 C GLY B 25 -12.081 -12.603 -7.745 1.00 0.00 C ATOM 1564 O GLY B 25 -13.246 -12.751 -7.373 1.00 0.00 O ATOM 0 H GLY B 25 -10.195 -12.845 -10.283 1.00 0.00 H new ATOM 0 HA2 GLY B 25 -11.134 -11.227 -9.076 1.00 0.00 H new ATOM 0 HA3 GLY B 25 -12.677 -11.832 -9.646 1.00 0.00 H new ATOM 1568 N GLU B 26 -11.031 -12.850 -6.984 1.00 0.00 N ATOM 1569 CA GLU B 26 -11.152 -13.063 -5.557 1.00 0.00 C ATOM 1570 C GLU B 26 -10.800 -11.762 -4.842 1.00 0.00 C ATOM 1571 O GLU B 26 -9.938 -11.013 -5.309 1.00 0.00 O ATOM 1572 CB GLU B 26 -10.238 -14.206 -5.121 1.00 0.00 C ATOM 1573 CG GLU B 26 -10.867 -15.148 -4.121 1.00 0.00 C ATOM 1574 CD GLU B 26 -11.286 -14.479 -2.829 1.00 0.00 C ATOM 1575 OE1 GLU B 26 -12.413 -13.934 -2.772 1.00 0.00 O ATOM 1576 OE2 GLU B 26 -10.505 -14.507 -1.861 1.00 0.00 O ATOM 0 H GLU B 26 -10.076 -12.908 -7.337 1.00 0.00 H new ATOM 0 HA GLU B 26 -12.173 -13.344 -5.298 1.00 0.00 H new ATOM 0 HB2 GLU B 26 -9.939 -14.774 -6.002 1.00 0.00 H new ATOM 0 HB3 GLU B 26 -9.330 -13.787 -4.688 1.00 0.00 H new ATOM 0 HG2 GLU B 26 -11.740 -15.616 -4.576 1.00 0.00 H new ATOM 0 HG3 GLU B 26 -10.160 -15.946 -3.893 1.00 0.00 H new ATOM 1583 N ARG B 27 -11.463 -11.489 -3.727 1.00 0.00 N ATOM 1584 CA ARG B 27 -11.381 -10.175 -3.099 1.00 0.00 C ATOM 1585 C ARG B 27 -10.338 -10.126 -1.990 1.00 0.00 C ATOM 1586 O ARG B 27 -10.391 -10.860 -0.995 1.00 0.00 O ATOM 1587 CB ARG B 27 -12.749 -9.766 -2.572 1.00 0.00 C ATOM 1588 CG ARG B 27 -12.825 -8.355 -2.010 1.00 0.00 C ATOM 1589 CD ARG B 27 -14.274 -7.926 -1.829 1.00 0.00 C ATOM 1590 NE ARG B 27 -14.395 -6.657 -1.113 1.00 0.00 N ATOM 1591 CZ ARG B 27 -15.427 -5.820 -1.230 1.00 0.00 C ATOM 1592 NH1 ARG B 27 -16.408 -6.081 -2.082 1.00 0.00 N ATOM 1593 NH2 ARG B 27 -15.466 -4.711 -0.507 1.00 0.00 N ATOM 0 H ARG B 27 -12.062 -12.156 -3.239 1.00 0.00 H new ATOM 0 HA ARG B 27 -11.061 -9.465 -3.861 1.00 0.00 H new ATOM 0 HB2 ARG B 27 -13.475 -9.859 -3.379 1.00 0.00 H new ATOM 0 HB3 ARG B 27 -13.046 -10.468 -1.793 1.00 0.00 H new ATOM 0 HG2 ARG B 27 -12.305 -8.311 -1.053 1.00 0.00 H new ATOM 0 HG3 ARG B 27 -12.317 -7.663 -2.681 1.00 0.00 H new ATOM 0 HD2 ARG B 27 -14.748 -7.835 -2.806 1.00 0.00 H new ATOM 0 HD3 ARG B 27 -14.814 -8.700 -1.284 1.00 0.00 H new ATOM 0 HE ARG B 27 -13.639 -6.394 -0.481 1.00 0.00 H new ATOM 0 HH11 ARG B 27 -16.377 -6.926 -2.653 1.00 0.00 H new ATOM 0 HH12 ARG B 27 -17.195 -5.437 -2.167 1.00 0.00 H new ATOM 0 HH21 ARG B 27 -14.707 -4.497 0.140 1.00 0.00 H new ATOM 0 HH22 ARG B 27 -16.255 -4.071 -0.597 1.00 0.00 H new ATOM 1607 N VAL B 28 -9.424 -9.200 -2.161 1.00 0.00 N ATOM 1608 CA VAL B 28 -8.260 -9.070 -1.294 1.00 0.00 C ATOM 1609 C VAL B 28 -8.082 -7.628 -0.832 1.00 0.00 C ATOM 1610 O VAL B 28 -8.797 -6.728 -1.282 1.00 0.00 O ATOM 1611 CB VAL B 28 -6.974 -9.510 -2.026 1.00 0.00 C ATOM 1612 CG1 VAL B 28 -7.053 -10.971 -2.446 1.00 0.00 C ATOM 1613 CG2 VAL B 28 -6.723 -8.616 -3.233 1.00 0.00 C ATOM 0 H VAL B 28 -9.461 -8.507 -2.909 1.00 0.00 H new ATOM 0 HA VAL B 28 -8.430 -9.714 -0.431 1.00 0.00 H new ATOM 0 HB VAL B 28 -6.137 -9.408 -1.335 1.00 0.00 H new ATOM 0 HG11 VAL B 28 -6.133 -11.252 -2.959 1.00 0.00 H new ATOM 0 HG12 VAL B 28 -7.182 -11.597 -1.563 1.00 0.00 H new ATOM 0 HG13 VAL B 28 -7.900 -11.111 -3.117 1.00 0.00 H new ATOM 0 HG21 VAL B 28 -5.813 -8.937 -3.740 1.00 0.00 H new ATOM 0 HG22 VAL B 28 -7.566 -8.687 -3.920 1.00 0.00 H new ATOM 0 HG23 VAL B 28 -6.610 -7.583 -2.904 1.00 0.00 H new ATOM 1623 N LYS B 29 -7.122 -7.407 0.057 1.00 0.00 N ATOM 1624 CA LYS B 29 -6.811 -6.079 0.534 1.00 0.00 C ATOM 1625 C LYS B 29 -5.438 -5.678 0.052 1.00 0.00 C ATOM 1626 O LYS B 29 -4.517 -6.498 0.007 1.00 0.00 O ATOM 1627 CB LYS B 29 -6.830 -6.022 2.056 1.00 0.00 C ATOM 1628 CG LYS B 29 -8.207 -5.836 2.679 1.00 0.00 C ATOM 1629 CD LYS B 29 -9.205 -6.898 2.249 1.00 0.00 C ATOM 1630 CE LYS B 29 -10.515 -6.765 3.010 1.00 0.00 C ATOM 1631 NZ LYS B 29 -11.587 -7.610 2.427 1.00 0.00 N ATOM 0 H LYS B 29 -6.544 -8.143 0.462 1.00 0.00 H new ATOM 0 HA LYS B 29 -7.567 -5.396 0.146 1.00 0.00 H new ATOM 0 HB2 LYS B 29 -6.394 -6.943 2.444 1.00 0.00 H new ATOM 0 HB3 LYS B 29 -6.188 -5.204 2.381 1.00 0.00 H new ATOM 0 HG2 LYS B 29 -8.113 -5.853 3.765 1.00 0.00 H new ATOM 0 HG3 LYS B 29 -8.592 -4.853 2.408 1.00 0.00 H new ATOM 0 HD2 LYS B 29 -9.393 -6.811 1.179 1.00 0.00 H new ATOM 0 HD3 LYS B 29 -8.782 -7.888 2.419 1.00 0.00 H new ATOM 0 HE2 LYS B 29 -10.359 -7.046 4.052 1.00 0.00 H new ATOM 0 HE3 LYS B 29 -10.833 -5.722 3.005 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 -12.334 -7.761 3.135 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 -11.990 -7.134 1.595 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 -11.189 -8.528 2.142 1.00 0.00 H new ATOM 1645 N ILE B 30 -5.307 -4.422 -0.293 1.00 0.00 N ATOM 1646 CA ILE B 30 -4.036 -3.879 -0.729 1.00 0.00 C ATOM 1647 C ILE B 30 -3.616 -2.772 0.216 1.00 0.00 C ATOM 1648 O ILE B 30 -4.442 -1.973 0.667 1.00 0.00 O ATOM 1649 CB ILE B 30 -4.089 -3.282 -2.149 1.00 0.00 C ATOM 1650 CG1 ILE B 30 -5.039 -4.070 -3.064 1.00 0.00 C ATOM 1651 CG2 ILE B 30 -2.687 -3.237 -2.747 1.00 0.00 C ATOM 1652 CD1 ILE B 30 -4.582 -5.476 -3.365 1.00 0.00 C ATOM 0 H ILE B 30 -6.071 -3.746 -0.281 1.00 0.00 H new ATOM 0 HA ILE B 30 -3.329 -4.708 -0.733 1.00 0.00 H new ATOM 0 HB ILE B 30 -4.480 -2.267 -2.072 1.00 0.00 H new ATOM 0 HG12 ILE B 30 -6.023 -4.112 -2.598 1.00 0.00 H new ATOM 0 HG13 ILE B 30 -5.154 -3.528 -4.003 1.00 0.00 H new ATOM 0 HG21 ILE B 30 -2.733 -2.814 -3.750 1.00 0.00 H new ATOM 0 HG22 ILE B 30 -2.044 -2.618 -2.121 1.00 0.00 H new ATOM 0 HG23 ILE B 30 -2.280 -4.247 -2.797 1.00 0.00 H new ATOM 0 HD11 ILE B 30 -5.308 -5.963 -4.016 1.00 0.00 H new ATOM 0 HD12 ILE B 30 -3.612 -5.445 -3.862 1.00 0.00 H new ATOM 0 HD13 ILE B 30 -4.495 -6.037 -2.435 1.00 0.00 H new ATOM 1664 N LYS B 31 -2.337 -2.724 0.498 1.00 0.00 N ATOM 1665 CA LYS B 31 -1.784 -1.715 1.370 1.00 0.00 C ATOM 1666 C LYS B 31 -0.411 -1.307 0.866 1.00 0.00 C ATOM 1667 O LYS B 31 0.444 -2.160 0.634 1.00 0.00 O ATOM 1668 CB LYS B 31 -1.691 -2.255 2.797 1.00 0.00 C ATOM 1669 CG LYS B 31 -1.253 -1.225 3.824 1.00 0.00 C ATOM 1670 CD LYS B 31 -2.336 -0.190 4.090 1.00 0.00 C ATOM 1671 CE LYS B 31 -1.930 0.758 5.205 1.00 0.00 C ATOM 1672 NZ LYS B 31 -3.013 1.720 5.536 1.00 0.00 N ATOM 0 H LYS B 31 -1.650 -3.382 0.130 1.00 0.00 H new ATOM 0 HA LYS B 31 -2.434 -0.840 1.373 1.00 0.00 H new ATOM 0 HB2 LYS B 31 -2.664 -2.651 3.088 1.00 0.00 H new ATOM 0 HB3 LYS B 31 -0.989 -3.089 2.813 1.00 0.00 H new ATOM 0 HG2 LYS B 31 -0.996 -1.729 4.756 1.00 0.00 H new ATOM 0 HG3 LYS B 31 -0.351 -0.724 3.473 1.00 0.00 H new ATOM 0 HD2 LYS B 31 -2.531 0.377 3.180 1.00 0.00 H new ATOM 0 HD3 LYS B 31 -3.265 -0.693 4.358 1.00 0.00 H new ATOM 0 HE2 LYS B 31 -1.671 0.183 6.094 1.00 0.00 H new ATOM 0 HE3 LYS B 31 -1.036 1.306 4.908 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 -2.697 2.349 6.301 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 -3.243 2.287 4.695 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 -3.858 1.198 5.844 1.00 0.00 H new ATOM 1686 N LEU B 32 -0.223 -0.016 0.660 1.00 0.00 N ATOM 1687 CA LEU B 32 1.072 0.518 0.266 1.00 0.00 C ATOM 1688 C LEU B 32 2.096 0.179 1.338 1.00 0.00 C ATOM 1689 O LEU B 32 1.803 0.292 2.528 1.00 0.00 O ATOM 1690 CB LEU B 32 0.958 2.027 0.054 1.00 0.00 C ATOM 1691 CG LEU B 32 0.072 2.430 -1.127 1.00 0.00 C ATOM 1692 CD1 LEU B 32 -0.415 3.859 -0.983 1.00 0.00 C ATOM 1693 CD2 LEU B 32 0.830 2.265 -2.432 1.00 0.00 C ATOM 0 H LEU B 32 -0.955 0.688 0.759 1.00 0.00 H new ATOM 0 HA LEU B 32 1.399 0.072 -0.673 1.00 0.00 H new ATOM 0 HB2 LEU B 32 0.562 2.481 0.962 1.00 0.00 H new ATOM 0 HB3 LEU B 32 1.956 2.437 -0.099 1.00 0.00 H new ATOM 0 HG LEU B 32 -0.799 1.774 -1.135 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -1.042 4.117 -1.836 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -0.994 3.955 -0.065 1.00 0.00 H new ATOM 0 HD13 LEU B 32 0.441 4.533 -0.944 1.00 0.00 H new ATOM 0 HD21 LEU B 32 0.189 2.555 -3.264 1.00 0.00 H new ATOM 0 HD22 LEU B 32 1.717 2.898 -2.420 1.00 0.00 H new ATOM 0 HD23 LEU B 32 1.129 1.223 -2.550 1.00 0.00 H new ATOM 1761 N VAL B 36 8.565 -1.141 9.993 1.00 0.00 N ATOM 1762 CA VAL B 36 8.549 -0.984 11.438 1.00 0.00 C ATOM 1763 C VAL B 36 9.894 -0.428 11.864 1.00 0.00 C ATOM 1764 O VAL B 36 10.936 -0.976 11.502 1.00 0.00 O ATOM 1765 CB VAL B 36 8.300 -2.308 12.179 1.00 0.00 C ATOM 1766 CG1 VAL B 36 8.022 -2.061 13.655 1.00 0.00 C ATOM 1767 CG2 VAL B 36 7.171 -3.091 11.533 1.00 0.00 C ATOM 0 HA VAL B 36 7.729 -0.313 11.695 1.00 0.00 H new ATOM 0 HB VAL B 36 9.206 -2.910 12.105 1.00 0.00 H new ATOM 0 HG11 VAL B 36 7.849 -3.013 14.157 1.00 0.00 H new ATOM 0 HG12 VAL B 36 8.879 -1.562 14.108 1.00 0.00 H new ATOM 0 HG13 VAL B 36 7.139 -1.431 13.758 1.00 0.00 H new ATOM 0 HG21 VAL B 36 7.016 -4.023 12.077 1.00 0.00 H new ATOM 0 HG22 VAL B 36 6.256 -2.499 11.560 1.00 0.00 H new ATOM 0 HG23 VAL B 36 7.429 -3.314 10.498 1.00 0.00 H new ATOM 1777 N GLU B 37 9.871 0.651 12.614 1.00 0.00 N ATOM 1778 CA GLU B 37 11.094 1.366 12.927 1.00 0.00 C ATOM 1779 C GLU B 37 11.445 1.234 14.404 1.00 0.00 C ATOM 1780 O GLU B 37 10.664 1.619 15.278 1.00 0.00 O ATOM 1781 CB GLU B 37 10.947 2.837 12.548 1.00 0.00 C ATOM 1782 CG GLU B 37 12.271 3.568 12.475 1.00 0.00 C ATOM 1783 CD GLU B 37 12.116 5.031 12.129 1.00 0.00 C ATOM 1784 OE1 GLU B 37 11.742 5.340 10.979 1.00 0.00 O ATOM 1785 OE2 GLU B 37 12.372 5.877 13.006 1.00 0.00 O ATOM 0 H GLU B 37 9.025 1.053 13.018 1.00 0.00 H new ATOM 0 HA GLU B 37 11.906 0.926 12.348 1.00 0.00 H new ATOM 0 HB2 GLU B 37 10.446 2.909 11.583 1.00 0.00 H new ATOM 0 HB3 GLU B 37 10.306 3.331 13.278 1.00 0.00 H new ATOM 0 HG2 GLU B 37 12.783 3.479 13.433 1.00 0.00 H new ATOM 0 HG3 GLU B 37 12.905 3.088 11.729 1.00 0.00 H new ATOM 1792 N PRO B 38 12.619 0.659 14.699 1.00 0.00 N ATOM 1793 CA PRO B 38 13.133 0.559 16.058 1.00 0.00 C ATOM 1794 C PRO B 38 13.930 1.800 16.457 1.00 0.00 C ATOM 1795 O PRO B 38 14.029 2.761 15.690 1.00 0.00 O ATOM 1796 CB PRO B 38 14.044 -0.663 15.977 1.00 0.00 C ATOM 1797 CG PRO B 38 14.577 -0.643 14.582 1.00 0.00 C ATOM 1798 CD PRO B 38 13.533 0.036 13.726 1.00 0.00 C ATOM 0 HA PRO B 38 12.344 0.476 16.805 1.00 0.00 H new ATOM 0 HB2 PRO B 38 14.849 -0.607 16.710 1.00 0.00 H new ATOM 0 HB3 PRO B 38 13.493 -1.582 16.178 1.00 0.00 H new ATOM 0 HG2 PRO B 38 15.524 -0.104 14.537 1.00 0.00 H new ATOM 0 HG3 PRO B 38 14.769 -1.655 14.227 1.00 0.00 H new ATOM 0 HD2 PRO B 38 13.981 0.780 13.067 1.00 0.00 H new ATOM 0 HD3 PRO B 38 13.011 -0.680 13.091 1.00 0.00 H new ATOM 1806 N ILE B 39 14.500 1.777 17.650 1.00 0.00 N ATOM 1807 CA ILE B 39 15.292 2.890 18.133 1.00 0.00 C ATOM 1808 C ILE B 39 16.785 2.586 18.062 1.00 0.00 C ATOM 1809 O ILE B 39 17.195 1.425 18.116 1.00 0.00 O ATOM 1810 CB ILE B 39 14.891 3.283 19.574 1.00 0.00 C ATOM 1811 CG1 ILE B 39 14.533 2.055 20.425 1.00 0.00 C ATOM 1812 CG2 ILE B 39 13.728 4.259 19.551 1.00 0.00 C ATOM 1813 CD1 ILE B 39 15.723 1.222 20.858 1.00 0.00 C ATOM 0 H ILE B 39 14.427 0.996 18.302 1.00 0.00 H new ATOM 0 HA ILE B 39 15.087 3.737 17.478 1.00 0.00 H new ATOM 0 HB ILE B 39 15.755 3.763 20.033 1.00 0.00 H new ATOM 0 HG12 ILE B 39 13.996 2.388 21.313 1.00 0.00 H new ATOM 0 HG13 ILE B 39 13.850 1.423 19.858 1.00 0.00 H new ATOM 0 HG21 ILE B 39 13.457 4.526 20.572 1.00 0.00 H new ATOM 0 HG22 ILE B 39 14.017 5.157 19.005 1.00 0.00 H new ATOM 0 HG23 ILE B 39 12.873 3.795 19.059 1.00 0.00 H new ATOM 0 HD11 ILE B 39 15.378 0.377 21.454 1.00 0.00 H new ATOM 0 HD12 ILE B 39 16.250 0.854 19.977 1.00 0.00 H new ATOM 0 HD13 ILE B 39 16.398 1.835 21.455 1.00 0.00 H new ATOM 1825 N ASP B 40 17.586 3.632 17.926 1.00 0.00 N ATOM 1826 CA ASP B 40 19.036 3.492 17.867 1.00 0.00 C ATOM 1827 C ASP B 40 19.693 4.523 18.773 1.00 0.00 C ATOM 1828 O ASP B 40 19.748 5.709 18.446 1.00 0.00 O ATOM 1829 CB ASP B 40 19.528 3.662 16.427 1.00 0.00 C ATOM 1830 CG ASP B 40 21.039 3.555 16.303 1.00 0.00 C ATOM 1831 OD1 ASP B 40 21.551 2.423 16.176 1.00 0.00 O ATOM 1832 OD2 ASP B 40 21.720 4.605 16.311 1.00 0.00 O ATOM 0 H ASP B 40 17.255 4.594 17.854 1.00 0.00 H new ATOM 0 HA ASP B 40 19.308 2.494 18.211 1.00 0.00 H new ATOM 0 HB2 ASP B 40 19.062 2.904 15.797 1.00 0.00 H new ATOM 0 HB3 ASP B 40 19.205 4.632 16.050 1.00 0.00 H new ATOM 1837 N LEU B 41 20.167 4.075 19.921 1.00 0.00 N ATOM 1838 CA LEU B 41 20.749 4.971 20.908 1.00 0.00 C ATOM 1839 C LEU B 41 22.046 4.392 21.457 1.00 0.00 C ATOM 1840 O LEU B 41 22.140 3.190 21.715 1.00 0.00 O ATOM 1841 CB LEU B 41 19.755 5.210 22.051 1.00 0.00 C ATOM 1842 CG LEU B 41 20.224 6.173 23.143 1.00 0.00 C ATOM 1843 CD1 LEU B 41 20.353 7.586 22.597 1.00 0.00 C ATOM 1844 CD2 LEU B 41 19.266 6.145 24.321 1.00 0.00 C ATOM 0 H LEU B 41 20.161 3.093 20.195 1.00 0.00 H new ATOM 0 HA LEU B 41 20.971 5.922 20.424 1.00 0.00 H new ATOM 0 HB2 LEU B 41 18.827 5.593 21.627 1.00 0.00 H new ATOM 0 HB3 LEU B 41 19.522 4.251 22.513 1.00 0.00 H new ATOM 0 HG LEU B 41 21.207 5.849 23.486 1.00 0.00 H new ATOM 0 HD11 LEU B 41 20.688 8.254 23.391 1.00 0.00 H new ATOM 0 HD12 LEU B 41 21.079 7.597 21.784 1.00 0.00 H new ATOM 0 HD13 LEU B 41 19.385 7.922 22.224 1.00 0.00 H new ATOM 0 HD21 LEU B 41 19.614 6.836 25.089 1.00 0.00 H new ATOM 0 HD22 LEU B 41 18.272 6.443 23.988 1.00 0.00 H new ATOM 0 HD23 LEU B 41 19.224 5.136 24.732 1.00 0.00 H new ATOM 1856 N GLY B 42 23.038 5.249 21.634 1.00 0.00 N ATOM 1857 CA GLY B 42 24.298 4.827 22.191 1.00 0.00 C ATOM 1858 C GLY B 42 24.609 5.589 23.453 1.00 0.00 C ATOM 1859 O GLY B 42 24.798 6.807 23.432 1.00 0.00 O ATOM 0 H GLY B 42 22.988 6.240 21.398 1.00 0.00 H new ATOM 0 HA2 GLY B 42 24.266 3.759 22.405 1.00 0.00 H new ATOM 0 HA3 GLY B 42 25.093 4.983 21.462 1.00 0.00 H new ATOM 1863 N GLU B 43 24.633 4.875 24.551 1.00 0.00 N ATOM 1864 CA GLU B 43 24.888 5.462 25.851 1.00 0.00 C ATOM 1865 C GLU B 43 26.379 5.409 26.186 1.00 0.00 C ATOM 1866 O GLU B 43 27.128 4.656 25.563 1.00 0.00 O ATOM 1867 CB GLU B 43 24.067 4.729 26.904 1.00 0.00 C ATOM 1868 CG GLU B 43 22.567 4.850 26.684 1.00 0.00 C ATOM 1869 CD GLU B 43 21.763 4.280 27.828 1.00 0.00 C ATOM 1870 OE1 GLU B 43 21.598 3.046 27.888 1.00 0.00 O ATOM 1871 OE2 GLU B 43 21.290 5.066 28.678 1.00 0.00 O ATOM 0 H GLU B 43 24.476 3.867 24.573 1.00 0.00 H new ATOM 0 HA GLU B 43 24.592 6.511 25.836 1.00 0.00 H new ATOM 0 HB2 GLU B 43 24.344 3.675 26.903 1.00 0.00 H new ATOM 0 HB3 GLU B 43 24.316 5.123 27.889 1.00 0.00 H new ATOM 0 HG2 GLU B 43 22.307 5.900 26.550 1.00 0.00 H new ATOM 0 HG3 GLU B 43 22.296 4.335 25.763 1.00 0.00 H new ATOM 1878 N PRO B 44 26.823 6.223 27.165 1.00 0.00 N ATOM 1879 CA PRO B 44 28.237 6.320 27.559 1.00 0.00 C ATOM 1880 C PRO B 44 28.904 4.970 27.814 1.00 0.00 C ATOM 1881 O PRO B 44 28.293 4.047 28.363 1.00 0.00 O ATOM 1882 CB PRO B 44 28.187 7.134 28.851 1.00 0.00 C ATOM 1883 CG PRO B 44 26.968 7.973 28.715 1.00 0.00 C ATOM 1884 CD PRO B 44 25.975 7.138 27.957 1.00 0.00 C ATOM 0 HA PRO B 44 28.833 6.766 26.763 1.00 0.00 H new ATOM 0 HB2 PRO B 44 28.128 6.487 29.726 1.00 0.00 H new ATOM 0 HB3 PRO B 44 29.080 7.748 28.968 1.00 0.00 H new ATOM 0 HG2 PRO B 44 26.576 8.254 29.693 1.00 0.00 H new ATOM 0 HG3 PRO B 44 27.188 8.898 28.182 1.00 0.00 H new ATOM 0 HD2 PRO B 44 25.315 6.591 28.630 1.00 0.00 H new ATOM 0 HD3 PRO B 44 25.341 7.752 27.317 1.00 0.00 H new ATOM 1892 N VAL B 45 30.163 4.875 27.409 1.00 0.00 N ATOM 1893 CA VAL B 45 30.967 3.680 27.627 1.00 0.00 C ATOM 1894 C VAL B 45 31.431 3.632 29.086 1.00 0.00 C ATOM 1895 O VAL B 45 31.353 4.638 29.796 1.00 0.00 O ATOM 1896 CB VAL B 45 32.194 3.673 26.680 1.00 0.00 C ATOM 1897 CG1 VAL B 45 32.863 2.305 26.640 1.00 0.00 C ATOM 1898 CG2 VAL B 45 31.789 4.104 25.278 1.00 0.00 C ATOM 0 H VAL B 45 30.655 5.623 26.921 1.00 0.00 H new ATOM 0 HA VAL B 45 30.359 2.801 27.412 1.00 0.00 H new ATOM 0 HB VAL B 45 32.918 4.387 27.074 1.00 0.00 H new ATOM 0 HG11 VAL B 45 33.719 2.338 25.966 1.00 0.00 H new ATOM 0 HG12 VAL B 45 33.200 2.035 27.641 1.00 0.00 H new ATOM 0 HG13 VAL B 45 32.150 1.561 26.284 1.00 0.00 H new ATOM 0 HG21 VAL B 45 32.663 4.093 24.627 1.00 0.00 H new ATOM 0 HG22 VAL B 45 31.038 3.416 24.889 1.00 0.00 H new ATOM 0 HG23 VAL B 45 31.375 5.112 25.312 1.00 0.00 H new ATOM 1908 N SER B 46 31.903 2.476 29.535 1.00 0.00 N ATOM 1909 CA SER B 46 32.335 2.311 30.914 1.00 0.00 C ATOM 1910 C SER B 46 33.726 2.901 31.132 1.00 0.00 C ATOM 1911 O SER B 46 34.462 3.167 30.176 1.00 0.00 O ATOM 1912 CB SER B 46 32.336 0.829 31.282 1.00 0.00 C ATOM 1913 OG SER B 46 31.178 0.180 30.781 1.00 0.00 O ATOM 0 H SER B 46 31.996 1.638 28.961 1.00 0.00 H new ATOM 0 HA SER B 46 31.636 2.846 31.556 1.00 0.00 H new ATOM 0 HB2 SER B 46 33.229 0.351 30.878 1.00 0.00 H new ATOM 0 HB3 SER B 46 32.378 0.720 32.366 1.00 0.00 H new ATOM 0 HG SER B 46 31.202 -0.768 31.028 1.00 0.00 H new ATOM 1919 N VAL B 47 34.071 3.098 32.393 1.00 0.00 N ATOM 1920 CA VAL B 47 35.367 3.635 32.771 1.00 0.00 C ATOM 1921 C VAL B 47 36.118 2.607 33.626 1.00 0.00 C ATOM 1922 O VAL B 47 35.517 1.646 34.107 1.00 0.00 O ATOM 1923 CB VAL B 47 35.205 4.972 33.545 1.00 0.00 C ATOM 1924 CG1 VAL B 47 34.599 4.746 34.926 1.00 0.00 C ATOM 1925 CG2 VAL B 47 36.529 5.717 33.649 1.00 0.00 C ATOM 0 H VAL B 47 33.461 2.890 33.183 1.00 0.00 H new ATOM 0 HA VAL B 47 35.942 3.838 31.868 1.00 0.00 H new ATOM 0 HB VAL B 47 34.515 5.594 32.975 1.00 0.00 H new ATOM 0 HG11 VAL B 47 34.499 5.702 35.441 1.00 0.00 H new ATOM 0 HG12 VAL B 47 33.616 4.286 34.821 1.00 0.00 H new ATOM 0 HG13 VAL B 47 35.248 4.088 35.505 1.00 0.00 H new ATOM 0 HG21 VAL B 47 36.381 6.648 34.196 1.00 0.00 H new ATOM 0 HG22 VAL B 47 37.254 5.098 34.177 1.00 0.00 H new ATOM 0 HG23 VAL B 47 36.901 5.939 32.649 1.00 0.00 H new ATOM 1935 N GLU B 48 37.421 2.802 33.793 1.00 0.00 N ATOM 1936 CA GLU B 48 38.246 1.895 34.585 1.00 0.00 C ATOM 1937 C GLU B 48 37.780 1.882 36.036 1.00 0.00 C ATOM 1938 O GLU B 48 37.942 2.865 36.762 1.00 0.00 O ATOM 1939 CB GLU B 48 39.704 2.335 34.553 1.00 0.00 C ATOM 1940 CG GLU B 48 40.206 2.736 33.176 1.00 0.00 C ATOM 1941 CD GLU B 48 41.525 3.475 33.242 1.00 0.00 C ATOM 1942 OE1 GLU B 48 41.512 4.706 33.435 1.00 0.00 O ATOM 1943 OE2 GLU B 48 42.584 2.834 33.102 1.00 0.00 O ATOM 0 H GLU B 48 37.933 3.586 33.388 1.00 0.00 H new ATOM 0 HA GLU B 48 38.151 0.898 34.155 1.00 0.00 H new ATOM 0 HB2 GLU B 48 39.832 3.177 35.233 1.00 0.00 H new ATOM 0 HB3 GLU B 48 40.325 1.523 34.931 1.00 0.00 H new ATOM 0 HG2 GLU B 48 40.321 1.845 32.559 1.00 0.00 H new ATOM 0 HG3 GLU B 48 39.462 3.367 32.689 1.00 0.00 H new ATOM 1950 N GLU B 49 37.207 0.771 36.451 1.00 0.00 N ATOM 1951 CA GLU B 49 36.694 0.638 37.807 1.00 0.00 C ATOM 1952 C GLU B 49 37.797 0.182 38.748 1.00 0.00 C ATOM 1953 O GLU B 49 37.802 0.508 39.936 1.00 0.00 O ATOM 1954 CB GLU B 49 35.522 -0.345 37.833 1.00 0.00 C ATOM 1955 CG GLU B 49 34.854 -0.458 39.191 1.00 0.00 C ATOM 1956 CD GLU B 49 33.626 -1.339 39.164 1.00 0.00 C ATOM 1957 OE1 GLU B 49 32.575 -0.882 38.664 1.00 0.00 O ATOM 1958 OE2 GLU B 49 33.701 -2.492 39.636 1.00 0.00 O ATOM 0 H GLU B 49 37.083 -0.058 35.870 1.00 0.00 H new ATOM 0 HA GLU B 49 36.337 1.611 38.145 1.00 0.00 H new ATOM 0 HB2 GLU B 49 34.781 -0.033 37.097 1.00 0.00 H new ATOM 0 HB3 GLU B 49 35.878 -1.330 37.529 1.00 0.00 H new ATOM 0 HG2 GLU B 49 35.568 -0.858 39.911 1.00 0.00 H new ATOM 0 HG3 GLU B 49 34.575 0.537 39.538 1.00 0.00 H new ATOM 1965 N ILE B 50 38.738 -0.565 38.199 1.00 0.00 N ATOM 1966 CA ILE B 50 39.841 -1.113 38.979 1.00 0.00 C ATOM 1967 C ILE B 50 41.038 -0.154 38.959 1.00 0.00 C ATOM 1968 O ILE B 50 42.152 -0.503 39.348 1.00 0.00 O ATOM 1969 CB ILE B 50 40.263 -2.502 38.437 1.00 0.00 C ATOM 1970 CG1 ILE B 50 39.024 -3.336 38.095 1.00 0.00 C ATOM 1971 CG2 ILE B 50 41.113 -3.246 39.462 1.00 0.00 C ATOM 1972 CD1 ILE B 50 39.345 -4.695 37.505 1.00 0.00 C ATOM 0 H ILE B 50 38.763 -0.809 37.209 1.00 0.00 H new ATOM 0 HA ILE B 50 39.502 -1.233 40.008 1.00 0.00 H new ATOM 0 HB ILE B 50 40.855 -2.349 37.535 1.00 0.00 H new ATOM 0 HG12 ILE B 50 38.430 -3.474 38.998 1.00 0.00 H new ATOM 0 HG13 ILE B 50 38.407 -2.780 37.389 1.00 0.00 H new ATOM 0 HG21 ILE B 50 41.398 -4.219 39.061 1.00 0.00 H new ATOM 0 HG22 ILE B 50 42.010 -2.666 39.680 1.00 0.00 H new ATOM 0 HG23 ILE B 50 40.539 -3.385 40.378 1.00 0.00 H new ATOM 0 HD11 ILE B 50 38.418 -5.226 37.289 1.00 0.00 H new ATOM 0 HD12 ILE B 50 39.913 -4.567 36.583 1.00 0.00 H new ATOM 0 HD13 ILE B 50 39.936 -5.271 38.218 1.00 0.00 H new ATOM 2090 N THR B 57 56.221 4.381 49.490 1.00 0.00 N ATOM 2091 CA THR B 57 57.127 3.310 49.859 1.00 0.00 C ATOM 2092 C THR B 57 57.841 3.693 51.150 1.00 0.00 C ATOM 2093 O THR B 57 57.904 4.874 51.500 1.00 0.00 O ATOM 2094 CB THR B 57 58.154 3.011 48.742 1.00 0.00 C ATOM 2095 OG1 THR B 57 58.881 1.809 49.038 1.00 0.00 O ATOM 2096 CG2 THR B 57 59.131 4.166 48.556 1.00 0.00 C ATOM 0 HA THR B 57 56.546 2.400 50.007 1.00 0.00 H new ATOM 0 HB THR B 57 57.598 2.880 47.814 1.00 0.00 H new ATOM 0 HG1 THR B 57 59.526 1.632 48.322 1.00 0.00 H new ATOM 0 HG21 THR B 57 59.838 3.921 47.763 1.00 0.00 H new ATOM 0 HG22 THR B 57 58.581 5.068 48.286 1.00 0.00 H new ATOM 0 HG23 THR B 57 59.674 4.337 49.486 1.00 0.00 H new ATOM 2104 N TRP B 58 58.356 2.708 51.863 1.00 0.00 N ATOM 2105 CA TRP B 58 58.982 2.961 53.148 1.00 0.00 C ATOM 2106 C TRP B 58 60.352 2.301 53.208 1.00 0.00 C ATOM 2107 O TRP B 58 60.569 1.242 52.617 1.00 0.00 O ATOM 2108 CB TRP B 58 58.093 2.438 54.282 1.00 0.00 C ATOM 2109 CG TRP B 58 58.207 3.234 55.554 1.00 0.00 C ATOM 2110 CD1 TRP B 58 59.326 3.428 56.317 1.00 0.00 C ATOM 2111 CD2 TRP B 58 57.150 3.942 56.217 1.00 0.00 C ATOM 2112 NE1 TRP B 58 59.030 4.212 57.405 1.00 0.00 N ATOM 2113 CE2 TRP B 58 57.703 4.543 57.365 1.00 0.00 C ATOM 2114 CE3 TRP B 58 55.792 4.130 55.950 1.00 0.00 C ATOM 2115 CZ2 TRP B 58 56.948 5.316 58.242 1.00 0.00 C ATOM 2116 CZ3 TRP B 58 55.044 4.900 56.820 1.00 0.00 C ATOM 2117 CH2 TRP B 58 55.623 5.485 57.952 1.00 0.00 C ATOM 0 H TRP B 58 58.353 1.729 51.576 1.00 0.00 H new ATOM 0 HA TRP B 58 59.108 4.037 53.268 1.00 0.00 H new ATOM 0 HB2 TRP B 58 57.055 2.445 53.951 1.00 0.00 H new ATOM 0 HB3 TRP B 58 58.355 1.400 54.488 1.00 0.00 H new ATOM 0 HD1 TRP B 58 60.302 3.023 56.095 1.00 0.00 H new ATOM 0 HE1 TRP B 58 59.692 4.501 58.126 1.00 0.00 H new ATOM 0 HE3 TRP B 58 55.335 3.682 55.080 1.00 0.00 H new ATOM 0 HZ2 TRP B 58 57.392 5.765 59.118 1.00 0.00 H new ATOM 0 HZ3 TRP B 58 53.993 5.053 56.623 1.00 0.00 H new ATOM 0 HH2 TRP B 58 55.010 6.083 58.610 1.00 0.00 H new ATOM 2128 N MET B 59 61.272 2.938 53.908 1.00 0.00 N ATOM 2129 CA MET B 59 62.616 2.408 54.064 1.00 0.00 C ATOM 2130 C MET B 59 62.718 1.616 55.363 1.00 0.00 C ATOM 2131 O MET B 59 61.751 1.528 56.119 1.00 0.00 O ATOM 2132 CB MET B 59 63.643 3.542 54.064 1.00 0.00 C ATOM 2133 CG MET B 59 63.677 4.341 52.771 1.00 0.00 C ATOM 2134 SD MET B 59 64.913 5.654 52.794 1.00 0.00 S ATOM 2135 CE MET B 59 64.620 6.400 51.191 1.00 0.00 C ATOM 0 H MET B 59 61.113 3.828 54.380 1.00 0.00 H new ATOM 0 HA MET B 59 62.827 1.746 53.224 1.00 0.00 H new ATOM 0 HB2 MET B 59 63.424 4.217 54.891 1.00 0.00 H new ATOM 0 HB3 MET B 59 64.633 3.123 54.247 1.00 0.00 H new ATOM 0 HG2 MET B 59 63.884 3.668 51.939 1.00 0.00 H new ATOM 0 HG3 MET B 59 62.694 4.777 52.592 1.00 0.00 H new ATOM 0 HE1 MET B 59 65.307 7.234 51.047 1.00 0.00 H new ATOM 0 HE2 MET B 59 64.781 5.658 50.409 1.00 0.00 H new ATOM 0 HE3 MET B 59 63.593 6.763 51.141 1.00 0.00 H new ATOM 2145 N SER B 60 63.879 1.045 55.622 1.00 0.00 N ATOM 2146 CA SER B 60 64.106 0.331 56.865 1.00 0.00 C ATOM 2147 C SER B 60 65.456 0.727 57.437 1.00 0.00 C ATOM 2148 O SER B 60 66.488 0.603 56.774 1.00 0.00 O ATOM 2149 CB SER B 60 64.035 -1.182 56.638 1.00 0.00 C ATOM 2150 OG SER B 60 64.061 -1.893 57.863 1.00 0.00 O ATOM 0 H SER B 60 64.679 1.061 54.989 1.00 0.00 H new ATOM 0 HA SER B 60 63.326 0.598 57.578 1.00 0.00 H new ATOM 0 HB2 SER B 60 63.123 -1.427 56.093 1.00 0.00 H new ATOM 0 HB3 SER B 60 64.872 -1.497 56.015 1.00 0.00 H new ATOM 0 HG SER B 60 64.013 -2.855 57.684 1.00 0.00 H new ATOM 2156 N SER B 61 65.443 1.223 58.658 1.00 0.00 N ATOM 2157 CA SER B 61 66.664 1.675 59.300 1.00 0.00 C ATOM 2158 C SER B 61 67.262 0.564 60.154 1.00 0.00 C ATOM 2159 O SER B 61 68.377 0.694 60.658 1.00 0.00 O ATOM 2160 CB SER B 61 66.380 2.924 60.136 1.00 0.00 C ATOM 2161 OG SER B 61 65.802 3.946 59.334 1.00 0.00 O ATOM 0 H SER B 61 64.602 1.324 59.226 1.00 0.00 H new ATOM 0 HA SER B 61 67.395 1.933 58.534 1.00 0.00 H new ATOM 0 HB2 SER B 61 65.706 2.673 60.955 1.00 0.00 H new ATOM 0 HB3 SER B 61 67.306 3.286 60.584 1.00 0.00 H new ATOM 0 HG SER B 61 65.626 4.736 59.887 1.00 0.00 H new ATOM 2167 N LEU B 62 66.511 -0.533 60.263 1.00 0.00 N ATOM 2168 CA LEU B 62 66.940 -1.747 60.964 1.00 0.00 C ATOM 2169 C LEU B 62 67.367 -1.460 62.406 1.00 0.00 C ATOM 2170 O LEU B 62 68.456 -0.945 62.662 1.00 0.00 O ATOM 2171 CB LEU B 62 68.071 -2.419 60.181 1.00 0.00 C ATOM 2172 CG LEU B 62 68.259 -3.917 60.425 1.00 0.00 C ATOM 2173 CD1 LEU B 62 69.092 -4.524 59.308 1.00 0.00 C ATOM 2174 CD2 LEU B 62 68.922 -4.181 61.770 1.00 0.00 C ATOM 0 H LEU B 62 65.576 -0.606 59.862 1.00 0.00 H new ATOM 0 HA LEU B 62 66.088 -2.425 61.020 1.00 0.00 H new ATOM 0 HB2 LEU B 62 67.891 -2.264 59.117 1.00 0.00 H new ATOM 0 HB3 LEU B 62 69.005 -1.912 60.423 1.00 0.00 H new ATOM 0 HG LEU B 62 67.274 -4.383 60.438 1.00 0.00 H new ATOM 0 HD11 LEU B 62 69.221 -5.591 59.489 1.00 0.00 H new ATOM 0 HD12 LEU B 62 68.585 -4.377 58.355 1.00 0.00 H new ATOM 0 HD13 LEU B 62 70.068 -4.040 59.278 1.00 0.00 H new ATOM 0 HD21 LEU B 62 69.041 -5.255 61.912 1.00 0.00 H new ATOM 0 HD22 LEU B 62 69.900 -3.701 61.794 1.00 0.00 H new ATOM 0 HD23 LEU B 62 68.300 -3.776 62.568 1.00 0.00 H new ATOM 2186 N GLU B 63 66.506 -1.798 63.352 1.00 0.00 N ATOM 2187 CA GLU B 63 66.821 -1.605 64.759 1.00 0.00 C ATOM 2188 C GLU B 63 67.788 -2.671 65.255 1.00 0.00 C ATOM 2189 O GLU B 63 67.468 -3.857 65.279 1.00 0.00 O ATOM 2190 CB GLU B 63 65.558 -1.624 65.614 1.00 0.00 C ATOM 2191 CG GLU B 63 64.693 -0.387 65.458 1.00 0.00 C ATOM 2192 CD GLU B 63 63.612 -0.314 66.514 1.00 0.00 C ATOM 2193 OE1 GLU B 63 63.942 -0.012 67.682 1.00 0.00 O ATOM 2194 OE2 GLU B 63 62.433 -0.575 66.193 1.00 0.00 O ATOM 0 H GLU B 63 65.588 -2.205 63.173 1.00 0.00 H new ATOM 0 HA GLU B 63 67.294 -0.628 64.852 1.00 0.00 H new ATOM 0 HB2 GLU B 63 64.968 -2.503 65.355 1.00 0.00 H new ATOM 0 HB3 GLU B 63 65.841 -1.728 66.661 1.00 0.00 H new ATOM 0 HG2 GLU B 63 65.319 0.503 65.518 1.00 0.00 H new ATOM 0 HG3 GLU B 63 64.234 -0.388 64.469 1.00 0.00 H new ATOM 2201 N HIS B 64 68.975 -2.236 65.642 1.00 0.00 N ATOM 2202 CA HIS B 64 69.972 -3.126 66.211 1.00 0.00 C ATOM 2203 C HIS B 64 69.949 -3.006 67.728 1.00 0.00 C ATOM 2204 O HIS B 64 70.330 -1.975 68.280 1.00 0.00 O ATOM 2205 CB HIS B 64 71.363 -2.782 65.661 1.00 0.00 C ATOM 2206 CG HIS B 64 72.480 -3.603 66.237 1.00 0.00 C ATOM 2207 ND1 HIS B 64 72.673 -4.930 65.931 1.00 0.00 N ATOM 2208 CD2 HIS B 64 73.472 -3.271 67.097 1.00 0.00 C ATOM 2209 CE1 HIS B 64 73.732 -5.380 66.577 1.00 0.00 C ATOM 2210 NE2 HIS B 64 74.238 -4.394 67.294 1.00 0.00 N ATOM 0 H HIS B 64 69.273 -1.263 65.571 1.00 0.00 H new ATOM 0 HA HIS B 64 69.742 -4.155 65.934 1.00 0.00 H new ATOM 0 HB2 HIS B 64 71.354 -2.912 64.579 1.00 0.00 H new ATOM 0 HB3 HIS B 64 71.566 -1.729 65.854 1.00 0.00 H new ATOM 0 HD2 HIS B 64 73.632 -2.302 67.545 1.00 0.00 H new ATOM 0 HE1 HIS B 64 74.120 -6.387 66.527 1.00 0.00 H new ATOM 0 HE2 HIS B 64 75.060 -4.456 67.894 1.00 0.00 H new ATOM 2219 N HIS B 65 69.490 -4.054 68.393 1.00 0.00 N ATOM 2220 CA HIS B 65 69.378 -4.044 69.845 1.00 0.00 C ATOM 2221 C HIS B 65 70.067 -5.258 70.449 1.00 0.00 C ATOM 2222 O HIS B 65 69.674 -6.397 70.196 1.00 0.00 O ATOM 2223 CB HIS B 65 67.911 -4.013 70.280 1.00 0.00 C ATOM 2224 CG HIS B 65 67.528 -2.745 70.981 1.00 0.00 C ATOM 2225 ND1 HIS B 65 66.445 -1.978 70.614 1.00 0.00 N ATOM 2226 CD2 HIS B 65 68.088 -2.117 72.042 1.00 0.00 C ATOM 2227 CE1 HIS B 65 66.358 -0.932 71.414 1.00 0.00 C ATOM 2228 NE2 HIS B 65 67.342 -0.992 72.294 1.00 0.00 N ATOM 0 H HIS B 65 69.189 -4.923 67.952 1.00 0.00 H new ATOM 0 HA HIS B 65 69.871 -3.142 70.208 1.00 0.00 H new ATOM 0 HB2 HIS B 65 67.276 -4.141 69.403 1.00 0.00 H new ATOM 0 HB3 HIS B 65 67.717 -4.858 70.940 1.00 0.00 H new ATOM 0 HD2 HIS B 65 68.961 -2.441 72.589 1.00 0.00 H new ATOM 0 HE1 HIS B 65 65.608 -0.157 71.359 1.00 0.00 H new ATOM 0 HE2 HIS B 65 67.518 -0.315 73.037 1.00 0.00 H new ATOM 2237 N HIS B 66 71.099 -5.005 71.239 1.00 0.00 N ATOM 2238 CA HIS B 66 71.840 -6.071 71.899 1.00 0.00 C ATOM 2239 C HIS B 66 72.623 -5.514 73.087 1.00 0.00 C ATOM 2240 O HIS B 66 73.832 -5.296 73.003 1.00 0.00 O ATOM 2241 CB HIS B 66 72.793 -6.746 70.907 1.00 0.00 C ATOM 2242 CG HIS B 66 72.711 -8.243 70.893 1.00 0.00 C ATOM 2243 ND1 HIS B 66 72.002 -8.972 71.823 1.00 0.00 N ATOM 2244 CD2 HIS B 66 73.245 -9.150 70.041 1.00 0.00 C ATOM 2245 CE1 HIS B 66 72.105 -10.256 71.543 1.00 0.00 C ATOM 2246 NE2 HIS B 66 72.853 -10.394 70.466 1.00 0.00 N ATOM 0 H HIS B 66 71.444 -4.066 71.440 1.00 0.00 H new ATOM 0 HA HIS B 66 71.131 -6.814 72.265 1.00 0.00 H new ATOM 0 HB2 HIS B 66 72.580 -6.373 69.905 1.00 0.00 H new ATOM 0 HB3 HIS B 66 73.815 -6.452 71.146 1.00 0.00 H new ATOM 0 HD2 HIS B 66 73.866 -8.934 69.184 1.00 0.00 H new ATOM 0 HE1 HIS B 66 71.652 -11.061 72.103 1.00 0.00 H new ATOM 0 HE2 HIS B 66 73.099 -11.279 70.022 1.00 0.00 H new ATOM 2255 N HIS B 67 71.928 -5.260 74.184 1.00 0.00 N ATOM 2256 CA HIS B 67 72.561 -4.697 75.367 1.00 0.00 C ATOM 2257 C HIS B 67 72.924 -5.814 76.340 1.00 0.00 C ATOM 2258 O HIS B 67 72.096 -6.247 77.139 1.00 0.00 O ATOM 2259 CB HIS B 67 71.625 -3.686 76.033 1.00 0.00 C ATOM 2260 CG HIS B 67 72.293 -2.795 77.034 1.00 0.00 C ATOM 2261 ND1 HIS B 67 72.245 -3.014 78.393 1.00 0.00 N ATOM 2262 CD2 HIS B 67 73.001 -1.656 76.866 1.00 0.00 C ATOM 2263 CE1 HIS B 67 72.894 -2.048 79.014 1.00 0.00 C ATOM 2264 NE2 HIS B 67 73.362 -1.207 78.112 1.00 0.00 N ATOM 0 H HIS B 67 70.928 -5.434 74.281 1.00 0.00 H new ATOM 0 HA HIS B 67 73.474 -4.179 75.073 1.00 0.00 H new ATOM 0 HB2 HIS B 67 71.169 -3.067 75.260 1.00 0.00 H new ATOM 0 HB3 HIS B 67 70.817 -4.226 76.527 1.00 0.00 H new ATOM 0 HD2 HIS B 67 73.239 -1.185 75.924 1.00 0.00 H new ATOM 0 HE1 HIS B 67 73.021 -1.960 80.083 1.00 0.00 H new ATOM 0 HE2 HIS B 67 73.902 -0.364 78.308 1.00 0.00 H new ATOM 2273 N HIS B 68 74.155 -6.293 76.253 1.00 0.00 N ATOM 2274 CA HIS B 68 74.605 -7.396 77.095 1.00 0.00 C ATOM 2275 C HIS B 68 75.020 -6.889 78.470 1.00 0.00 C ATOM 2276 O HIS B 68 75.806 -5.950 78.577 1.00 0.00 O ATOM 2277 CB HIS B 68 75.784 -8.122 76.433 1.00 0.00 C ATOM 2278 CG HIS B 68 76.293 -9.312 77.201 1.00 0.00 C ATOM 2279 ND1 HIS B 68 77.164 -9.205 78.265 1.00 0.00 N ATOM 2280 CD2 HIS B 68 76.061 -10.638 77.044 1.00 0.00 C ATOM 2281 CE1 HIS B 68 77.446 -10.411 78.725 1.00 0.00 C ATOM 2282 NE2 HIS B 68 76.790 -11.301 78.004 1.00 0.00 N ATOM 0 H HIS B 68 74.862 -5.937 75.609 1.00 0.00 H new ATOM 0 HA HIS B 68 73.776 -8.093 77.215 1.00 0.00 H new ATOM 0 HB2 HIS B 68 75.481 -8.450 75.439 1.00 0.00 H new ATOM 0 HB3 HIS B 68 76.602 -7.414 76.300 1.00 0.00 H new ATOM 0 HD2 HIS B 68 75.421 -11.091 76.301 1.00 0.00 H new ATOM 0 HE1 HIS B 68 78.104 -10.632 79.553 1.00 0.00 H new ATOM 0 HE2 HIS B 68 76.819 -12.312 78.137 1.00 0.00 H new ATOM 2291 N HIS B 69 74.496 -7.520 79.509 1.00 0.00 N ATOM 2292 CA HIS B 69 74.896 -7.210 80.872 1.00 0.00 C ATOM 2293 C HIS B 69 75.419 -8.472 81.546 1.00 0.00 C ATOM 2294 O HIS B 69 76.646 -8.688 81.528 1.00 0.00 O ATOM 2295 CB HIS B 69 73.724 -6.623 81.667 1.00 0.00 C ATOM 2296 CG HIS B 69 74.098 -6.204 83.056 1.00 0.00 C ATOM 2297 ND1 HIS B 69 73.718 -6.896 84.183 1.00 0.00 N ATOM 2298 CD2 HIS B 69 74.823 -5.148 83.492 1.00 0.00 C ATOM 2299 CE1 HIS B 69 74.193 -6.284 85.252 1.00 0.00 C ATOM 2300 NE2 HIS B 69 74.867 -5.219 84.862 1.00 0.00 N ATOM 2301 OXT HIS B 69 74.594 -9.257 82.054 1.00 0.00 O ATOM 0 H HIS B 69 73.790 -8.252 79.433 1.00 0.00 H new ATOM 0 HA HIS B 69 75.688 -6.461 80.845 1.00 0.00 H new ATOM 0 HB2 HIS B 69 73.326 -5.762 81.130 1.00 0.00 H new ATOM 0 HB3 HIS B 69 72.925 -7.362 81.721 1.00 0.00 H new ATOM 0 HD2 HIS B 69 75.282 -4.389 82.876 1.00 0.00 H new ATOM 0 HE1 HIS B 69 74.053 -6.602 86.275 1.00 0.00 H new ATOM 0 HE2 HIS B 69 75.342 -4.558 85.477 1.00 0.00 H new