USER MOD reduce.3.24.130724 H: found=0, std=0, add=739, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 743 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 7 SER OG : rot 180:sc= -0.187 USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 THR OG1 : rot 180:sc=-0.00399 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 TYR OH : rot -177:sc= -0.102! USER MOD Single : A 33 ASN :FLIP amide:sc= 0.233 F(o=-1.5!,f=0.23) USER MOD Single : A 36 ASN : amide:sc= 0 X(o=0,f=-0.031) USER MOD Single : A 38 THR OG1 : rot 40:sc= 0.0679 USER MOD Single : A 43 THR OG1 : rot 25:sc= 0.562 USER MOD Single : A 45 THR OG1 : rot 180:sc= -0.395 USER MOD Single : A 49 GLN :FLIP amide:sc= -0.67 F(o=-2!,f=-0.67) USER MOD Single : B 7 SER OG : rot 180:sc= 0 USER MOD Single : B 9 THR OG1 : rot 75:sc= 0.614 USER MOD Single : B 12 THR OG1 : rot 180:sc= 0.177 USER MOD Single : B 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 14 LYS NZ :NH3+ -114:sc= 1.11 (180deg=-0.0895) USER MOD Single : B 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 32 TYR OH : rot 180:sc= -0.982! USER MOD Single : B 33 ASN : amide:sc= -0.728 X(o=-0.73,f=-0.69) USER MOD Single : B 36 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 38 THR OG1 : rot 45:sc= 0.14 USER MOD Single : B 45 THR OG1 : rot 180:sc= -0.232 USER MOD Single : B 49 GLN :FLIP amide:sc= -0.889 F(o=-1.7!,f=-0.89) USER MOD ----------------------------------------------------------------- ATOM 16 N ARG A 3 3.367 -2.765 1.086 1.00 0.00 N ATOM 17 CA ARG A 3 4.809 -2.880 1.268 1.00 0.00 C ATOM 18 C ARG A 3 5.399 -3.905 0.303 1.00 0.00 C ATOM 19 O ARG A 3 4.753 -4.895 -0.038 1.00 0.00 O ATOM 20 CB ARG A 3 5.133 -3.275 2.710 1.00 0.00 C ATOM 21 CG ARG A 3 6.594 -3.634 2.930 1.00 0.00 C ATOM 22 CD ARG A 3 6.830 -5.128 2.780 1.00 0.00 C ATOM 23 NE ARG A 3 7.628 -5.669 3.876 1.00 0.00 N ATOM 24 CZ ARG A 3 7.149 -5.890 5.095 1.00 0.00 C ATOM 25 NH1 ARG A 3 5.881 -5.617 5.372 1.00 0.00 N ATOM 26 NH2 ARG A 3 7.938 -6.384 6.041 1.00 0.00 N ATOM 0 HA ARG A 3 5.255 -1.908 1.056 1.00 0.00 H new ATOM 0 HB2 ARG A 3 4.866 -2.451 3.372 1.00 0.00 H new ATOM 0 HB3 ARG A 3 4.512 -4.125 2.993 1.00 0.00 H new ATOM 0 HG2 ARG A 3 7.214 -3.093 2.215 1.00 0.00 H new ATOM 0 HG3 ARG A 3 6.902 -3.314 3.925 1.00 0.00 H new ATOM 0 HD2 ARG A 3 5.871 -5.644 2.741 1.00 0.00 H new ATOM 0 HD3 ARG A 3 7.335 -5.322 1.834 1.00 0.00 H new ATOM 0 HE ARG A 3 8.607 -5.889 3.696 1.00 0.00 H new ATOM 0 HH11 ARG A 3 5.271 -5.236 4.648 1.00 0.00 H new ATOM 0 HH12 ARG A 3 5.515 -5.788 6.309 1.00 0.00 H new ATOM 0 HH21 ARG A 3 8.914 -6.595 5.833 1.00 0.00 H new ATOM 0 HH22 ARG A 3 7.568 -6.553 6.977 1.00 0.00 H new ATOM 40 N VAL A 4 6.631 -3.659 -0.133 1.00 0.00 N ATOM 41 CA VAL A 4 7.308 -4.560 -1.058 1.00 0.00 C ATOM 42 C VAL A 4 8.695 -4.932 -0.546 1.00 0.00 C ATOM 43 O VAL A 4 9.529 -4.062 -0.294 1.00 0.00 O ATOM 44 CB VAL A 4 7.441 -3.932 -2.458 1.00 0.00 C ATOM 45 CG1 VAL A 4 8.030 -4.933 -3.439 1.00 0.00 C ATOM 46 CG2 VAL A 4 6.091 -3.427 -2.945 1.00 0.00 C ATOM 0 H VAL A 4 7.180 -2.844 0.140 1.00 0.00 H new ATOM 0 HA VAL A 4 6.696 -5.459 -1.128 1.00 0.00 H new ATOM 0 HB VAL A 4 8.120 -3.082 -2.393 1.00 0.00 H new ATOM 0 HG11 VAL A 4 8.116 -4.471 -4.422 1.00 0.00 H new ATOM 0 HG12 VAL A 4 9.017 -5.242 -3.095 1.00 0.00 H new ATOM 0 HG13 VAL A 4 7.379 -5.805 -3.504 1.00 0.00 H new ATOM 0 HG21 VAL A 4 6.203 -2.986 -3.936 1.00 0.00 H new ATOM 0 HG22 VAL A 4 5.388 -4.259 -2.995 1.00 0.00 H new ATOM 0 HG23 VAL A 4 5.713 -2.674 -2.254 1.00 0.00 H new ATOM 56 N ARG A 5 8.935 -6.230 -0.394 1.00 0.00 N ATOM 57 CA ARG A 5 10.222 -6.718 0.089 1.00 0.00 C ATOM 58 C ARG A 5 10.763 -7.817 -0.821 1.00 0.00 C ATOM 59 O ARG A 5 10.086 -8.814 -1.076 1.00 0.00 O ATOM 60 CB ARG A 5 10.087 -7.245 1.519 1.00 0.00 C ATOM 61 CG ARG A 5 11.358 -7.883 2.055 1.00 0.00 C ATOM 62 CD ARG A 5 11.122 -8.550 3.401 1.00 0.00 C ATOM 63 NE ARG A 5 11.154 -10.007 3.303 1.00 0.00 N ATOM 64 CZ ARG A 5 10.718 -10.817 4.260 1.00 0.00 C ATOM 65 NH1 ARG A 5 10.218 -10.316 5.381 1.00 0.00 N ATOM 66 NH2 ARG A 5 10.780 -12.133 4.097 1.00 0.00 N ATOM 0 H ARG A 5 8.256 -6.963 -0.598 1.00 0.00 H new ATOM 0 HA ARG A 5 10.925 -5.885 0.081 1.00 0.00 H new ATOM 0 HB2 ARG A 5 9.799 -6.423 2.174 1.00 0.00 H new ATOM 0 HB3 ARG A 5 9.281 -7.978 1.553 1.00 0.00 H new ATOM 0 HG2 ARG A 5 11.725 -8.621 1.341 1.00 0.00 H new ATOM 0 HG3 ARG A 5 12.133 -7.123 2.155 1.00 0.00 H new ATOM 0 HD2 ARG A 5 11.882 -8.218 4.108 1.00 0.00 H new ATOM 0 HD3 ARG A 5 10.157 -8.234 3.798 1.00 0.00 H new ATOM 0 HE ARG A 5 11.532 -10.425 2.453 1.00 0.00 H new ATOM 0 HH11 ARG A 5 10.167 -9.305 5.510 1.00 0.00 H new ATOM 0 HH12 ARG A 5 9.884 -10.941 6.114 1.00 0.00 H new ATOM 0 HH21 ARG A 5 11.163 -12.523 3.236 1.00 0.00 H new ATOM 0 HH22 ARG A 5 10.445 -12.754 4.833 1.00 0.00 H new ATOM 80 N ILE A 6 11.985 -7.627 -1.307 1.00 0.00 N ATOM 81 CA ILE A 6 12.616 -8.602 -2.187 1.00 0.00 C ATOM 82 C ILE A 6 13.906 -9.140 -1.577 1.00 0.00 C ATOM 83 O ILE A 6 14.797 -8.374 -1.210 1.00 0.00 O ATOM 84 CB ILE A 6 12.929 -7.995 -3.568 1.00 0.00 C ATOM 85 CG1 ILE A 6 11.696 -7.281 -4.126 1.00 0.00 C ATOM 86 CG2 ILE A 6 13.401 -9.076 -4.527 1.00 0.00 C ATOM 87 CD1 ILE A 6 11.925 -6.650 -5.482 1.00 0.00 C ATOM 0 H ILE A 6 12.557 -6.807 -1.106 1.00 0.00 H new ATOM 0 HA ILE A 6 11.906 -9.420 -2.311 1.00 0.00 H new ATOM 0 HB ILE A 6 13.729 -7.264 -3.454 1.00 0.00 H new ATOM 0 HG12 ILE A 6 10.875 -7.995 -4.200 1.00 0.00 H new ATOM 0 HG13 ILE A 6 11.384 -6.509 -3.423 1.00 0.00 H new ATOM 0 HG21 ILE A 6 13.618 -8.631 -5.498 1.00 0.00 H new ATOM 0 HG22 ILE A 6 14.303 -9.544 -4.132 1.00 0.00 H new ATOM 0 HG23 ILE A 6 12.621 -9.829 -4.639 1.00 0.00 H new ATOM 0 HD11 ILE A 6 11.009 -6.162 -5.816 1.00 0.00 H new ATOM 0 HD12 ILE A 6 12.724 -5.912 -5.410 1.00 0.00 H new ATOM 0 HD13 ILE A 6 12.207 -7.421 -6.199 1.00 0.00 H new ATOM 99 N SER A 7 13.999 -10.462 -1.473 1.00 0.00 N ATOM 100 CA SER A 7 15.179 -11.103 -0.905 1.00 0.00 C ATOM 101 C SER A 7 15.960 -11.852 -1.981 1.00 0.00 C ATOM 102 O SER A 7 15.403 -12.676 -2.707 1.00 0.00 O ATOM 103 CB SER A 7 14.774 -12.066 0.212 1.00 0.00 C ATOM 104 OG SER A 7 13.416 -11.886 0.574 1.00 0.00 O ATOM 0 H SER A 7 13.271 -11.110 -1.775 1.00 0.00 H new ATOM 0 HA SER A 7 15.821 -10.326 -0.489 1.00 0.00 H new ATOM 0 HB2 SER A 7 14.933 -13.094 -0.114 1.00 0.00 H new ATOM 0 HB3 SER A 7 15.410 -11.906 1.083 1.00 0.00 H new ATOM 0 HG SER A 7 13.182 -12.515 1.288 1.00 0.00 H new ATOM 110 N ILE A 8 17.253 -11.559 -2.076 1.00 0.00 N ATOM 111 CA ILE A 8 18.111 -12.206 -3.061 1.00 0.00 C ATOM 112 C ILE A 8 19.149 -13.095 -2.386 1.00 0.00 C ATOM 113 O ILE A 8 19.776 -12.702 -1.401 1.00 0.00 O ATOM 114 CB ILE A 8 18.834 -11.170 -3.943 1.00 0.00 C ATOM 115 CG1 ILE A 8 19.848 -10.380 -3.113 1.00 0.00 C ATOM 116 CG2 ILE A 8 17.827 -10.233 -4.593 1.00 0.00 C ATOM 117 CD1 ILE A 8 20.422 -9.183 -3.839 1.00 0.00 C ATOM 0 H ILE A 8 17.729 -10.879 -1.483 1.00 0.00 H new ATOM 0 HA ILE A 8 17.465 -12.819 -3.689 1.00 0.00 H new ATOM 0 HB ILE A 8 19.371 -11.697 -4.731 1.00 0.00 H new ATOM 0 HG12 ILE A 8 19.369 -10.042 -2.194 1.00 0.00 H new ATOM 0 HG13 ILE A 8 20.663 -11.043 -2.822 1.00 0.00 H new ATOM 0 HG21 ILE A 8 18.353 -9.507 -5.213 1.00 0.00 H new ATOM 0 HG22 ILE A 8 17.141 -10.810 -5.213 1.00 0.00 H new ATOM 0 HG23 ILE A 8 17.265 -9.710 -3.819 1.00 0.00 H new ATOM 0 HD11 ILE A 8 21.133 -8.671 -3.191 1.00 0.00 H new ATOM 0 HD12 ILE A 8 20.931 -9.516 -4.744 1.00 0.00 H new ATOM 0 HD13 ILE A 8 19.617 -8.499 -4.106 1.00 0.00 H new ATOM 129 N THR A 9 19.330 -14.298 -2.923 1.00 0.00 N ATOM 130 CA THR A 9 20.292 -15.244 -2.374 1.00 0.00 C ATOM 131 C THR A 9 21.419 -15.518 -3.363 1.00 0.00 C ATOM 132 O THR A 9 21.257 -16.293 -4.305 1.00 0.00 O ATOM 133 CB THR A 9 19.618 -16.577 -1.999 1.00 0.00 C ATOM 134 OG1 THR A 9 18.228 -16.365 -1.731 1.00 0.00 O ATOM 135 CG2 THR A 9 20.286 -17.197 -0.780 1.00 0.00 C ATOM 0 H THR A 9 18.822 -14.640 -3.739 1.00 0.00 H new ATOM 0 HA THR A 9 20.705 -14.788 -1.474 1.00 0.00 H new ATOM 0 HB THR A 9 19.725 -17.262 -2.840 1.00 0.00 H new ATOM 0 HG1 THR A 9 17.807 -17.218 -1.495 1.00 0.00 H new ATOM 0 HG21 THR A 9 19.793 -18.137 -0.534 1.00 0.00 H new ATOM 0 HG22 THR A 9 21.338 -17.384 -0.997 1.00 0.00 H new ATOM 0 HG23 THR A 9 20.206 -16.514 0.065 1.00 0.00 H new ATOM 143 N ALA A 10 22.563 -14.878 -3.142 1.00 0.00 N ATOM 144 CA ALA A 10 23.718 -15.055 -4.013 1.00 0.00 C ATOM 145 C ALA A 10 24.791 -15.902 -3.336 1.00 0.00 C ATOM 146 O ALA A 10 24.820 -16.021 -2.111 1.00 0.00 O ATOM 147 CB ALA A 10 24.287 -13.703 -4.417 1.00 0.00 C ATOM 0 H ALA A 10 22.714 -14.232 -2.367 1.00 0.00 H new ATOM 0 HA ALA A 10 23.389 -15.580 -4.909 1.00 0.00 H new ATOM 0 HB1 ALA A 10 25.149 -13.851 -5.067 1.00 0.00 H new ATOM 0 HB2 ALA A 10 23.526 -13.132 -4.948 1.00 0.00 H new ATOM 0 HB3 ALA A 10 24.595 -13.157 -3.525 1.00 0.00 H new ATOM 153 N ARG A 11 25.671 -16.488 -4.142 1.00 0.00 N ATOM 154 CA ARG A 11 26.744 -17.325 -3.620 1.00 0.00 C ATOM 155 C ARG A 11 27.774 -16.485 -2.870 1.00 0.00 C ATOM 156 O ARG A 11 28.476 -16.983 -1.990 1.00 0.00 O ATOM 157 CB ARG A 11 27.424 -18.088 -4.759 1.00 0.00 C ATOM 158 CG ARG A 11 27.860 -17.199 -5.912 1.00 0.00 C ATOM 159 CD ARG A 11 28.682 -17.971 -6.931 1.00 0.00 C ATOM 160 NE ARG A 11 28.069 -19.253 -7.271 1.00 0.00 N ATOM 161 CZ ARG A 11 28.738 -20.269 -7.804 1.00 0.00 C ATOM 162 NH1 ARG A 11 30.035 -20.154 -8.057 1.00 0.00 N ATOM 163 NH2 ARG A 11 28.110 -21.404 -8.085 1.00 0.00 N ATOM 0 H ARG A 11 25.662 -16.398 -5.158 1.00 0.00 H new ATOM 0 HA ARG A 11 26.307 -18.040 -2.923 1.00 0.00 H new ATOM 0 HB2 ARG A 11 28.295 -18.611 -4.365 1.00 0.00 H new ATOM 0 HB3 ARG A 11 26.739 -18.848 -5.136 1.00 0.00 H new ATOM 0 HG2 ARG A 11 26.981 -16.775 -6.398 1.00 0.00 H new ATOM 0 HG3 ARG A 11 28.446 -16.364 -5.528 1.00 0.00 H new ATOM 0 HD2 ARG A 11 28.795 -17.372 -7.835 1.00 0.00 H new ATOM 0 HD3 ARG A 11 29.683 -18.142 -6.535 1.00 0.00 H new ATOM 0 HE ARG A 11 27.073 -19.374 -7.089 1.00 0.00 H new ATOM 0 HH11 ARG A 11 30.521 -19.284 -7.842 1.00 0.00 H new ATOM 0 HH12 ARG A 11 30.546 -20.936 -8.466 1.00 0.00 H new ATOM 0 HH21 ARG A 11 27.113 -21.496 -7.892 1.00 0.00 H new ATOM 0 HH22 ARG A 11 28.625 -22.184 -8.494 1.00 0.00 H new ATOM 177 N THR A 12 27.858 -15.206 -3.225 1.00 0.00 N ATOM 178 CA THR A 12 28.802 -14.297 -2.587 1.00 0.00 C ATOM 179 C THR A 12 28.173 -12.928 -2.352 1.00 0.00 C ATOM 180 O THR A 12 27.302 -12.495 -3.106 1.00 0.00 O ATOM 181 CB THR A 12 30.076 -14.125 -3.435 1.00 0.00 C ATOM 182 OG1 THR A 12 30.858 -13.037 -2.930 1.00 0.00 O ATOM 183 CG2 THR A 12 29.725 -13.869 -4.893 1.00 0.00 C ATOM 0 H THR A 12 27.284 -14.777 -3.951 1.00 0.00 H new ATOM 0 HA THR A 12 29.070 -14.741 -1.628 1.00 0.00 H new ATOM 0 HB THR A 12 30.654 -15.047 -3.373 1.00 0.00 H new ATOM 0 HG1 THR A 12 31.667 -12.936 -3.474 1.00 0.00 H new ATOM 0 HG21 THR A 12 30.641 -13.751 -5.472 1.00 0.00 H new ATOM 0 HG22 THR A 12 29.155 -14.712 -5.283 1.00 0.00 H new ATOM 0 HG23 THR A 12 29.128 -12.961 -4.969 1.00 0.00 H new ATOM 191 N LYS A 13 28.621 -12.250 -1.300 1.00 0.00 N ATOM 192 CA LYS A 13 28.104 -10.928 -0.966 1.00 0.00 C ATOM 193 C LYS A 13 28.265 -9.968 -2.139 1.00 0.00 C ATOM 194 O LYS A 13 27.413 -9.112 -2.376 1.00 0.00 O ATOM 195 CB LYS A 13 28.825 -10.373 0.265 1.00 0.00 C ATOM 196 CG LYS A 13 30.338 -10.363 0.131 1.00 0.00 C ATOM 197 CD LYS A 13 31.017 -10.225 1.483 1.00 0.00 C ATOM 198 CE LYS A 13 32.435 -9.693 1.343 1.00 0.00 C ATOM 199 NZ LYS A 13 32.780 -8.741 2.435 1.00 0.00 N ATOM 0 H LYS A 13 29.341 -12.594 -0.665 1.00 0.00 H new ATOM 0 HA LYS A 13 27.041 -11.026 -0.744 1.00 0.00 H new ATOM 0 HB2 LYS A 13 28.478 -9.356 0.451 1.00 0.00 H new ATOM 0 HB3 LYS A 13 28.550 -10.968 1.136 1.00 0.00 H new ATOM 0 HG2 LYS A 13 30.668 -11.284 -0.350 1.00 0.00 H new ATOM 0 HG3 LYS A 13 30.641 -9.539 -0.515 1.00 0.00 H new ATOM 0 HD2 LYS A 13 30.436 -9.554 2.116 1.00 0.00 H new ATOM 0 HD3 LYS A 13 31.038 -11.194 1.981 1.00 0.00 H new ATOM 0 HE2 LYS A 13 33.138 -10.526 1.352 1.00 0.00 H new ATOM 0 HE3 LYS A 13 32.543 -9.195 0.379 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 33.754 -8.401 2.304 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 32.125 -7.933 2.411 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 32.702 -9.223 3.353 1.00 0.00 H new ATOM 213 N LYS A 14 29.364 -10.115 -2.872 1.00 0.00 N ATOM 214 CA LYS A 14 29.636 -9.263 -4.023 1.00 0.00 C ATOM 215 C LYS A 14 28.528 -9.383 -5.064 1.00 0.00 C ATOM 216 O LYS A 14 28.133 -8.394 -5.680 1.00 0.00 O ATOM 217 CB LYS A 14 30.982 -9.634 -4.651 1.00 0.00 C ATOM 218 CG LYS A 14 32.179 -9.224 -3.810 1.00 0.00 C ATOM 219 CD LYS A 14 32.386 -7.719 -3.831 1.00 0.00 C ATOM 220 CE LYS A 14 31.900 -7.071 -2.543 1.00 0.00 C ATOM 221 NZ LYS A 14 33.003 -6.898 -1.559 1.00 0.00 N ATOM 0 H LYS A 14 30.081 -10.817 -2.689 1.00 0.00 H new ATOM 0 HA LYS A 14 29.675 -8.230 -3.677 1.00 0.00 H new ATOM 0 HB2 LYS A 14 31.014 -10.712 -4.812 1.00 0.00 H new ATOM 0 HB3 LYS A 14 31.058 -9.163 -5.631 1.00 0.00 H new ATOM 0 HG2 LYS A 14 32.034 -9.558 -2.783 1.00 0.00 H new ATOM 0 HG3 LYS A 14 33.075 -9.721 -4.184 1.00 0.00 H new ATOM 0 HD2 LYS A 14 33.444 -7.498 -3.974 1.00 0.00 H new ATOM 0 HD3 LYS A 14 31.853 -7.289 -4.679 1.00 0.00 H new ATOM 0 HE2 LYS A 14 31.459 -6.100 -2.769 1.00 0.00 H new ATOM 0 HE3 LYS A 14 31.113 -7.684 -2.103 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 32.631 -6.453 -0.695 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 33.407 -7.827 -1.324 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 33.742 -6.293 -1.969 1.00 0.00 H new ATOM 235 N GLU A 15 28.029 -10.601 -5.253 1.00 0.00 N ATOM 236 CA GLU A 15 26.965 -10.849 -6.219 1.00 0.00 C ATOM 237 C GLU A 15 25.666 -10.179 -5.781 1.00 0.00 C ATOM 238 O GLU A 15 25.049 -9.437 -6.546 1.00 0.00 O ATOM 239 CB GLU A 15 26.743 -12.353 -6.392 1.00 0.00 C ATOM 240 CG GLU A 15 27.652 -12.987 -7.432 1.00 0.00 C ATOM 241 CD GLU A 15 27.304 -14.437 -7.704 1.00 0.00 C ATOM 242 OE1 GLU A 15 26.181 -14.854 -7.354 1.00 0.00 O ATOM 243 OE2 GLU A 15 28.157 -15.155 -8.269 1.00 0.00 O ATOM 0 H GLU A 15 28.344 -11.431 -4.750 1.00 0.00 H new ATOM 0 HA GLU A 15 27.270 -10.422 -7.174 1.00 0.00 H new ATOM 0 HB2 GLU A 15 26.901 -12.848 -5.434 1.00 0.00 H new ATOM 0 HB3 GLU A 15 25.705 -12.528 -6.674 1.00 0.00 H new ATOM 0 HG2 GLU A 15 27.585 -12.421 -8.361 1.00 0.00 H new ATOM 0 HG3 GLU A 15 28.686 -12.923 -7.093 1.00 0.00 H new ATOM 250 N ALA A 16 25.256 -10.446 -4.546 1.00 0.00 N ATOM 251 CA ALA A 16 24.032 -9.869 -4.005 1.00 0.00 C ATOM 252 C ALA A 16 24.100 -8.346 -3.998 1.00 0.00 C ATOM 253 O ALA A 16 23.123 -7.671 -4.324 1.00 0.00 O ATOM 254 CB ALA A 16 23.777 -10.394 -2.600 1.00 0.00 C ATOM 0 H ALA A 16 25.754 -11.059 -3.901 1.00 0.00 H new ATOM 0 HA ALA A 16 23.204 -10.167 -4.648 1.00 0.00 H new ATOM 0 HB1 ALA A 16 22.860 -9.955 -2.208 1.00 0.00 H new ATOM 0 HB2 ALA A 16 23.676 -11.479 -2.630 1.00 0.00 H new ATOM 0 HB3 ALA A 16 24.613 -10.125 -1.954 1.00 0.00 H new ATOM 260 N GLU A 17 25.258 -7.811 -3.625 1.00 0.00 N ATOM 261 CA GLU A 17 25.451 -6.366 -3.574 1.00 0.00 C ATOM 262 C GLU A 17 25.212 -5.738 -4.944 1.00 0.00 C ATOM 263 O GLU A 17 24.622 -4.663 -5.053 1.00 0.00 O ATOM 264 CB GLU A 17 26.863 -6.035 -3.088 1.00 0.00 C ATOM 265 CG GLU A 17 26.957 -5.835 -1.584 1.00 0.00 C ATOM 266 CD GLU A 17 27.853 -4.672 -1.205 1.00 0.00 C ATOM 267 OE1 GLU A 17 27.683 -3.579 -1.783 1.00 0.00 O ATOM 268 OE2 GLU A 17 28.725 -4.856 -0.330 1.00 0.00 O ATOM 0 H GLU A 17 26.077 -8.356 -3.354 1.00 0.00 H new ATOM 0 HA GLU A 17 24.727 -5.952 -2.872 1.00 0.00 H new ATOM 0 HB2 GLU A 17 27.537 -6.839 -3.382 1.00 0.00 H new ATOM 0 HB3 GLU A 17 27.208 -5.130 -3.589 1.00 0.00 H new ATOM 0 HG2 GLU A 17 25.959 -5.666 -1.181 1.00 0.00 H new ATOM 0 HG3 GLU A 17 27.337 -6.747 -1.123 1.00 0.00 H new ATOM 275 N LYS A 18 25.676 -6.416 -5.989 1.00 0.00 N ATOM 276 CA LYS A 18 25.514 -5.927 -7.353 1.00 0.00 C ATOM 277 C LYS A 18 24.038 -5.822 -7.721 1.00 0.00 C ATOM 278 O LYS A 18 23.597 -4.819 -8.282 1.00 0.00 O ATOM 279 CB LYS A 18 26.233 -6.852 -8.337 1.00 0.00 C ATOM 280 CG LYS A 18 27.739 -6.891 -8.147 1.00 0.00 C ATOM 281 CD LYS A 18 28.459 -6.111 -9.234 1.00 0.00 C ATOM 282 CE LYS A 18 29.956 -6.376 -9.212 1.00 0.00 C ATOM 283 NZ LYS A 18 30.396 -7.172 -10.392 1.00 0.00 N ATOM 0 H LYS A 18 26.168 -7.307 -5.917 1.00 0.00 H new ATOM 0 HA LYS A 18 25.956 -4.932 -7.411 1.00 0.00 H new ATOM 0 HB2 LYS A 18 25.836 -7.861 -8.230 1.00 0.00 H new ATOM 0 HB3 LYS A 18 26.012 -6.529 -9.354 1.00 0.00 H new ATOM 0 HG2 LYS A 18 27.994 -6.477 -7.171 1.00 0.00 H new ATOM 0 HG3 LYS A 18 28.081 -7.926 -8.154 1.00 0.00 H new ATOM 0 HD2 LYS A 18 28.054 -6.385 -10.208 1.00 0.00 H new ATOM 0 HD3 LYS A 18 28.275 -5.045 -9.101 1.00 0.00 H new ATOM 0 HE2 LYS A 18 30.492 -5.427 -9.193 1.00 0.00 H new ATOM 0 HE3 LYS A 18 30.217 -6.908 -8.297 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 31.422 -7.331 -10.340 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 29.903 -8.088 -10.396 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 30.170 -6.653 -11.265 1.00 0.00 H new ATOM 297 N PHE A 19 23.278 -6.864 -7.402 1.00 0.00 N ATOM 298 CA PHE A 19 21.850 -6.889 -7.699 1.00 0.00 C ATOM 299 C PHE A 19 21.112 -5.810 -6.912 1.00 0.00 C ATOM 300 O PHE A 19 20.218 -5.146 -7.436 1.00 0.00 O ATOM 301 CB PHE A 19 21.264 -8.265 -7.374 1.00 0.00 C ATOM 302 CG PHE A 19 21.363 -9.242 -8.511 1.00 0.00 C ATOM 303 CD1 PHE A 19 22.517 -9.984 -8.704 1.00 0.00 C ATOM 304 CD2 PHE A 19 20.303 -9.418 -9.385 1.00 0.00 C ATOM 305 CE1 PHE A 19 22.611 -10.884 -9.750 1.00 0.00 C ATOM 306 CE2 PHE A 19 20.391 -10.317 -10.432 1.00 0.00 C ATOM 307 CZ PHE A 19 21.547 -11.051 -10.614 1.00 0.00 C ATOM 0 H PHE A 19 23.627 -7.703 -6.938 1.00 0.00 H new ATOM 0 HA PHE A 19 21.722 -6.689 -8.763 1.00 0.00 H new ATOM 0 HB2 PHE A 19 21.781 -8.676 -6.507 1.00 0.00 H new ATOM 0 HB3 PHE A 19 20.217 -8.149 -7.096 1.00 0.00 H new ATOM 0 HD1 PHE A 19 23.352 -9.858 -8.031 1.00 0.00 H new ATOM 0 HD2 PHE A 19 19.397 -8.846 -9.247 1.00 0.00 H new ATOM 0 HE1 PHE A 19 23.516 -11.456 -9.891 1.00 0.00 H new ATOM 0 HE2 PHE A 19 19.557 -10.445 -11.106 1.00 0.00 H new ATOM 0 HZ PHE A 19 21.618 -11.754 -11.431 1.00 0.00 H new ATOM 317 N ALA A 20 21.492 -5.643 -5.649 1.00 0.00 N ATOM 318 CA ALA A 20 20.868 -4.645 -4.790 1.00 0.00 C ATOM 319 C ALA A 20 20.948 -3.256 -5.413 1.00 0.00 C ATOM 320 O ALA A 20 19.978 -2.499 -5.392 1.00 0.00 O ATOM 321 CB ALA A 20 21.523 -4.648 -3.416 1.00 0.00 C ATOM 0 H ALA A 20 22.229 -6.186 -5.199 1.00 0.00 H new ATOM 0 HA ALA A 20 19.815 -4.904 -4.680 1.00 0.00 H new ATOM 0 HB1 ALA A 20 21.047 -3.898 -2.784 1.00 0.00 H new ATOM 0 HB2 ALA A 20 21.408 -5.632 -2.960 1.00 0.00 H new ATOM 0 HB3 ALA A 20 22.583 -4.417 -3.518 1.00 0.00 H new ATOM 327 N ALA A 21 22.110 -2.927 -5.967 1.00 0.00 N ATOM 328 CA ALA A 21 22.316 -1.629 -6.598 1.00 0.00 C ATOM 329 C ALA A 21 21.247 -1.355 -7.650 1.00 0.00 C ATOM 330 O ALA A 21 20.705 -0.252 -7.724 1.00 0.00 O ATOM 331 CB ALA A 21 23.703 -1.559 -7.220 1.00 0.00 C ATOM 0 H ALA A 21 22.924 -3.542 -5.992 1.00 0.00 H new ATOM 0 HA ALA A 21 22.236 -0.861 -5.829 1.00 0.00 H new ATOM 0 HB1 ALA A 21 23.843 -0.584 -7.688 1.00 0.00 H new ATOM 0 HB2 ALA A 21 24.457 -1.702 -6.446 1.00 0.00 H new ATOM 0 HB3 ALA A 21 23.804 -2.341 -7.973 1.00 0.00 H new ATOM 337 N ILE A 22 20.951 -2.363 -8.462 1.00 0.00 N ATOM 338 CA ILE A 22 19.946 -2.229 -9.510 1.00 0.00 C ATOM 339 C ILE A 22 18.549 -2.086 -8.917 1.00 0.00 C ATOM 340 O ILE A 22 17.793 -1.188 -9.291 1.00 0.00 O ATOM 341 CB ILE A 22 19.965 -3.437 -10.465 1.00 0.00 C ATOM 342 CG1 ILE A 22 21.339 -3.573 -11.124 1.00 0.00 C ATOM 343 CG2 ILE A 22 18.877 -3.295 -11.520 1.00 0.00 C ATOM 344 CD1 ILE A 22 21.698 -4.998 -11.484 1.00 0.00 C ATOM 0 H ILE A 22 21.392 -3.281 -8.415 1.00 0.00 H new ATOM 0 HA ILE A 22 20.193 -1.328 -10.071 1.00 0.00 H new ATOM 0 HB ILE A 22 19.769 -4.341 -9.888 1.00 0.00 H new ATOM 0 HG12 ILE A 22 21.362 -2.962 -12.026 1.00 0.00 H new ATOM 0 HG13 ILE A 22 22.097 -3.175 -10.450 1.00 0.00 H new ATOM 0 HG21 ILE A 22 18.903 -4.156 -12.188 1.00 0.00 H new ATOM 0 HG22 ILE A 22 17.903 -3.242 -11.033 1.00 0.00 H new ATOM 0 HG23 ILE A 22 19.045 -2.385 -12.096 1.00 0.00 H new ATOM 0 HD11 ILE A 22 22.685 -5.019 -11.947 1.00 0.00 H new ATOM 0 HD12 ILE A 22 21.707 -5.610 -10.582 1.00 0.00 H new ATOM 0 HD13 ILE A 22 20.961 -5.393 -12.183 1.00 0.00 H new ATOM 356 N LEU A 23 18.212 -2.975 -7.990 1.00 0.00 N ATOM 357 CA LEU A 23 16.905 -2.947 -7.342 1.00 0.00 C ATOM 358 C LEU A 23 16.620 -1.571 -6.749 1.00 0.00 C ATOM 359 O LEU A 23 15.500 -1.066 -6.837 1.00 0.00 O ATOM 360 CB LEU A 23 16.834 -4.012 -6.246 1.00 0.00 C ATOM 361 CG LEU A 23 15.873 -5.174 -6.499 1.00 0.00 C ATOM 362 CD1 LEU A 23 14.445 -4.667 -6.631 1.00 0.00 C ATOM 363 CD2 LEU A 23 16.284 -5.944 -7.746 1.00 0.00 C ATOM 0 H LEU A 23 18.825 -3.724 -7.670 1.00 0.00 H new ATOM 0 HA LEU A 23 16.148 -3.160 -8.097 1.00 0.00 H new ATOM 0 HB2 LEU A 23 17.834 -4.420 -6.098 1.00 0.00 H new ATOM 0 HB3 LEU A 23 16.547 -3.526 -5.313 1.00 0.00 H new ATOM 0 HG LEU A 23 15.919 -5.851 -5.646 1.00 0.00 H new ATOM 0 HD11 LEU A 23 13.775 -5.508 -6.811 1.00 0.00 H new ATOM 0 HD12 LEU A 23 14.152 -4.160 -5.711 1.00 0.00 H new ATOM 0 HD13 LEU A 23 14.383 -3.969 -7.466 1.00 0.00 H new ATOM 0 HD21 LEU A 23 15.589 -6.767 -7.911 1.00 0.00 H new ATOM 0 HD22 LEU A 23 16.267 -5.277 -8.608 1.00 0.00 H new ATOM 0 HD23 LEU A 23 17.291 -6.340 -7.614 1.00 0.00 H new ATOM 375 N ILE A 24 17.641 -0.969 -6.148 1.00 0.00 N ATOM 376 CA ILE A 24 17.501 0.350 -5.544 1.00 0.00 C ATOM 377 C ILE A 24 17.079 1.387 -6.580 1.00 0.00 C ATOM 378 O ILE A 24 16.215 2.225 -6.320 1.00 0.00 O ATOM 379 CB ILE A 24 18.813 0.808 -4.881 1.00 0.00 C ATOM 380 CG1 ILE A 24 19.214 -0.163 -3.769 1.00 0.00 C ATOM 381 CG2 ILE A 24 18.665 2.219 -4.332 1.00 0.00 C ATOM 382 CD1 ILE A 24 20.710 -0.328 -3.621 1.00 0.00 C ATOM 0 H ILE A 24 18.574 -1.374 -6.066 1.00 0.00 H new ATOM 0 HA ILE A 24 16.728 0.267 -4.780 1.00 0.00 H new ATOM 0 HB ILE A 24 19.601 0.813 -5.634 1.00 0.00 H new ATOM 0 HG12 ILE A 24 18.800 0.189 -2.824 1.00 0.00 H new ATOM 0 HG13 ILE A 24 18.767 -1.137 -3.970 1.00 0.00 H new ATOM 0 HG21 ILE A 24 19.601 2.528 -3.866 1.00 0.00 H new ATOM 0 HG22 ILE A 24 18.421 2.902 -5.146 1.00 0.00 H new ATOM 0 HG23 ILE A 24 17.867 2.239 -3.590 1.00 0.00 H new ATOM 0 HD11 ILE A 24 20.921 -1.030 -2.814 1.00 0.00 H new ATOM 0 HD12 ILE A 24 21.128 -0.709 -4.553 1.00 0.00 H new ATOM 0 HD13 ILE A 24 21.161 0.637 -3.389 1.00 0.00 H new ATOM 394 N LYS A 25 17.693 1.324 -7.756 1.00 0.00 N ATOM 395 CA LYS A 25 17.380 2.254 -8.834 1.00 0.00 C ATOM 396 C LYS A 25 15.954 2.049 -9.333 1.00 0.00 C ATOM 397 O LYS A 25 15.229 3.012 -9.586 1.00 0.00 O ATOM 398 CB LYS A 25 18.367 2.077 -9.991 1.00 0.00 C ATOM 399 CG LYS A 25 19.821 2.221 -9.577 1.00 0.00 C ATOM 400 CD LYS A 25 20.339 3.626 -9.833 1.00 0.00 C ATOM 401 CE LYS A 25 19.594 4.655 -8.997 1.00 0.00 C ATOM 402 NZ LYS A 25 20.240 5.995 -9.063 1.00 0.00 N ATOM 0 H LYS A 25 18.411 0.638 -7.987 1.00 0.00 H new ATOM 0 HA LYS A 25 17.467 3.267 -8.442 1.00 0.00 H new ATOM 0 HB2 LYS A 25 18.220 1.093 -10.435 1.00 0.00 H new ATOM 0 HB3 LYS A 25 18.143 2.812 -10.764 1.00 0.00 H new ATOM 0 HG2 LYS A 25 19.924 1.982 -8.519 1.00 0.00 H new ATOM 0 HG3 LYS A 25 20.429 1.503 -10.127 1.00 0.00 H new ATOM 0 HD2 LYS A 25 21.403 3.670 -9.603 1.00 0.00 H new ATOM 0 HD3 LYS A 25 20.231 3.868 -10.890 1.00 0.00 H new ATOM 0 HE2 LYS A 25 18.564 4.730 -9.347 1.00 0.00 H new ATOM 0 HE3 LYS A 25 19.555 4.321 -7.960 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 19.703 6.668 -8.480 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 21.214 5.929 -8.706 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 20.255 6.325 -10.049 1.00 0.00 H new ATOM 416 N VAL A 26 15.555 0.788 -9.472 1.00 0.00 N ATOM 417 CA VAL A 26 14.214 0.457 -9.938 1.00 0.00 C ATOM 418 C VAL A 26 13.156 0.927 -8.946 1.00 0.00 C ATOM 419 O VAL A 26 12.106 1.437 -9.338 1.00 0.00 O ATOM 420 CB VAL A 26 14.056 -1.059 -10.161 1.00 0.00 C ATOM 421 CG1 VAL A 26 12.740 -1.362 -10.860 1.00 0.00 C ATOM 422 CG2 VAL A 26 15.231 -1.605 -10.958 1.00 0.00 C ATOM 0 H VAL A 26 16.142 -0.021 -9.268 1.00 0.00 H new ATOM 0 HA VAL A 26 14.072 0.973 -10.888 1.00 0.00 H new ATOM 0 HB VAL A 26 14.045 -1.552 -9.189 1.00 0.00 H new ATOM 0 HG11 VAL A 26 12.646 -2.438 -11.009 1.00 0.00 H new ATOM 0 HG12 VAL A 26 11.912 -1.007 -10.246 1.00 0.00 H new ATOM 0 HG13 VAL A 26 12.717 -0.859 -11.827 1.00 0.00 H new ATOM 0 HG21 VAL A 26 15.103 -2.677 -11.106 1.00 0.00 H new ATOM 0 HG22 VAL A 26 15.276 -1.107 -11.927 1.00 0.00 H new ATOM 0 HG23 VAL A 26 16.157 -1.422 -10.413 1.00 0.00 H new ATOM 432 N PHE A 27 13.439 0.752 -7.660 1.00 0.00 N ATOM 433 CA PHE A 27 12.511 1.158 -6.611 1.00 0.00 C ATOM 434 C PHE A 27 12.349 2.675 -6.585 1.00 0.00 C ATOM 435 O PHE A 27 11.241 3.189 -6.439 1.00 0.00 O ATOM 436 CB PHE A 27 13.000 0.662 -5.248 1.00 0.00 C ATOM 437 CG PHE A 27 12.511 -0.714 -4.900 1.00 0.00 C ATOM 438 CD1 PHE A 27 11.154 -0.985 -4.829 1.00 0.00 C ATOM 439 CD2 PHE A 27 13.409 -1.738 -4.642 1.00 0.00 C ATOM 440 CE1 PHE A 27 10.701 -2.251 -4.510 1.00 0.00 C ATOM 441 CE2 PHE A 27 12.961 -3.006 -4.322 1.00 0.00 C ATOM 442 CZ PHE A 27 11.605 -3.262 -4.255 1.00 0.00 C ATOM 0 H PHE A 27 14.304 0.332 -7.319 1.00 0.00 H new ATOM 0 HA PHE A 27 11.541 0.711 -6.826 1.00 0.00 H new ATOM 0 HB2 PHE A 27 14.090 0.664 -5.239 1.00 0.00 H new ATOM 0 HB3 PHE A 27 12.673 1.361 -4.478 1.00 0.00 H new ATOM 0 HD1 PHE A 27 10.442 -0.197 -5.025 1.00 0.00 H new ATOM 0 HD2 PHE A 27 14.470 -1.543 -4.692 1.00 0.00 H new ATOM 0 HE1 PHE A 27 9.640 -2.449 -4.460 1.00 0.00 H new ATOM 0 HE2 PHE A 27 13.670 -3.796 -4.125 1.00 0.00 H new ATOM 0 HZ PHE A 27 11.253 -4.252 -4.004 1.00 0.00 H new ATOM 452 N ALA A 28 13.464 3.385 -6.726 1.00 0.00 N ATOM 453 CA ALA A 28 13.446 4.843 -6.721 1.00 0.00 C ATOM 454 C ALA A 28 12.641 5.386 -7.897 1.00 0.00 C ATOM 455 O ALA A 28 11.820 6.288 -7.733 1.00 0.00 O ATOM 456 CB ALA A 28 14.866 5.387 -6.754 1.00 0.00 C ATOM 0 H ALA A 28 14.390 2.975 -6.845 1.00 0.00 H new ATOM 0 HA ALA A 28 12.963 5.174 -5.801 1.00 0.00 H new ATOM 0 HB1 ALA A 28 14.838 6.477 -6.750 1.00 0.00 H new ATOM 0 HB2 ALA A 28 15.411 5.035 -5.878 1.00 0.00 H new ATOM 0 HB3 ALA A 28 15.368 5.040 -7.657 1.00 0.00 H new ATOM 462 N GLU A 29 12.885 4.833 -9.081 1.00 0.00 N ATOM 463 CA GLU A 29 12.183 5.265 -10.283 1.00 0.00 C ATOM 464 C GLU A 29 10.715 4.849 -10.236 1.00 0.00 C ATOM 465 O GLU A 29 9.880 5.394 -10.959 1.00 0.00 O ATOM 466 CB GLU A 29 12.850 4.678 -11.529 1.00 0.00 C ATOM 467 CG GLU A 29 12.311 3.313 -11.923 1.00 0.00 C ATOM 468 CD GLU A 29 11.266 3.393 -13.019 1.00 0.00 C ATOM 469 OE1 GLU A 29 11.616 3.803 -14.145 1.00 0.00 O ATOM 470 OE2 GLU A 29 10.097 3.045 -12.749 1.00 0.00 O ATOM 0 H GLU A 29 13.563 4.086 -9.233 1.00 0.00 H new ATOM 0 HA GLU A 29 12.233 6.353 -10.330 1.00 0.00 H new ATOM 0 HB2 GLU A 29 12.714 5.367 -12.362 1.00 0.00 H new ATOM 0 HB3 GLU A 29 13.923 4.599 -11.353 1.00 0.00 H new ATOM 0 HG2 GLU A 29 13.136 2.684 -12.258 1.00 0.00 H new ATOM 0 HG3 GLU A 29 11.877 2.831 -11.047 1.00 0.00 H new ATOM 477 N LEU A 30 10.408 3.881 -9.380 1.00 0.00 N ATOM 478 CA LEU A 30 9.042 3.390 -9.238 1.00 0.00 C ATOM 479 C LEU A 30 8.278 4.202 -8.197 1.00 0.00 C ATOM 480 O LEU A 30 7.057 4.096 -8.085 1.00 0.00 O ATOM 481 CB LEU A 30 9.048 1.912 -8.844 1.00 0.00 C ATOM 482 CG LEU A 30 9.333 0.919 -9.971 1.00 0.00 C ATOM 483 CD1 LEU A 30 9.718 -0.438 -9.402 1.00 0.00 C ATOM 484 CD2 LEU A 30 8.124 0.791 -10.887 1.00 0.00 C ATOM 0 H LEU A 30 11.087 3.420 -8.774 1.00 0.00 H new ATOM 0 HA LEU A 30 8.540 3.501 -10.199 1.00 0.00 H new ATOM 0 HB2 LEU A 30 9.794 1.768 -8.062 1.00 0.00 H new ATOM 0 HB3 LEU A 30 8.079 1.669 -8.409 1.00 0.00 H new ATOM 0 HG LEU A 30 10.171 1.295 -10.558 1.00 0.00 H new ATOM 0 HD11 LEU A 30 9.917 -1.132 -10.219 1.00 0.00 H new ATOM 0 HD12 LEU A 30 10.612 -0.334 -8.788 1.00 0.00 H new ATOM 0 HD13 LEU A 30 8.901 -0.822 -8.791 1.00 0.00 H new ATOM 0 HD21 LEU A 30 8.345 0.080 -11.683 1.00 0.00 H new ATOM 0 HD22 LEU A 30 7.268 0.438 -10.312 1.00 0.00 H new ATOM 0 HD23 LEU A 30 7.893 1.763 -11.322 1.00 0.00 H new ATOM 496 N GLY A 31 9.005 5.015 -7.437 1.00 0.00 N ATOM 497 CA GLY A 31 8.379 5.835 -6.417 1.00 0.00 C ATOM 498 C GLY A 31 8.461 5.209 -5.039 1.00 0.00 C ATOM 499 O GLY A 31 7.800 5.661 -4.104 1.00 0.00 O ATOM 0 H GLY A 31 10.017 5.120 -7.510 1.00 0.00 H new ATOM 0 HA2 GLY A 31 8.858 6.814 -6.397 1.00 0.00 H new ATOM 0 HA3 GLY A 31 7.333 5.998 -6.677 1.00 0.00 H new ATOM 503 N TYR A 32 9.273 4.166 -4.912 1.00 0.00 N ATOM 504 CA TYR A 32 9.436 3.474 -3.639 1.00 0.00 C ATOM 505 C TYR A 32 10.632 4.025 -2.868 1.00 0.00 C ATOM 506 O TYR A 32 11.346 3.284 -2.195 1.00 0.00 O ATOM 507 CB TYR A 32 9.613 1.972 -3.870 1.00 0.00 C ATOM 508 CG TYR A 32 8.386 1.298 -4.441 1.00 0.00 C ATOM 509 CD1 TYR A 32 7.963 1.563 -5.738 1.00 0.00 C ATOM 510 CD2 TYR A 32 7.649 0.396 -3.683 1.00 0.00 C ATOM 511 CE1 TYR A 32 6.842 0.950 -6.263 1.00 0.00 C ATOM 512 CE2 TYR A 32 6.528 -0.223 -4.201 1.00 0.00 C ATOM 513 CZ TYR A 32 6.128 0.058 -5.490 1.00 0.00 C ATOM 514 OH TYR A 32 5.011 -0.555 -6.010 1.00 0.00 O ATOM 0 H TYR A 32 9.829 3.781 -5.675 1.00 0.00 H new ATOM 0 HA TYR A 32 8.536 3.641 -3.047 1.00 0.00 H new ATOM 0 HB2 TYR A 32 10.452 1.814 -4.547 1.00 0.00 H new ATOM 0 HB3 TYR A 32 9.872 1.496 -2.924 1.00 0.00 H new ATOM 0 HD1 TYR A 32 8.520 2.260 -6.346 1.00 0.00 H new ATOM 0 HD2 TYR A 32 7.958 0.175 -2.672 1.00 0.00 H new ATOM 0 HE1 TYR A 32 6.526 1.168 -7.273 1.00 0.00 H new ATOM 0 HE2 TYR A 32 5.968 -0.923 -3.599 1.00 0.00 H new ATOM 0 HH TYR A 32 4.597 -1.117 -5.323 1.00 0.00 H new ATOM 524 N ASN A 33 10.842 5.334 -2.973 1.00 0.00 N ATOM 525 CA ASN A 33 11.950 5.987 -2.286 1.00 0.00 C ATOM 526 C ASN A 33 11.996 5.578 -0.816 1.00 0.00 C ATOM 527 O ASN A 33 11.011 5.083 -0.268 1.00 0.00 O ATOM 528 CB ASN A 33 11.824 7.507 -2.400 1.00 0.00 C ATOM 529 CG ASN A 33 10.384 7.976 -2.307 1.00 0.00 C ATOM 530 OD1 ASN A 33 9.678 7.942 -3.431 1.00 0.00 O flip ATOM 531 ND2 ASN A 33 9.914 8.364 -1.237 1.00 0.00 N flip ATOM 0 H ASN A 33 10.260 5.962 -3.527 1.00 0.00 H new ATOM 0 HA ASN A 33 12.877 5.669 -2.763 1.00 0.00 H new ATOM 0 HB2 ASN A 33 12.408 7.978 -1.609 1.00 0.00 H new ATOM 0 HB3 ASN A 33 12.249 7.834 -3.349 1.00 0.00 H new ATOM 0 HD21 ASN A 33 10.494 8.373 -0.398 1.00 0.00 H new ATOM 0 HD22 ASN A 33 8.944 8.677 -1.189 1.00 0.00 H new ATOM 538 N ASP A 34 13.146 5.789 -0.185 1.00 0.00 N ATOM 539 CA ASP A 34 13.320 5.445 1.221 1.00 0.00 C ATOM 540 C ASP A 34 13.350 3.931 1.410 1.00 0.00 C ATOM 541 O ASP A 34 12.544 3.373 2.154 1.00 0.00 O ATOM 542 CB ASP A 34 12.196 6.054 2.061 1.00 0.00 C ATOM 543 CG ASP A 34 12.648 6.407 3.464 1.00 0.00 C ATOM 544 OD1 ASP A 34 13.571 7.237 3.598 1.00 0.00 O ATOM 545 OD2 ASP A 34 12.079 5.853 4.428 1.00 0.00 O ATOM 0 H ASP A 34 13.971 6.196 -0.625 1.00 0.00 H new ATOM 0 HA ASP A 34 14.274 5.854 1.554 1.00 0.00 H new ATOM 0 HB2 ASP A 34 11.822 6.950 1.567 1.00 0.00 H new ATOM 0 HB3 ASP A 34 11.365 5.350 2.116 1.00 0.00 H new ATOM 550 N ILE A 35 14.284 3.274 0.732 1.00 0.00 N ATOM 551 CA ILE A 35 14.419 1.826 0.825 1.00 0.00 C ATOM 552 C ILE A 35 15.328 1.432 1.985 1.00 0.00 C ATOM 553 O ILE A 35 16.254 2.161 2.335 1.00 0.00 O ATOM 554 CB ILE A 35 14.980 1.227 -0.478 1.00 0.00 C ATOM 555 CG1 ILE A 35 13.988 0.225 -1.073 1.00 0.00 C ATOM 556 CG2 ILE A 35 16.323 0.561 -0.220 1.00 0.00 C ATOM 557 CD1 ILE A 35 12.895 0.873 -1.895 1.00 0.00 C ATOM 0 H ILE A 35 14.959 3.722 0.112 1.00 0.00 H new ATOM 0 HA ILE A 35 13.419 1.427 0.997 1.00 0.00 H new ATOM 0 HB ILE A 35 15.128 2.033 -1.196 1.00 0.00 H new ATOM 0 HG12 ILE A 35 14.531 -0.483 -1.699 1.00 0.00 H new ATOM 0 HG13 ILE A 35 13.533 -0.347 -0.265 1.00 0.00 H new ATOM 0 HG21 ILE A 35 16.706 0.143 -1.151 1.00 0.00 H new ATOM 0 HG22 ILE A 35 17.028 1.299 0.163 1.00 0.00 H new ATOM 0 HG23 ILE A 35 16.199 -0.237 0.512 1.00 0.00 H new ATOM 0 HD11 ILE A 35 12.229 0.104 -2.285 1.00 0.00 H new ATOM 0 HD12 ILE A 35 12.327 1.561 -1.268 1.00 0.00 H new ATOM 0 HD13 ILE A 35 13.341 1.422 -2.724 1.00 0.00 H new ATOM 569 N ASN A 36 15.056 0.272 2.575 1.00 0.00 N ATOM 570 CA ASN A 36 15.850 -0.220 3.694 1.00 0.00 C ATOM 571 C ASN A 36 16.280 -1.665 3.463 1.00 0.00 C ATOM 572 O ASN A 36 15.445 -2.553 3.288 1.00 0.00 O ATOM 573 CB ASN A 36 15.053 -0.116 4.997 1.00 0.00 C ATOM 574 CG ASN A 36 15.277 1.205 5.708 1.00 0.00 C ATOM 575 OD1 ASN A 36 14.886 2.262 5.214 1.00 0.00 O ATOM 576 ND2 ASN A 36 15.911 1.149 6.873 1.00 0.00 N ATOM 0 H ASN A 36 14.292 -0.344 2.297 1.00 0.00 H new ATOM 0 HA ASN A 36 16.744 0.399 3.772 1.00 0.00 H new ATOM 0 HB2 ASN A 36 13.991 -0.234 4.781 1.00 0.00 H new ATOM 0 HB3 ASN A 36 15.336 -0.934 5.659 1.00 0.00 H new ATOM 0 HD21 ASN A 36 16.092 2.005 7.397 1.00 0.00 H new ATOM 0 HD22 ASN A 36 16.217 0.250 7.244 1.00 0.00 H new ATOM 583 N VAL A 37 17.590 -1.895 3.463 1.00 0.00 N ATOM 584 CA VAL A 37 18.132 -3.232 3.254 1.00 0.00 C ATOM 585 C VAL A 37 18.566 -3.861 4.574 1.00 0.00 C ATOM 586 O VAL A 37 19.186 -3.206 5.412 1.00 0.00 O ATOM 587 CB VAL A 37 19.332 -3.207 2.290 1.00 0.00 C ATOM 588 CG1 VAL A 37 20.516 -2.498 2.929 1.00 0.00 C ATOM 589 CG2 VAL A 37 19.709 -4.620 1.872 1.00 0.00 C ATOM 0 H VAL A 37 18.295 -1.172 3.606 1.00 0.00 H new ATOM 0 HA VAL A 37 17.335 -3.832 2.814 1.00 0.00 H new ATOM 0 HB VAL A 37 19.046 -2.652 1.396 1.00 0.00 H new ATOM 0 HG11 VAL A 37 21.355 -2.490 2.233 1.00 0.00 H new ATOM 0 HG12 VAL A 37 20.238 -1.473 3.173 1.00 0.00 H new ATOM 0 HG13 VAL A 37 20.806 -3.022 3.840 1.00 0.00 H new ATOM 0 HG21 VAL A 37 20.559 -4.583 1.191 1.00 0.00 H new ATOM 0 HG22 VAL A 37 19.976 -5.201 2.754 1.00 0.00 H new ATOM 0 HG23 VAL A 37 18.862 -5.089 1.371 1.00 0.00 H new ATOM 599 N THR A 38 18.238 -5.136 4.751 1.00 0.00 N ATOM 600 CA THR A 38 18.594 -5.855 5.969 1.00 0.00 C ATOM 601 C THR A 38 19.273 -7.180 5.646 1.00 0.00 C ATOM 602 O THR A 38 18.713 -8.021 4.942 1.00 0.00 O ATOM 603 CB THR A 38 17.355 -6.125 6.844 1.00 0.00 C ATOM 604 OG1 THR A 38 16.289 -6.641 6.038 1.00 0.00 O ATOM 605 CG2 THR A 38 16.898 -4.854 7.543 1.00 0.00 C ATOM 0 H THR A 38 17.726 -5.693 4.067 1.00 0.00 H new ATOM 0 HA THR A 38 19.287 -5.220 6.520 1.00 0.00 H new ATOM 0 HB THR A 38 17.627 -6.860 7.602 1.00 0.00 H new ATOM 0 HG1 THR A 38 16.651 -7.273 5.383 1.00 0.00 H new ATOM 0 HG21 THR A 38 16.022 -5.070 8.155 1.00 0.00 H new ATOM 0 HG22 THR A 38 17.701 -4.479 8.178 1.00 0.00 H new ATOM 0 HG23 THR A 38 16.643 -4.100 6.798 1.00 0.00 H new ATOM 613 N TRP A 39 20.482 -7.362 6.166 1.00 0.00 N ATOM 614 CA TRP A 39 21.238 -8.587 5.933 1.00 0.00 C ATOM 615 C TRP A 39 21.321 -9.425 7.204 1.00 0.00 C ATOM 616 O TRP A 39 21.450 -8.889 8.305 1.00 0.00 O ATOM 617 CB TRP A 39 22.645 -8.256 5.433 1.00 0.00 C ATOM 618 CG TRP A 39 23.401 -7.341 6.349 1.00 0.00 C ATOM 619 CD1 TRP A 39 23.382 -5.976 6.342 1.00 0.00 C ATOM 620 CD2 TRP A 39 24.288 -7.727 7.404 1.00 0.00 C ATOM 621 NE1 TRP A 39 24.204 -5.489 7.329 1.00 0.00 N ATOM 622 CE2 TRP A 39 24.771 -6.543 7.996 1.00 0.00 C ATOM 623 CE3 TRP A 39 24.720 -8.957 7.908 1.00 0.00 C ATOM 624 CZ2 TRP A 39 25.664 -6.556 9.063 1.00 0.00 C ATOM 625 CZ3 TRP A 39 25.607 -8.968 8.967 1.00 0.00 C ATOM 626 CH2 TRP A 39 26.071 -7.774 9.537 1.00 0.00 C ATOM 0 H TRP A 39 20.959 -6.677 6.752 1.00 0.00 H new ATOM 0 HA TRP A 39 20.717 -9.166 5.171 1.00 0.00 H new ATOM 0 HB2 TRP A 39 23.207 -9.182 5.311 1.00 0.00 H new ATOM 0 HB3 TRP A 39 22.574 -7.795 4.448 1.00 0.00 H new ATOM 0 HD1 TRP A 39 22.805 -5.368 5.660 1.00 0.00 H new ATOM 0 HE1 TRP A 39 24.366 -4.503 7.532 1.00 0.00 H new ATOM 0 HE3 TRP A 39 24.367 -9.882 7.477 1.00 0.00 H new ATOM 0 HZ2 TRP A 39 26.024 -5.637 9.502 1.00 0.00 H new ATOM 0 HZ3 TRP A 39 25.949 -9.913 9.363 1.00 0.00 H new ATOM 0 HH2 TRP A 39 26.762 -7.816 10.366 1.00 0.00 H new ATOM 668 N THR A 43 22.429 -13.448 3.700 1.00 0.00 N ATOM 669 CA THR A 43 21.288 -13.160 2.841 1.00 0.00 C ATOM 670 C THR A 43 20.870 -11.698 2.954 1.00 0.00 C ATOM 671 O THR A 43 20.728 -11.166 4.055 1.00 0.00 O ATOM 672 CB THR A 43 20.083 -14.055 3.189 1.00 0.00 C ATOM 673 OG1 THR A 43 20.537 -15.291 3.750 1.00 0.00 O ATOM 674 CG2 THR A 43 19.241 -14.332 1.953 1.00 0.00 C ATOM 0 HA THR A 43 21.602 -13.367 1.818 1.00 0.00 H new ATOM 0 HB THR A 43 19.467 -13.530 3.919 1.00 0.00 H new ATOM 0 HG1 THR A 43 21.422 -15.163 4.152 1.00 0.00 H new ATOM 0 HG21 THR A 43 18.396 -14.966 2.223 1.00 0.00 H new ATOM 0 HG22 THR A 43 18.873 -13.391 1.545 1.00 0.00 H new ATOM 0 HG23 THR A 43 19.850 -14.839 1.204 1.00 0.00 H new ATOM 682 N VAL A 44 20.674 -11.054 1.808 1.00 0.00 N ATOM 683 CA VAL A 44 20.271 -9.653 1.779 1.00 0.00 C ATOM 684 C VAL A 44 18.833 -9.505 1.292 1.00 0.00 C ATOM 685 O VAL A 44 18.441 -10.102 0.289 1.00 0.00 O ATOM 686 CB VAL A 44 21.196 -8.821 0.871 1.00 0.00 C ATOM 687 CG1 VAL A 44 22.534 -8.578 1.552 1.00 0.00 C ATOM 688 CG2 VAL A 44 21.389 -9.513 -0.470 1.00 0.00 C ATOM 0 H VAL A 44 20.788 -11.480 0.888 1.00 0.00 H new ATOM 0 HA VAL A 44 20.347 -9.281 2.801 1.00 0.00 H new ATOM 0 HB VAL A 44 20.726 -7.854 0.691 1.00 0.00 H new ATOM 0 HG11 VAL A 44 23.175 -7.989 0.896 1.00 0.00 H new ATOM 0 HG12 VAL A 44 22.375 -8.037 2.485 1.00 0.00 H new ATOM 0 HG13 VAL A 44 23.013 -9.534 1.764 1.00 0.00 H new ATOM 0 HG21 VAL A 44 22.045 -8.911 -1.099 1.00 0.00 H new ATOM 0 HG22 VAL A 44 21.837 -10.494 -0.312 1.00 0.00 H new ATOM 0 HG23 VAL A 44 20.423 -9.630 -0.961 1.00 0.00 H new ATOM 698 N THR A 45 18.051 -8.705 2.009 1.00 0.00 N ATOM 699 CA THR A 45 16.656 -8.478 1.651 1.00 0.00 C ATOM 700 C THR A 45 16.330 -6.989 1.623 1.00 0.00 C ATOM 701 O THR A 45 16.520 -6.283 2.614 1.00 0.00 O ATOM 702 CB THR A 45 15.703 -9.182 2.634 1.00 0.00 C ATOM 703 OG1 THR A 45 16.136 -10.529 2.858 1.00 0.00 O ATOM 704 CG2 THR A 45 14.278 -9.185 2.099 1.00 0.00 C ATOM 0 H THR A 45 18.360 -8.203 2.842 1.00 0.00 H new ATOM 0 HA THR A 45 16.513 -8.897 0.655 1.00 0.00 H new ATOM 0 HB THR A 45 15.720 -8.634 3.576 1.00 0.00 H new ATOM 0 HG1 THR A 45 15.525 -10.969 3.486 1.00 0.00 H new ATOM 0 HG21 THR A 45 13.623 -9.688 2.811 1.00 0.00 H new ATOM 0 HG22 THR A 45 13.940 -8.158 1.958 1.00 0.00 H new ATOM 0 HG23 THR A 45 14.249 -9.711 1.145 1.00 0.00 H new ATOM 712 N VAL A 46 15.838 -6.517 0.482 1.00 0.00 N ATOM 713 CA VAL A 46 15.484 -5.111 0.326 1.00 0.00 C ATOM 714 C VAL A 46 14.041 -4.858 0.747 1.00 0.00 C ATOM 715 O VAL A 46 13.151 -5.656 0.457 1.00 0.00 O ATOM 716 CB VAL A 46 15.672 -4.643 -1.129 1.00 0.00 C ATOM 717 CG1 VAL A 46 14.624 -5.274 -2.033 1.00 0.00 C ATOM 718 CG2 VAL A 46 15.616 -3.125 -1.212 1.00 0.00 C ATOM 0 H VAL A 46 15.675 -7.087 -0.348 1.00 0.00 H new ATOM 0 HA VAL A 46 16.153 -4.543 0.972 1.00 0.00 H new ATOM 0 HB VAL A 46 16.655 -4.966 -1.472 1.00 0.00 H new ATOM 0 HG11 VAL A 46 14.773 -4.931 -3.057 1.00 0.00 H new ATOM 0 HG12 VAL A 46 14.718 -6.359 -1.996 1.00 0.00 H new ATOM 0 HG13 VAL A 46 13.629 -4.984 -1.694 1.00 0.00 H new ATOM 0 HG21 VAL A 46 15.751 -2.812 -2.247 1.00 0.00 H new ATOM 0 HG22 VAL A 46 14.649 -2.776 -0.850 1.00 0.00 H new ATOM 0 HG23 VAL A 46 16.409 -2.698 -0.598 1.00 0.00 H new ATOM 728 N GLU A 47 13.818 -3.741 1.433 1.00 0.00 N ATOM 729 CA GLU A 47 12.482 -3.383 1.895 1.00 0.00 C ATOM 730 C GLU A 47 12.094 -1.990 1.409 1.00 0.00 C ATOM 731 O GLU A 47 12.721 -0.996 1.775 1.00 0.00 O ATOM 732 CB GLU A 47 12.413 -3.441 3.422 1.00 0.00 C ATOM 733 CG GLU A 47 11.623 -4.626 3.952 1.00 0.00 C ATOM 734 CD GLU A 47 10.837 -4.290 5.205 1.00 0.00 C ATOM 735 OE1 GLU A 47 9.977 -3.387 5.140 1.00 0.00 O ATOM 736 OE2 GLU A 47 11.083 -4.930 6.249 1.00 0.00 O ATOM 0 H GLU A 47 14.544 -3.069 1.681 1.00 0.00 H new ATOM 0 HA GLU A 47 11.777 -4.103 1.480 1.00 0.00 H new ATOM 0 HB2 GLU A 47 13.426 -3.483 3.822 1.00 0.00 H new ATOM 0 HB3 GLU A 47 11.962 -2.520 3.792 1.00 0.00 H new ATOM 0 HG2 GLU A 47 10.937 -4.975 3.180 1.00 0.00 H new ATOM 0 HG3 GLU A 47 12.307 -5.447 4.166 1.00 0.00 H new ATOM 743 N GLY A 48 11.054 -1.925 0.582 1.00 0.00 N ATOM 744 CA GLY A 48 10.600 -0.650 0.059 1.00 0.00 C ATOM 745 C GLY A 48 9.111 -0.442 0.251 1.00 0.00 C ATOM 746 O GLY A 48 8.336 -1.397 0.221 1.00 0.00 O ATOM 0 H GLY A 48 10.518 -2.733 0.265 1.00 0.00 H new ATOM 0 HA2 GLY A 48 11.143 0.156 0.553 1.00 0.00 H new ATOM 0 HA3 GLY A 48 10.838 -0.591 -1.003 1.00 0.00 H new ATOM 750 N GLN A 49 8.711 0.810 0.451 1.00 0.00 N ATOM 751 CA GLN A 49 7.305 1.140 0.651 1.00 0.00 C ATOM 752 C GLN A 49 6.861 2.237 -0.310 1.00 0.00 C ATOM 753 O GLN A 49 7.605 3.183 -0.575 1.00 0.00 O ATOM 754 CB GLN A 49 7.064 1.581 2.095 1.00 0.00 C ATOM 755 CG GLN A 49 7.700 2.919 2.437 1.00 0.00 C ATOM 756 CD GLN A 49 9.211 2.842 2.522 1.00 0.00 C ATOM 757 OE1 GLN A 49 9.887 3.262 1.459 1.00 0.00 O flip ATOM 758 NE2 GLN A 49 9.766 2.409 3.533 1.00 0.00 N flip ATOM 0 H GLN A 49 9.341 1.612 0.479 1.00 0.00 H new ATOM 0 HA GLN A 49 6.715 0.246 0.449 1.00 0.00 H new ATOM 0 HB2 GLN A 49 5.990 1.642 2.273 1.00 0.00 H new ATOM 0 HB3 GLN A 49 7.456 0.819 2.769 1.00 0.00 H new ATOM 0 HG2 GLN A 49 7.419 3.654 1.682 1.00 0.00 H new ATOM 0 HG3 GLN A 49 7.304 3.272 3.389 1.00 0.00 H new ATOM 0 HE21 GLN A 49 9.207 2.097 4.327 1.00 0.00 H new ATOM 0 HE22 GLN A 49 10.784 2.363 3.576 1.00 0.00 H new ATOM 767 N LEU A 50 5.645 2.106 -0.829 1.00 0.00 N ATOM 768 CA LEU A 50 5.102 3.087 -1.762 1.00 0.00 C ATOM 769 C LEU A 50 4.080 3.986 -1.072 1.00 0.00 C ATOM 770 O LEU A 50 3.275 3.521 -0.266 1.00 0.00 O ATOM 771 CB LEU A 50 4.455 2.382 -2.955 1.00 0.00 C ATOM 772 CG LEU A 50 4.757 2.977 -4.331 1.00 0.00 C ATOM 773 CD1 LEU A 50 3.885 2.329 -5.396 1.00 0.00 C ATOM 774 CD2 LEU A 50 4.552 4.485 -4.316 1.00 0.00 C ATOM 0 H LEU A 50 5.017 1.330 -0.620 1.00 0.00 H new ATOM 0 HA LEU A 50 5.924 3.708 -2.118 1.00 0.00 H new ATOM 0 HB2 LEU A 50 4.776 1.340 -2.953 1.00 0.00 H new ATOM 0 HB3 LEU A 50 3.375 2.383 -2.810 1.00 0.00 H new ATOM 0 HG LEU A 50 5.800 2.774 -4.573 1.00 0.00 H new ATOM 0 HD11 LEU A 50 4.114 2.765 -6.368 1.00 0.00 H new ATOM 0 HD12 LEU A 50 4.081 1.257 -5.424 1.00 0.00 H new ATOM 0 HD13 LEU A 50 2.835 2.500 -5.160 1.00 0.00 H new ATOM 0 HD21 LEU A 50 4.771 4.892 -5.303 1.00 0.00 H new ATOM 0 HD22 LEU A 50 3.518 4.709 -4.053 1.00 0.00 H new ATOM 0 HD23 LEU A 50 5.219 4.936 -3.581 1.00 0.00 H new ATOM 910 N ARG B 3 24.719 -19.346 -9.823 1.00 0.00 N ATOM 911 CA ARG B 3 23.261 -19.333 -9.813 1.00 0.00 C ATOM 912 C ARG B 3 22.734 -18.123 -9.047 1.00 0.00 C ATOM 913 O ARG B 3 23.280 -17.745 -8.010 1.00 0.00 O ATOM 914 CB ARG B 3 22.722 -20.620 -9.188 1.00 0.00 C ATOM 915 CG ARG B 3 21.459 -21.139 -9.856 1.00 0.00 C ATOM 916 CD ARG B 3 20.252 -20.283 -9.507 1.00 0.00 C ATOM 917 NE ARG B 3 19.154 -21.079 -8.964 1.00 0.00 N ATOM 918 CZ ARG B 3 19.089 -21.474 -7.698 1.00 0.00 C ATOM 919 NH1 ARG B 3 20.053 -21.148 -6.848 1.00 0.00 N ATOM 920 NH2 ARG B 3 18.058 -22.196 -7.279 1.00 0.00 N ATOM 0 HA ARG B 3 22.916 -19.267 -10.845 1.00 0.00 H new ATOM 0 HB2 ARG B 3 23.492 -21.389 -9.239 1.00 0.00 H new ATOM 0 HB3 ARG B 3 22.518 -20.443 -8.132 1.00 0.00 H new ATOM 0 HG2 ARG B 3 21.597 -21.152 -10.937 1.00 0.00 H new ATOM 0 HG3 ARG B 3 21.279 -22.168 -9.546 1.00 0.00 H new ATOM 0 HD2 ARG B 3 20.544 -19.525 -8.780 1.00 0.00 H new ATOM 0 HD3 ARG B 3 19.911 -19.756 -10.398 1.00 0.00 H new ATOM 0 HE ARG B 3 18.396 -21.346 -9.592 1.00 0.00 H new ATOM 0 HH11 ARG B 3 20.847 -20.592 -7.166 1.00 0.00 H new ATOM 0 HH12 ARG B 3 20.000 -21.453 -5.876 1.00 0.00 H new ATOM 0 HH21 ARG B 3 17.314 -22.448 -7.930 1.00 0.00 H new ATOM 0 HH22 ARG B 3 18.009 -22.499 -6.306 1.00 0.00 H new ATOM 934 N VAL B 4 21.669 -17.519 -9.565 1.00 0.00 N ATOM 935 CA VAL B 4 21.067 -16.352 -8.930 1.00 0.00 C ATOM 936 C VAL B 4 19.554 -16.504 -8.823 1.00 0.00 C ATOM 937 O VAL B 4 18.871 -16.736 -9.821 1.00 0.00 O ATOM 938 CB VAL B 4 21.389 -15.062 -9.706 1.00 0.00 C ATOM 939 CG1 VAL B 4 20.768 -13.856 -9.019 1.00 0.00 C ATOM 940 CG2 VAL B 4 22.894 -14.888 -9.849 1.00 0.00 C ATOM 0 H VAL B 4 21.205 -17.818 -10.423 1.00 0.00 H new ATOM 0 HA VAL B 4 21.494 -16.281 -7.929 1.00 0.00 H new ATOM 0 HB VAL B 4 20.959 -15.143 -10.704 1.00 0.00 H new ATOM 0 HG11 VAL B 4 21.007 -12.954 -9.582 1.00 0.00 H new ATOM 0 HG12 VAL B 4 19.686 -13.980 -8.974 1.00 0.00 H new ATOM 0 HG13 VAL B 4 21.166 -13.768 -8.008 1.00 0.00 H new ATOM 0 HG21 VAL B 4 23.104 -13.971 -10.400 1.00 0.00 H new ATOM 0 HG22 VAL B 4 23.349 -14.829 -8.860 1.00 0.00 H new ATOM 0 HG23 VAL B 4 23.309 -15.739 -10.389 1.00 0.00 H new ATOM 950 N ARG B 5 19.036 -16.371 -7.606 1.00 0.00 N ATOM 951 CA ARG B 5 17.603 -16.494 -7.369 1.00 0.00 C ATOM 952 C ARG B 5 17.085 -15.316 -6.549 1.00 0.00 C ATOM 953 O ARG B 5 17.626 -14.999 -5.489 1.00 0.00 O ATOM 954 CB ARG B 5 17.295 -17.806 -6.646 1.00 0.00 C ATOM 955 CG ARG B 5 15.849 -17.929 -6.195 1.00 0.00 C ATOM 956 CD ARG B 5 15.745 -18.050 -4.682 1.00 0.00 C ATOM 957 NE ARG B 5 16.555 -19.150 -4.165 1.00 0.00 N ATOM 958 CZ ARG B 5 16.514 -19.563 -2.904 1.00 0.00 C ATOM 959 NH1 ARG B 5 15.706 -18.971 -2.035 1.00 0.00 N ATOM 960 NH2 ARG B 5 17.281 -20.571 -2.509 1.00 0.00 N ATOM 0 H ARG B 5 19.587 -16.178 -6.770 1.00 0.00 H new ATOM 0 HA ARG B 5 17.099 -16.492 -8.335 1.00 0.00 H new ATOM 0 HB2 ARG B 5 17.532 -18.639 -7.307 1.00 0.00 H new ATOM 0 HB3 ARG B 5 17.946 -17.893 -5.776 1.00 0.00 H new ATOM 0 HG2 ARG B 5 15.287 -17.058 -6.531 1.00 0.00 H new ATOM 0 HG3 ARG B 5 15.394 -18.802 -6.663 1.00 0.00 H new ATOM 0 HD2 ARG B 5 16.065 -17.116 -4.221 1.00 0.00 H new ATOM 0 HD3 ARG B 5 14.703 -18.204 -4.401 1.00 0.00 H new ATOM 0 HE ARG B 5 17.187 -19.627 -4.808 1.00 0.00 H new ATOM 0 HH11 ARG B 5 15.114 -18.196 -2.335 1.00 0.00 H new ATOM 0 HH12 ARG B 5 15.676 -19.290 -1.067 1.00 0.00 H new ATOM 0 HH21 ARG B 5 17.903 -21.030 -3.175 1.00 0.00 H new ATOM 0 HH22 ARG B 5 17.248 -20.887 -1.540 1.00 0.00 H new ATOM 974 N ILE B 6 16.035 -14.672 -7.046 1.00 0.00 N ATOM 975 CA ILE B 6 15.444 -13.530 -6.360 1.00 0.00 C ATOM 976 C ILE B 6 13.953 -13.743 -6.120 1.00 0.00 C ATOM 977 O ILE B 6 13.197 -14.017 -7.052 1.00 0.00 O ATOM 978 CB ILE B 6 15.643 -12.228 -7.158 1.00 0.00 C ATOM 979 CG1 ILE B 6 17.126 -12.013 -7.464 1.00 0.00 C ATOM 980 CG2 ILE B 6 15.077 -11.043 -6.390 1.00 0.00 C ATOM 981 CD1 ILE B 6 17.401 -10.769 -8.280 1.00 0.00 C ATOM 0 H ILE B 6 15.576 -14.922 -7.922 1.00 0.00 H new ATOM 0 HA ILE B 6 15.955 -13.440 -5.401 1.00 0.00 H new ATOM 0 HB ILE B 6 15.105 -12.313 -8.102 1.00 0.00 H new ATOM 0 HG12 ILE B 6 17.677 -11.951 -6.526 1.00 0.00 H new ATOM 0 HG13 ILE B 6 17.507 -12.882 -8.001 1.00 0.00 H new ATOM 0 HG21 ILE B 6 15.226 -10.131 -6.968 1.00 0.00 H new ATOM 0 HG22 ILE B 6 14.011 -11.195 -6.220 1.00 0.00 H new ATOM 0 HG23 ILE B 6 15.588 -10.953 -5.431 1.00 0.00 H new ATOM 0 HD11 ILE B 6 18.473 -10.681 -8.459 1.00 0.00 H new ATOM 0 HD12 ILE B 6 16.878 -10.837 -9.234 1.00 0.00 H new ATOM 0 HD13 ILE B 6 17.051 -9.892 -7.736 1.00 0.00 H new ATOM 993 N SER B 7 13.537 -13.615 -4.864 1.00 0.00 N ATOM 994 CA SER B 7 12.136 -13.796 -4.501 1.00 0.00 C ATOM 995 C SER B 7 11.522 -12.480 -4.034 1.00 0.00 C ATOM 996 O SER B 7 12.124 -11.745 -3.251 1.00 0.00 O ATOM 997 CB SER B 7 12.004 -14.852 -3.402 1.00 0.00 C ATOM 998 OG SER B 7 13.277 -15.253 -2.925 1.00 0.00 O ATOM 0 H SER B 7 14.150 -13.387 -4.081 1.00 0.00 H new ATOM 0 HA SER B 7 11.598 -14.134 -5.386 1.00 0.00 H new ATOM 0 HB2 SER B 7 11.413 -14.452 -2.578 1.00 0.00 H new ATOM 0 HB3 SER B 7 11.467 -15.718 -3.788 1.00 0.00 H new ATOM 0 HG SER B 7 13.166 -15.927 -2.222 1.00 0.00 H new ATOM 1004 N ILE B 8 10.319 -12.190 -4.519 1.00 0.00 N ATOM 1005 CA ILE B 8 9.622 -10.964 -4.151 1.00 0.00 C ATOM 1006 C ILE B 8 8.409 -11.263 -3.277 1.00 0.00 C ATOM 1007 O ILE B 8 7.636 -12.179 -3.560 1.00 0.00 O ATOM 1008 CB ILE B 8 9.164 -10.181 -5.395 1.00 0.00 C ATOM 1009 CG1 ILE B 8 10.357 -9.890 -6.309 1.00 0.00 C ATOM 1010 CG2 ILE B 8 8.476 -8.888 -4.984 1.00 0.00 C ATOM 1011 CD1 ILE B 8 9.970 -9.664 -7.754 1.00 0.00 C ATOM 0 H ILE B 8 9.807 -12.788 -5.168 1.00 0.00 H new ATOM 0 HA ILE B 8 10.330 -10.355 -3.590 1.00 0.00 H new ATOM 0 HB ILE B 8 8.448 -10.790 -5.947 1.00 0.00 H new ATOM 0 HG12 ILE B 8 10.881 -9.009 -5.939 1.00 0.00 H new ATOM 0 HG13 ILE B 8 11.058 -10.723 -6.255 1.00 0.00 H new ATOM 0 HG21 ILE B 8 8.158 -8.346 -5.875 1.00 0.00 H new ATOM 0 HG22 ILE B 8 7.606 -9.118 -4.370 1.00 0.00 H new ATOM 0 HG23 ILE B 8 9.171 -8.272 -4.413 1.00 0.00 H new ATOM 0 HD11 ILE B 8 10.865 -9.463 -8.343 1.00 0.00 H new ATOM 0 HD12 ILE B 8 9.473 -10.553 -8.141 1.00 0.00 H new ATOM 0 HD13 ILE B 8 9.293 -8.812 -7.820 1.00 0.00 H new ATOM 1023 N THR B 9 8.246 -10.483 -2.213 1.00 0.00 N ATOM 1024 CA THR B 9 7.127 -10.662 -1.297 1.00 0.00 C ATOM 1025 C THR B 9 6.031 -9.635 -1.559 1.00 0.00 C ATOM 1026 O THR B 9 5.853 -8.694 -0.788 1.00 0.00 O ATOM 1027 CB THR B 9 7.578 -10.551 0.171 1.00 0.00 C ATOM 1028 OG1 THR B 9 8.912 -11.052 0.313 1.00 0.00 O ATOM 1029 CG2 THR B 9 6.641 -11.324 1.086 1.00 0.00 C ATOM 0 H THR B 9 8.876 -9.720 -1.964 1.00 0.00 H new ATOM 0 HA THR B 9 6.733 -11.663 -1.473 1.00 0.00 H new ATOM 0 HB THR B 9 7.553 -9.499 0.457 1.00 0.00 H new ATOM 0 HG1 THR B 9 9.547 -10.400 -0.050 1.00 0.00 H new ATOM 0 HG21 THR B 9 6.981 -11.230 2.118 1.00 0.00 H new ATOM 0 HG22 THR B 9 5.632 -10.921 0.998 1.00 0.00 H new ATOM 0 HG23 THR B 9 6.638 -12.376 0.799 1.00 0.00 H new ATOM 1037 N ALA B 10 5.300 -9.823 -2.653 1.00 0.00 N ATOM 1038 CA ALA B 10 4.220 -8.914 -3.015 1.00 0.00 C ATOM 1039 C ALA B 10 2.863 -9.494 -2.632 1.00 0.00 C ATOM 1040 O ALA B 10 2.675 -10.710 -2.632 1.00 0.00 O ATOM 1041 CB ALA B 10 4.264 -8.609 -4.505 1.00 0.00 C ATOM 0 H ALA B 10 5.436 -10.597 -3.304 1.00 0.00 H new ATOM 0 HA ALA B 10 4.359 -7.986 -2.461 1.00 0.00 H new ATOM 0 HB1 ALA B 10 3.452 -7.929 -4.761 1.00 0.00 H new ATOM 0 HB2 ALA B 10 5.218 -8.144 -4.753 1.00 0.00 H new ATOM 0 HB3 ALA B 10 4.154 -9.535 -5.069 1.00 0.00 H new ATOM 1047 N ARG B 11 1.920 -8.615 -2.306 1.00 0.00 N ATOM 1048 CA ARG B 11 0.580 -9.041 -1.919 1.00 0.00 C ATOM 1049 C ARG B 11 -0.245 -9.422 -3.145 1.00 0.00 C ATOM 1050 O ARG B 11 -0.980 -10.410 -3.130 1.00 0.00 O ATOM 1051 CB ARG B 11 -0.126 -7.929 -1.141 1.00 0.00 C ATOM 1052 CG ARG B 11 -0.266 -6.633 -1.923 1.00 0.00 C ATOM 1053 CD ARG B 11 -0.828 -5.517 -1.056 1.00 0.00 C ATOM 1054 NE ARG B 11 -2.268 -5.653 -0.855 1.00 0.00 N ATOM 1055 CZ ARG B 11 -3.034 -4.691 -0.354 1.00 0.00 C ATOM 1056 NH1 ARG B 11 -2.501 -3.528 -0.005 1.00 0.00 N ATOM 1057 NH2 ARG B 11 -4.337 -4.890 -0.201 1.00 0.00 N ATOM 0 H ARG B 11 2.059 -7.605 -2.302 1.00 0.00 H new ATOM 0 HA ARG B 11 0.675 -9.919 -1.280 1.00 0.00 H new ATOM 0 HB2 ARG B 11 -1.117 -8.275 -0.848 1.00 0.00 H new ATOM 0 HB3 ARG B 11 0.427 -7.732 -0.223 1.00 0.00 H new ATOM 0 HG2 ARG B 11 0.707 -6.336 -2.315 1.00 0.00 H new ATOM 0 HG3 ARG B 11 -0.919 -6.793 -2.781 1.00 0.00 H new ATOM 0 HD2 ARG B 11 -0.325 -5.521 -0.089 1.00 0.00 H new ATOM 0 HD3 ARG B 11 -0.616 -4.554 -1.522 1.00 0.00 H new ATOM 0 HE ARG B 11 -2.710 -6.535 -1.114 1.00 0.00 H new ATOM 0 HH11 ARG B 11 -1.500 -3.370 -0.121 1.00 0.00 H new ATOM 0 HH12 ARG B 11 -3.092 -2.791 0.380 1.00 0.00 H new ATOM 0 HH21 ARG B 11 -4.751 -5.783 -0.468 1.00 0.00 H new ATOM 0 HH22 ARG B 11 -4.924 -4.150 0.184 1.00 0.00 H new ATOM 1071 N THR B 12 -0.118 -8.631 -4.206 1.00 0.00 N ATOM 1072 CA THR B 12 -0.852 -8.884 -5.440 1.00 0.00 C ATOM 1073 C THR B 12 0.094 -9.239 -6.580 1.00 0.00 C ATOM 1074 O THR B 12 1.231 -8.768 -6.627 1.00 0.00 O ATOM 1075 CB THR B 12 -1.697 -7.663 -5.851 1.00 0.00 C ATOM 1076 OG1 THR B 12 -2.121 -7.796 -7.212 1.00 0.00 O ATOM 1077 CG2 THR B 12 -0.904 -6.375 -5.686 1.00 0.00 C ATOM 0 H THR B 12 0.486 -7.810 -4.235 1.00 0.00 H new ATOM 0 HA THR B 12 -1.515 -9.727 -5.246 1.00 0.00 H new ATOM 0 HB THR B 12 -2.571 -7.619 -5.201 1.00 0.00 H new ATOM 0 HG1 THR B 12 -2.659 -7.017 -7.465 1.00 0.00 H new ATOM 0 HG21 THR B 12 -1.521 -5.527 -5.982 1.00 0.00 H new ATOM 0 HG22 THR B 12 -0.608 -6.261 -4.643 1.00 0.00 H new ATOM 0 HG23 THR B 12 -0.014 -6.413 -6.314 1.00 0.00 H new ATOM 1085 N LYS B 13 -0.381 -10.073 -7.499 1.00 0.00 N ATOM 1086 CA LYS B 13 0.422 -10.491 -8.642 1.00 0.00 C ATOM 1087 C LYS B 13 0.801 -9.294 -9.508 1.00 0.00 C ATOM 1088 O LYS B 13 1.831 -9.303 -10.182 1.00 0.00 O ATOM 1089 CB LYS B 13 -0.342 -11.519 -9.480 1.00 0.00 C ATOM 1090 CG LYS B 13 -1.711 -11.040 -9.931 1.00 0.00 C ATOM 1091 CD LYS B 13 -2.645 -12.204 -10.212 1.00 0.00 C ATOM 1092 CE LYS B 13 -3.911 -12.118 -9.375 1.00 0.00 C ATOM 1093 NZ LYS B 13 -4.391 -13.464 -8.955 1.00 0.00 N ATOM 0 H LYS B 13 -1.319 -10.473 -7.474 1.00 0.00 H new ATOM 0 HA LYS B 13 1.337 -10.947 -8.264 1.00 0.00 H new ATOM 0 HB2 LYS B 13 0.252 -11.773 -10.358 1.00 0.00 H new ATOM 0 HB3 LYS B 13 -0.460 -12.434 -8.899 1.00 0.00 H new ATOM 0 HG2 LYS B 13 -2.145 -10.401 -9.162 1.00 0.00 H new ATOM 0 HG3 LYS B 13 -1.607 -10.431 -10.829 1.00 0.00 H new ATOM 0 HD2 LYS B 13 -2.907 -12.214 -11.270 1.00 0.00 H new ATOM 0 HD3 LYS B 13 -2.132 -13.142 -10.002 1.00 0.00 H new ATOM 0 HE2 LYS B 13 -3.722 -11.508 -8.492 1.00 0.00 H new ATOM 0 HE3 LYS B 13 -4.691 -11.616 -9.947 1.00 0.00 H new ATOM 0 HZ1 LYS B 13 -5.256 -13.362 -8.386 1.00 0.00 H new ATOM 0 HZ2 LYS B 13 -4.596 -14.038 -9.798 1.00 0.00 H new ATOM 0 HZ3 LYS B 13 -3.657 -13.933 -8.387 1.00 0.00 H new ATOM 1107 N LYS B 14 -0.039 -8.264 -9.486 1.00 0.00 N ATOM 1108 CA LYS B 14 0.208 -7.058 -10.266 1.00 0.00 C ATOM 1109 C LYS B 14 1.536 -6.418 -9.874 1.00 0.00 C ATOM 1110 O LYS B 14 2.308 -5.994 -10.733 1.00 0.00 O ATOM 1111 CB LYS B 14 -0.931 -6.055 -10.068 1.00 0.00 C ATOM 1112 CG LYS B 14 -2.206 -6.430 -10.804 1.00 0.00 C ATOM 1113 CD LYS B 14 -2.054 -6.258 -12.306 1.00 0.00 C ATOM 1114 CE LYS B 14 -1.857 -7.596 -13.003 1.00 0.00 C ATOM 1115 NZ LYS B 14 -1.189 -7.440 -14.325 1.00 0.00 N ATOM 0 H LYS B 14 -0.897 -8.241 -8.936 1.00 0.00 H new ATOM 0 HA LYS B 14 0.257 -7.340 -11.318 1.00 0.00 H new ATOM 0 HB2 LYS B 14 -1.148 -5.970 -9.003 1.00 0.00 H new ATOM 0 HB3 LYS B 14 -0.602 -5.072 -10.406 1.00 0.00 H new ATOM 0 HG2 LYS B 14 -2.466 -7.465 -10.580 1.00 0.00 H new ATOM 0 HG3 LYS B 14 -3.029 -5.810 -10.447 1.00 0.00 H new ATOM 0 HD2 LYS B 14 -2.938 -5.764 -12.708 1.00 0.00 H new ATOM 0 HD3 LYS B 14 -1.204 -5.609 -12.515 1.00 0.00 H new ATOM 0 HE2 LYS B 14 -1.259 -8.251 -12.369 1.00 0.00 H new ATOM 0 HE3 LYS B 14 -2.824 -8.080 -13.140 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 -1.849 -7.711 -15.082 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 -0.902 -6.449 -14.454 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 -0.349 -8.051 -14.364 1.00 0.00 H new ATOM 1129 N GLU B 15 1.796 -6.355 -8.572 1.00 0.00 N ATOM 1130 CA GLU B 15 3.031 -5.768 -8.067 1.00 0.00 C ATOM 1131 C GLU B 15 4.237 -6.617 -8.460 1.00 0.00 C ATOM 1132 O GLU B 15 5.208 -6.112 -9.022 1.00 0.00 O ATOM 1133 CB GLU B 15 2.969 -5.623 -6.545 1.00 0.00 C ATOM 1134 CG GLU B 15 2.439 -4.276 -6.083 1.00 0.00 C ATOM 1135 CD GLU B 15 3.507 -3.200 -6.077 1.00 0.00 C ATOM 1136 OE1 GLU B 15 3.991 -2.838 -7.170 1.00 0.00 O ATOM 1137 OE2 GLU B 15 3.859 -2.719 -4.979 1.00 0.00 O ATOM 0 H GLU B 15 1.168 -6.703 -7.848 1.00 0.00 H new ATOM 0 HA GLU B 15 3.143 -4.780 -8.514 1.00 0.00 H new ATOM 0 HB2 GLU B 15 2.336 -6.412 -6.139 1.00 0.00 H new ATOM 0 HB3 GLU B 15 3.967 -5.772 -6.133 1.00 0.00 H new ATOM 0 HG2 GLU B 15 1.622 -3.968 -6.735 1.00 0.00 H new ATOM 0 HG3 GLU B 15 2.025 -4.377 -5.080 1.00 0.00 H new ATOM 1144 N ALA B 16 4.167 -7.909 -8.158 1.00 0.00 N ATOM 1145 CA ALA B 16 5.251 -8.829 -8.480 1.00 0.00 C ATOM 1146 C ALA B 16 5.526 -8.850 -9.980 1.00 0.00 C ATOM 1147 O ALA B 16 6.678 -8.911 -10.407 1.00 0.00 O ATOM 1148 CB ALA B 16 4.920 -10.228 -7.983 1.00 0.00 C ATOM 0 H ALA B 16 3.371 -8.343 -7.691 1.00 0.00 H new ATOM 0 HA ALA B 16 6.153 -8.480 -7.977 1.00 0.00 H new ATOM 0 HB1 ALA B 16 5.738 -10.905 -8.230 1.00 0.00 H new ATOM 0 HB2 ALA B 16 4.781 -10.207 -6.902 1.00 0.00 H new ATOM 0 HB3 ALA B 16 4.004 -10.576 -8.460 1.00 0.00 H new ATOM 1154 N GLU B 17 4.460 -8.799 -10.773 1.00 0.00 N ATOM 1155 CA GLU B 17 4.589 -8.814 -12.226 1.00 0.00 C ATOM 1156 C GLU B 17 5.443 -7.644 -12.708 1.00 0.00 C ATOM 1157 O GLU B 17 6.332 -7.813 -13.542 1.00 0.00 O ATOM 1158 CB GLU B 17 3.208 -8.757 -12.883 1.00 0.00 C ATOM 1159 CG GLU B 17 2.598 -10.125 -13.137 1.00 0.00 C ATOM 1160 CD GLU B 17 1.607 -10.118 -14.285 1.00 0.00 C ATOM 1161 OE1 GLU B 17 1.158 -9.019 -14.672 1.00 0.00 O ATOM 1162 OE2 GLU B 17 1.282 -11.210 -14.795 1.00 0.00 O ATOM 0 H GLU B 17 3.499 -8.747 -10.435 1.00 0.00 H new ATOM 0 HA GLU B 17 5.082 -9.743 -12.513 1.00 0.00 H new ATOM 0 HB2 GLU B 17 2.536 -8.181 -12.247 1.00 0.00 H new ATOM 0 HB3 GLU B 17 3.287 -8.222 -13.830 1.00 0.00 H new ATOM 0 HG2 GLU B 17 3.393 -10.839 -13.353 1.00 0.00 H new ATOM 0 HG3 GLU B 17 2.097 -10.469 -12.232 1.00 0.00 H new ATOM 1169 N LYS B 18 5.164 -6.458 -12.178 1.00 0.00 N ATOM 1170 CA LYS B 18 5.905 -5.259 -12.552 1.00 0.00 C ATOM 1171 C LYS B 18 7.386 -5.408 -12.217 1.00 0.00 C ATOM 1172 O LYS B 18 8.251 -4.963 -12.971 1.00 0.00 O ATOM 1173 CB LYS B 18 5.330 -4.035 -11.837 1.00 0.00 C ATOM 1174 CG LYS B 18 3.881 -3.749 -12.190 1.00 0.00 C ATOM 1175 CD LYS B 18 3.770 -2.887 -13.436 1.00 0.00 C ATOM 1176 CE LYS B 18 2.753 -3.452 -14.416 1.00 0.00 C ATOM 1177 NZ LYS B 18 3.409 -4.068 -15.603 1.00 0.00 N ATOM 0 H LYS B 18 4.430 -6.301 -11.488 1.00 0.00 H new ATOM 0 HA LYS B 18 5.806 -5.122 -13.629 1.00 0.00 H new ATOM 0 HB2 LYS B 18 5.410 -4.183 -10.760 1.00 0.00 H new ATOM 0 HB3 LYS B 18 5.935 -3.163 -12.085 1.00 0.00 H new ATOM 0 HG2 LYS B 18 3.352 -4.689 -12.348 1.00 0.00 H new ATOM 0 HG3 LYS B 18 3.394 -3.246 -11.354 1.00 0.00 H new ATOM 0 HD2 LYS B 18 3.482 -1.874 -13.155 1.00 0.00 H new ATOM 0 HD3 LYS B 18 4.744 -2.818 -13.920 1.00 0.00 H new ATOM 0 HE2 LYS B 18 2.139 -4.199 -13.912 1.00 0.00 H new ATOM 0 HE3 LYS B 18 2.083 -2.657 -14.743 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 2.682 -4.441 -16.247 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 3.975 -3.350 -16.099 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 4.029 -4.844 -15.294 1.00 0.00 H new ATOM 1191 N PHE B 19 7.670 -6.039 -11.082 1.00 0.00 N ATOM 1192 CA PHE B 19 9.047 -6.247 -10.648 1.00 0.00 C ATOM 1193 C PHE B 19 9.742 -7.287 -11.521 1.00 0.00 C ATOM 1194 O PHE B 19 10.876 -7.090 -11.956 1.00 0.00 O ATOM 1195 CB PHE B 19 9.080 -6.689 -9.183 1.00 0.00 C ATOM 1196 CG PHE B 19 8.811 -5.574 -8.214 1.00 0.00 C ATOM 1197 CD1 PHE B 19 9.711 -4.530 -8.071 1.00 0.00 C ATOM 1198 CD2 PHE B 19 7.658 -5.569 -7.446 1.00 0.00 C ATOM 1199 CE1 PHE B 19 9.466 -3.503 -7.179 1.00 0.00 C ATOM 1200 CE2 PHE B 19 7.407 -4.545 -6.553 1.00 0.00 C ATOM 1201 CZ PHE B 19 8.312 -3.510 -6.420 1.00 0.00 C ATOM 0 H PHE B 19 6.966 -6.415 -10.447 1.00 0.00 H new ATOM 0 HA PHE B 19 9.580 -5.301 -10.748 1.00 0.00 H new ATOM 0 HB2 PHE B 19 8.341 -7.476 -9.033 1.00 0.00 H new ATOM 0 HB3 PHE B 19 10.056 -7.122 -8.964 1.00 0.00 H new ATOM 0 HD1 PHE B 19 10.614 -4.519 -8.663 1.00 0.00 H new ATOM 0 HD2 PHE B 19 6.947 -6.375 -7.547 1.00 0.00 H new ATOM 0 HE1 PHE B 19 10.176 -2.696 -7.076 1.00 0.00 H new ATOM 0 HE2 PHE B 19 6.505 -4.554 -5.960 1.00 0.00 H new ATOM 0 HZ PHE B 19 8.118 -2.708 -5.724 1.00 0.00 H new ATOM 1211 N ALA B 20 9.052 -8.395 -11.773 1.00 0.00 N ATOM 1212 CA ALA B 20 9.601 -9.466 -12.595 1.00 0.00 C ATOM 1213 C ALA B 20 10.019 -8.947 -13.966 1.00 0.00 C ATOM 1214 O ALA B 20 11.089 -9.288 -14.470 1.00 0.00 O ATOM 1215 CB ALA B 20 8.588 -10.591 -12.741 1.00 0.00 C ATOM 0 H ALA B 20 8.112 -8.574 -11.420 1.00 0.00 H new ATOM 0 HA ALA B 20 10.489 -9.854 -12.096 1.00 0.00 H new ATOM 0 HB1 ALA B 20 9.011 -11.384 -13.357 1.00 0.00 H new ATOM 0 HB2 ALA B 20 8.342 -10.989 -11.757 1.00 0.00 H new ATOM 0 HB3 ALA B 20 7.684 -10.207 -13.214 1.00 0.00 H new ATOM 1221 N ALA B 21 9.168 -8.120 -14.565 1.00 0.00 N ATOM 1222 CA ALA B 21 9.451 -7.553 -15.878 1.00 0.00 C ATOM 1223 C ALA B 21 10.831 -6.906 -15.911 1.00 0.00 C ATOM 1224 O ALA B 21 11.614 -7.138 -16.833 1.00 0.00 O ATOM 1225 CB ALA B 21 8.382 -6.538 -16.255 1.00 0.00 C ATOM 0 H ALA B 21 8.278 -7.828 -14.162 1.00 0.00 H new ATOM 0 HA ALA B 21 9.441 -8.364 -16.606 1.00 0.00 H new ATOM 0 HB1 ALA B 21 8.605 -6.122 -17.238 1.00 0.00 H new ATOM 0 HB2 ALA B 21 7.408 -7.028 -16.281 1.00 0.00 H new ATOM 0 HB3 ALA B 21 8.365 -5.736 -15.517 1.00 0.00 H new ATOM 1231 N ILE B 22 11.124 -6.095 -14.900 1.00 0.00 N ATOM 1232 CA ILE B 22 12.411 -5.416 -14.814 1.00 0.00 C ATOM 1233 C ILE B 22 13.541 -6.408 -14.561 1.00 0.00 C ATOM 1234 O ILE B 22 14.576 -6.369 -15.227 1.00 0.00 O ATOM 1235 CB ILE B 22 12.414 -4.355 -13.697 1.00 0.00 C ATOM 1236 CG1 ILE B 22 11.304 -3.330 -13.934 1.00 0.00 C ATOM 1237 CG2 ILE B 22 13.770 -3.668 -13.623 1.00 0.00 C ATOM 1238 CD1 ILE B 22 10.601 -2.897 -12.666 1.00 0.00 C ATOM 0 H ILE B 22 10.488 -5.892 -14.129 1.00 0.00 H new ATOM 0 HA ILE B 22 12.572 -4.923 -15.773 1.00 0.00 H new ATOM 0 HB ILE B 22 12.227 -4.851 -12.745 1.00 0.00 H new ATOM 0 HG12 ILE B 22 11.729 -2.453 -14.422 1.00 0.00 H new ATOM 0 HG13 ILE B 22 10.570 -3.753 -14.620 1.00 0.00 H new ATOM 0 HG21 ILE B 22 13.757 -2.921 -12.829 1.00 0.00 H new ATOM 0 HG22 ILE B 22 14.542 -4.408 -13.412 1.00 0.00 H new ATOM 0 HG23 ILE B 22 13.984 -3.182 -14.575 1.00 0.00 H new ATOM 0 HD11 ILE B 22 9.826 -2.170 -12.910 1.00 0.00 H new ATOM 0 HD12 ILE B 22 10.147 -3.765 -12.187 1.00 0.00 H new ATOM 0 HD13 ILE B 22 11.323 -2.444 -11.986 1.00 0.00 H new ATOM 1250 N LEU B 23 13.334 -7.298 -13.597 1.00 0.00 N ATOM 1251 CA LEU B 23 14.335 -8.303 -13.256 1.00 0.00 C ATOM 1252 C LEU B 23 14.790 -9.061 -14.499 1.00 0.00 C ATOM 1253 O LEU B 23 15.975 -9.353 -14.660 1.00 0.00 O ATOM 1254 CB LEU B 23 13.771 -9.283 -12.226 1.00 0.00 C ATOM 1255 CG LEU B 23 14.299 -9.133 -10.798 1.00 0.00 C ATOM 1256 CD1 LEU B 23 15.799 -9.378 -10.755 1.00 0.00 C ATOM 1257 CD2 LEU B 23 13.965 -7.754 -10.249 1.00 0.00 C ATOM 0 H LEU B 23 12.482 -7.344 -13.038 1.00 0.00 H new ATOM 0 HA LEU B 23 15.197 -7.792 -12.828 1.00 0.00 H new ATOM 0 HB2 LEU B 23 12.687 -9.173 -12.205 1.00 0.00 H new ATOM 0 HB3 LEU B 23 13.982 -10.297 -12.565 1.00 0.00 H new ATOM 0 HG LEU B 23 13.812 -9.880 -10.170 1.00 0.00 H new ATOM 0 HD11 LEU B 23 16.157 -9.267 -9.731 1.00 0.00 H new ATOM 0 HD12 LEU B 23 16.013 -10.387 -11.107 1.00 0.00 H new ATOM 0 HD13 LEU B 23 16.304 -8.656 -11.396 1.00 0.00 H new ATOM 0 HD21 LEU B 23 14.348 -7.665 -9.232 1.00 0.00 H new ATOM 0 HD22 LEU B 23 14.424 -6.991 -10.878 1.00 0.00 H new ATOM 0 HD23 LEU B 23 12.884 -7.617 -10.243 1.00 0.00 H new ATOM 1269 N ILE B 24 13.842 -9.373 -15.376 1.00 0.00 N ATOM 1270 CA ILE B 24 14.147 -10.093 -16.606 1.00 0.00 C ATOM 1271 C ILE B 24 15.146 -9.322 -17.461 1.00 0.00 C ATOM 1272 O ILE B 24 16.092 -9.896 -18.001 1.00 0.00 O ATOM 1273 CB ILE B 24 12.875 -10.357 -17.434 1.00 0.00 C ATOM 1274 CG1 ILE B 24 11.876 -11.187 -16.625 1.00 0.00 C ATOM 1275 CG2 ILE B 24 13.227 -11.062 -18.735 1.00 0.00 C ATOM 1276 CD1 ILE B 24 10.434 -10.803 -16.869 1.00 0.00 C ATOM 0 H ILE B 24 12.856 -9.138 -15.258 1.00 0.00 H new ATOM 0 HA ILE B 24 14.584 -11.047 -16.313 1.00 0.00 H new ATOM 0 HB ILE B 24 12.412 -9.400 -17.676 1.00 0.00 H new ATOM 0 HG12 ILE B 24 12.009 -12.241 -16.870 1.00 0.00 H new ATOM 0 HG13 ILE B 24 12.099 -11.076 -15.564 1.00 0.00 H new ATOM 0 HG21 ILE B 24 12.318 -11.242 -19.309 1.00 0.00 H new ATOM 0 HG22 ILE B 24 13.905 -10.437 -19.316 1.00 0.00 H new ATOM 0 HG23 ILE B 24 13.710 -12.014 -18.514 1.00 0.00 H new ATOM 0 HD11 ILE B 24 9.782 -11.432 -16.263 1.00 0.00 H new ATOM 0 HD12 ILE B 24 10.285 -9.758 -16.597 1.00 0.00 H new ATOM 0 HD13 ILE B 24 10.194 -10.941 -17.923 1.00 0.00 H new ATOM 1288 N LYS B 25 14.931 -8.017 -17.581 1.00 0.00 N ATOM 1289 CA LYS B 25 15.814 -7.164 -18.368 1.00 0.00 C ATOM 1290 C LYS B 25 17.207 -7.106 -17.750 1.00 0.00 C ATOM 1291 O LYS B 25 18.213 -7.163 -18.456 1.00 0.00 O ATOM 1292 CB LYS B 25 15.232 -5.752 -18.473 1.00 0.00 C ATOM 1293 CG LYS B 25 13.831 -5.714 -19.060 1.00 0.00 C ATOM 1294 CD LYS B 25 13.859 -5.416 -20.550 1.00 0.00 C ATOM 1295 CE LYS B 25 14.579 -6.510 -21.323 1.00 0.00 C ATOM 1296 NZ LYS B 25 14.143 -6.561 -22.747 1.00 0.00 N ATOM 0 H LYS B 25 14.152 -7.526 -17.143 1.00 0.00 H new ATOM 0 HA LYS B 25 15.896 -7.592 -19.367 1.00 0.00 H new ATOM 0 HB2 LYS B 25 15.214 -5.301 -17.481 1.00 0.00 H new ATOM 0 HB3 LYS B 25 15.892 -5.141 -19.089 1.00 0.00 H new ATOM 0 HG2 LYS B 25 13.338 -6.671 -18.888 1.00 0.00 H new ATOM 0 HG3 LYS B 25 13.241 -4.954 -18.547 1.00 0.00 H new ATOM 0 HD2 LYS B 25 12.839 -5.317 -20.922 1.00 0.00 H new ATOM 0 HD3 LYS B 25 14.355 -4.461 -20.722 1.00 0.00 H new ATOM 0 HE2 LYS B 25 15.655 -6.339 -21.278 1.00 0.00 H new ATOM 0 HE3 LYS B 25 14.390 -7.474 -20.850 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 14.656 -7.319 -23.240 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 13.121 -6.749 -22.791 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 14.347 -5.650 -23.205 1.00 0.00 H new ATOM 1310 N VAL B 26 17.258 -6.993 -16.426 1.00 0.00 N ATOM 1311 CA VAL B 26 18.529 -6.930 -15.713 1.00 0.00 C ATOM 1312 C VAL B 26 19.306 -8.232 -15.860 1.00 0.00 C ATOM 1313 O VAL B 26 20.526 -8.224 -16.031 1.00 0.00 O ATOM 1314 CB VAL B 26 18.318 -6.637 -14.216 1.00 0.00 C ATOM 1315 CG1 VAL B 26 19.646 -6.338 -13.538 1.00 0.00 C ATOM 1316 CG2 VAL B 26 17.344 -5.482 -14.031 1.00 0.00 C ATOM 0 H VAL B 26 16.435 -6.943 -15.826 1.00 0.00 H new ATOM 0 HA VAL B 26 19.102 -6.116 -16.158 1.00 0.00 H new ATOM 0 HB VAL B 26 17.889 -7.523 -13.747 1.00 0.00 H new ATOM 0 HG11 VAL B 26 19.477 -6.133 -12.481 1.00 0.00 H new ATOM 0 HG12 VAL B 26 20.308 -7.198 -13.640 1.00 0.00 H new ATOM 0 HG13 VAL B 26 20.106 -5.468 -14.007 1.00 0.00 H new ATOM 0 HG21 VAL B 26 17.207 -5.289 -12.967 1.00 0.00 H new ATOM 0 HG22 VAL B 26 17.742 -4.589 -14.514 1.00 0.00 H new ATOM 0 HG23 VAL B 26 16.385 -5.740 -14.480 1.00 0.00 H new ATOM 1326 N PHE B 27 18.593 -9.352 -15.793 1.00 0.00 N ATOM 1327 CA PHE B 27 19.217 -10.664 -15.919 1.00 0.00 C ATOM 1328 C PHE B 27 19.727 -10.890 -17.339 1.00 0.00 C ATOM 1329 O PHE B 27 20.830 -11.399 -17.539 1.00 0.00 O ATOM 1330 CB PHE B 27 18.221 -11.763 -15.541 1.00 0.00 C ATOM 1331 CG PHE B 27 18.212 -12.085 -14.074 1.00 0.00 C ATOM 1332 CD1 PHE B 27 19.358 -12.541 -13.444 1.00 0.00 C ATOM 1333 CD2 PHE B 27 17.056 -11.932 -13.325 1.00 0.00 C ATOM 1334 CE1 PHE B 27 19.351 -12.839 -12.094 1.00 0.00 C ATOM 1335 CE2 PHE B 27 17.043 -12.228 -11.975 1.00 0.00 C ATOM 1336 CZ PHE B 27 18.193 -12.681 -11.359 1.00 0.00 C ATOM 0 H PHE B 27 17.583 -9.377 -15.652 1.00 0.00 H new ATOM 0 HA PHE B 27 20.067 -10.702 -15.237 1.00 0.00 H new ATOM 0 HB2 PHE B 27 17.220 -11.455 -15.843 1.00 0.00 H new ATOM 0 HB3 PHE B 27 18.459 -12.667 -16.102 1.00 0.00 H new ATOM 0 HD1 PHE B 27 20.267 -12.665 -14.014 1.00 0.00 H new ATOM 0 HD2 PHE B 27 16.154 -11.577 -13.802 1.00 0.00 H new ATOM 0 HE1 PHE B 27 20.251 -13.195 -11.615 1.00 0.00 H new ATOM 0 HE2 PHE B 27 16.135 -12.105 -11.403 1.00 0.00 H new ATOM 0 HZ PHE B 27 18.187 -12.911 -10.304 1.00 0.00 H new ATOM 1346 N ALA B 28 18.916 -10.510 -18.320 1.00 0.00 N ATOM 1347 CA ALA B 28 19.285 -10.669 -19.721 1.00 0.00 C ATOM 1348 C ALA B 28 20.509 -9.827 -20.066 1.00 0.00 C ATOM 1349 O ALA B 28 21.434 -10.301 -20.724 1.00 0.00 O ATOM 1350 CB ALA B 28 18.116 -10.298 -20.621 1.00 0.00 C ATOM 0 H ALA B 28 17.999 -10.090 -18.171 1.00 0.00 H new ATOM 0 HA ALA B 28 19.538 -11.716 -19.887 1.00 0.00 H new ATOM 0 HB1 ALA B 28 18.406 -10.422 -21.664 1.00 0.00 H new ATOM 0 HB2 ALA B 28 17.268 -10.946 -20.401 1.00 0.00 H new ATOM 0 HB3 ALA B 28 17.835 -9.260 -20.443 1.00 0.00 H new ATOM 1356 N GLU B 29 20.506 -8.575 -19.617 1.00 0.00 N ATOM 1357 CA GLU B 29 21.616 -7.667 -19.881 1.00 0.00 C ATOM 1358 C GLU B 29 22.865 -8.100 -19.119 1.00 0.00 C ATOM 1359 O GLU B 29 23.980 -7.693 -19.450 1.00 0.00 O ATOM 1360 CB GLU B 29 21.237 -6.237 -19.490 1.00 0.00 C ATOM 1361 CG GLU B 29 21.484 -5.920 -18.025 1.00 0.00 C ATOM 1362 CD GLU B 29 22.766 -5.140 -17.805 1.00 0.00 C ATOM 1363 OE1 GLU B 29 22.802 -3.944 -18.162 1.00 0.00 O ATOM 1364 OE2 GLU B 29 23.733 -5.726 -17.275 1.00 0.00 O ATOM 0 H GLU B 29 19.748 -8.167 -19.069 1.00 0.00 H new ATOM 0 HA GLU B 29 21.833 -7.699 -20.949 1.00 0.00 H new ATOM 0 HB2 GLU B 29 21.805 -5.539 -20.105 1.00 0.00 H new ATOM 0 HB3 GLU B 29 20.183 -6.075 -19.715 1.00 0.00 H new ATOM 0 HG2 GLU B 29 20.643 -5.347 -17.634 1.00 0.00 H new ATOM 0 HG3 GLU B 29 21.527 -6.850 -17.458 1.00 0.00 H new ATOM 1371 N LEU B 30 22.671 -8.927 -18.098 1.00 0.00 N ATOM 1372 CA LEU B 30 23.782 -9.416 -17.288 1.00 0.00 C ATOM 1373 C LEU B 30 24.339 -10.717 -17.856 1.00 0.00 C ATOM 1374 O LEU B 30 25.410 -11.173 -17.457 1.00 0.00 O ATOM 1375 CB LEU B 30 23.329 -9.630 -15.842 1.00 0.00 C ATOM 1376 CG LEU B 30 23.218 -8.372 -14.980 1.00 0.00 C ATOM 1377 CD1 LEU B 30 22.415 -8.657 -13.721 1.00 0.00 C ATOM 1378 CD2 LEU B 30 24.601 -7.846 -14.625 1.00 0.00 C ATOM 0 H LEU B 30 21.755 -9.273 -17.811 1.00 0.00 H new ATOM 0 HA LEU B 30 24.572 -8.665 -17.308 1.00 0.00 H new ATOM 0 HB2 LEU B 30 22.357 -10.123 -15.856 1.00 0.00 H new ATOM 0 HB3 LEU B 30 24.027 -10.315 -15.361 1.00 0.00 H new ATOM 0 HG LEU B 30 22.696 -7.606 -15.554 1.00 0.00 H new ATOM 0 HD11 LEU B 30 22.347 -7.750 -13.120 1.00 0.00 H new ATOM 0 HD12 LEU B 30 21.413 -8.987 -13.995 1.00 0.00 H new ATOM 0 HD13 LEU B 30 22.909 -9.439 -13.144 1.00 0.00 H new ATOM 0 HD21 LEU B 30 24.503 -6.950 -14.011 1.00 0.00 H new ATOM 0 HD22 LEU B 30 25.149 -8.608 -14.070 1.00 0.00 H new ATOM 0 HD23 LEU B 30 25.143 -7.602 -15.539 1.00 0.00 H new ATOM 1390 N GLY B 31 23.605 -11.310 -18.793 1.00 0.00 N ATOM 1391 CA GLY B 31 24.043 -12.552 -19.403 1.00 0.00 C ATOM 1392 C GLY B 31 23.401 -13.768 -18.767 1.00 0.00 C ATOM 1393 O GLY B 31 23.824 -14.899 -19.007 1.00 0.00 O ATOM 0 H GLY B 31 22.715 -10.952 -19.140 1.00 0.00 H new ATOM 0 HA2 GLY B 31 23.806 -12.534 -20.467 1.00 0.00 H new ATOM 0 HA3 GLY B 31 25.127 -12.632 -19.320 1.00 0.00 H new ATOM 1397 N TYR B 32 22.378 -13.537 -17.952 1.00 0.00 N ATOM 1398 CA TYR B 32 21.678 -14.623 -17.276 1.00 0.00 C ATOM 1399 C TYR B 32 20.453 -15.061 -18.073 1.00 0.00 C ATOM 1400 O TYR B 32 19.419 -15.408 -17.503 1.00 0.00 O ATOM 1401 CB TYR B 32 21.258 -14.190 -15.871 1.00 0.00 C ATOM 1402 CG TYR B 32 22.423 -13.944 -14.939 1.00 0.00 C ATOM 1403 CD1 TYR B 32 23.275 -12.864 -15.131 1.00 0.00 C ATOM 1404 CD2 TYR B 32 22.671 -14.792 -13.866 1.00 0.00 C ATOM 1405 CE1 TYR B 32 24.342 -12.636 -14.283 1.00 0.00 C ATOM 1406 CE2 TYR B 32 23.734 -14.571 -13.012 1.00 0.00 C ATOM 1407 CZ TYR B 32 24.567 -13.492 -13.225 1.00 0.00 C ATOM 1408 OH TYR B 32 25.627 -13.267 -12.377 1.00 0.00 O ATOM 0 H TYR B 32 22.015 -12.607 -17.743 1.00 0.00 H new ATOM 0 HA TYR B 32 22.361 -15.469 -17.199 1.00 0.00 H new ATOM 0 HB2 TYR B 32 20.663 -13.280 -15.943 1.00 0.00 H new ATOM 0 HB3 TYR B 32 20.615 -14.958 -15.440 1.00 0.00 H new ATOM 0 HD1 TYR B 32 23.101 -12.191 -15.957 1.00 0.00 H new ATOM 0 HD2 TYR B 32 22.021 -15.638 -13.697 1.00 0.00 H new ATOM 0 HE1 TYR B 32 24.996 -11.792 -14.448 1.00 0.00 H new ATOM 0 HE2 TYR B 32 23.912 -15.239 -12.182 1.00 0.00 H new ATOM 0 HH TYR B 32 25.644 -13.960 -11.684 1.00 0.00 H new ATOM 1418 N ASN B 33 20.579 -15.044 -19.396 1.00 0.00 N ATOM 1419 CA ASN B 33 19.482 -15.439 -20.273 1.00 0.00 C ATOM 1420 C ASN B 33 18.891 -16.776 -19.835 1.00 0.00 C ATOM 1421 O ASN B 33 19.523 -17.536 -19.101 1.00 0.00 O ATOM 1422 CB ASN B 33 19.969 -15.534 -21.721 1.00 0.00 C ATOM 1423 CG ASN B 33 18.838 -15.809 -22.693 1.00 0.00 C ATOM 1424 OD1 ASN B 33 18.841 -16.820 -23.395 1.00 0.00 O ATOM 1425 ND2 ASN B 33 17.865 -14.907 -22.739 1.00 0.00 N ATOM 0 H ASN B 33 21.429 -14.761 -19.884 1.00 0.00 H new ATOM 0 HA ASN B 33 18.704 -14.678 -20.207 1.00 0.00 H new ATOM 0 HB2 ASN B 33 20.464 -14.603 -21.997 1.00 0.00 H new ATOM 0 HB3 ASN B 33 20.713 -16.326 -21.800 1.00 0.00 H new ATOM 0 HD21 ASN B 33 17.078 -15.037 -23.375 1.00 0.00 H new ATOM 0 HD22 ASN B 33 17.904 -14.084 -22.138 1.00 0.00 H new ATOM 1432 N ASP B 34 17.675 -17.056 -20.292 1.00 0.00 N ATOM 1433 CA ASP B 34 16.998 -18.302 -19.949 1.00 0.00 C ATOM 1434 C ASP B 34 16.579 -18.307 -18.482 1.00 0.00 C ATOM 1435 O ASP B 34 16.975 -19.186 -17.717 1.00 0.00 O ATOM 1436 CB ASP B 34 17.908 -19.497 -20.236 1.00 0.00 C ATOM 1437 CG ASP B 34 17.130 -20.728 -20.661 1.00 0.00 C ATOM 1438 OD1 ASP B 34 16.518 -21.374 -19.785 1.00 0.00 O ATOM 1439 OD2 ASP B 34 17.134 -21.043 -21.869 1.00 0.00 O ATOM 0 H ASP B 34 17.138 -16.438 -20.900 1.00 0.00 H new ATOM 0 HA ASP B 34 16.102 -18.381 -20.564 1.00 0.00 H new ATOM 0 HB2 ASP B 34 18.617 -19.230 -21.020 1.00 0.00 H new ATOM 0 HB3 ASP B 34 18.491 -19.729 -19.344 1.00 0.00 H new ATOM 1444 N ILE B 35 15.777 -17.320 -18.098 1.00 0.00 N ATOM 1445 CA ILE B 35 15.304 -17.211 -16.724 1.00 0.00 C ATOM 1446 C ILE B 35 14.023 -18.011 -16.518 1.00 0.00 C ATOM 1447 O ILE B 35 13.218 -18.161 -17.437 1.00 0.00 O ATOM 1448 CB ILE B 35 15.048 -15.744 -16.331 1.00 0.00 C ATOM 1449 CG1 ILE B 35 15.937 -15.347 -15.151 1.00 0.00 C ATOM 1450 CG2 ILE B 35 13.580 -15.535 -15.989 1.00 0.00 C ATOM 1451 CD1 ILE B 35 17.352 -14.991 -15.552 1.00 0.00 C ATOM 0 H ILE B 35 15.441 -16.584 -18.719 1.00 0.00 H new ATOM 0 HA ILE B 35 16.090 -17.618 -16.087 1.00 0.00 H new ATOM 0 HB ILE B 35 15.297 -15.107 -17.180 1.00 0.00 H new ATOM 0 HG12 ILE B 35 15.488 -14.496 -14.639 1.00 0.00 H new ATOM 0 HG13 ILE B 35 15.967 -16.169 -14.436 1.00 0.00 H new ATOM 0 HG21 ILE B 35 13.415 -14.493 -15.713 1.00 0.00 H new ATOM 0 HG22 ILE B 35 12.966 -15.783 -16.855 1.00 0.00 H new ATOM 0 HG23 ILE B 35 13.306 -16.179 -15.153 1.00 0.00 H new ATOM 0 HD11 ILE B 35 17.924 -14.720 -14.665 1.00 0.00 H new ATOM 0 HD12 ILE B 35 17.819 -15.848 -16.037 1.00 0.00 H new ATOM 0 HD13 ILE B 35 17.333 -14.148 -16.243 1.00 0.00 H new ATOM 1463 N ASN B 36 13.839 -18.522 -15.305 1.00 0.00 N ATOM 1464 CA ASN B 36 12.654 -19.307 -14.977 1.00 0.00 C ATOM 1465 C ASN B 36 11.983 -18.777 -13.714 1.00 0.00 C ATOM 1466 O ASN B 36 12.592 -18.736 -12.645 1.00 0.00 O ATOM 1467 CB ASN B 36 13.027 -20.779 -14.791 1.00 0.00 C ATOM 1468 CG ASN B 36 13.015 -21.549 -16.097 1.00 0.00 C ATOM 1469 OD1 ASN B 36 13.864 -21.337 -16.963 1.00 0.00 O ATOM 1470 ND2 ASN B 36 12.049 -22.447 -16.246 1.00 0.00 N ATOM 0 H ASN B 36 14.495 -18.407 -14.533 1.00 0.00 H new ATOM 0 HA ASN B 36 11.950 -19.220 -15.805 1.00 0.00 H new ATOM 0 HB2 ASN B 36 14.018 -20.846 -14.342 1.00 0.00 H new ATOM 0 HB3 ASN B 36 12.329 -21.242 -14.093 1.00 0.00 H new ATOM 0 HD21 ASN B 36 11.989 -22.994 -17.105 1.00 0.00 H new ATOM 0 HD22 ASN B 36 11.366 -22.590 -15.502 1.00 0.00 H new ATOM 1477 N VAL B 37 10.724 -18.372 -13.845 1.00 0.00 N ATOM 1478 CA VAL B 37 9.968 -17.846 -12.714 1.00 0.00 C ATOM 1479 C VAL B 37 8.960 -18.869 -12.203 1.00 0.00 C ATOM 1480 O VAL B 37 8.278 -19.531 -12.987 1.00 0.00 O ATOM 1481 CB VAL B 37 9.223 -16.551 -13.091 1.00 0.00 C ATOM 1482 CG1 VAL B 37 8.113 -16.844 -14.088 1.00 0.00 C ATOM 1483 CG2 VAL B 37 8.668 -15.875 -11.846 1.00 0.00 C ATOM 0 H VAL B 37 10.206 -18.398 -14.723 1.00 0.00 H new ATOM 0 HA VAL B 37 10.689 -17.626 -11.926 1.00 0.00 H new ATOM 0 HB VAL B 37 9.931 -15.869 -13.563 1.00 0.00 H new ATOM 0 HG11 VAL B 37 7.598 -15.917 -14.342 1.00 0.00 H new ATOM 0 HG12 VAL B 37 8.541 -17.281 -14.990 1.00 0.00 H new ATOM 0 HG13 VAL B 37 7.403 -17.544 -13.647 1.00 0.00 H new ATOM 0 HG21 VAL B 37 8.145 -14.962 -12.130 1.00 0.00 H new ATOM 0 HG22 VAL B 37 7.974 -16.550 -11.344 1.00 0.00 H new ATOM 0 HG23 VAL B 37 9.487 -15.629 -11.170 1.00 0.00 H new ATOM 1493 N THR B 38 8.870 -18.994 -10.883 1.00 0.00 N ATOM 1494 CA THR B 38 7.945 -19.937 -10.266 1.00 0.00 C ATOM 1495 C THR B 38 7.193 -19.291 -9.108 1.00 0.00 C ATOM 1496 O THR B 38 7.786 -18.942 -8.087 1.00 0.00 O ATOM 1497 CB THR B 38 8.680 -21.189 -9.751 1.00 0.00 C ATOM 1498 OG1 THR B 38 9.852 -20.804 -9.023 1.00 0.00 O ATOM 1499 CG2 THR B 38 9.070 -22.100 -10.905 1.00 0.00 C ATOM 0 H THR B 38 9.426 -18.454 -10.220 1.00 0.00 H new ATOM 0 HA THR B 38 7.234 -20.233 -11.037 1.00 0.00 H new ATOM 0 HB THR B 38 8.005 -21.734 -9.091 1.00 0.00 H new ATOM 0 HG1 THR B 38 9.632 -20.069 -8.413 1.00 0.00 H new ATOM 0 HG21 THR B 38 9.588 -22.977 -10.517 1.00 0.00 H new ATOM 0 HG22 THR B 38 8.174 -22.414 -11.439 1.00 0.00 H new ATOM 0 HG23 THR B 38 9.729 -21.562 -11.587 1.00 0.00 H new ATOM 1576 N VAL B 44 6.545 -14.559 -5.726 1.00 0.00 N ATOM 1577 CA VAL B 44 7.184 -14.870 -6.999 1.00 0.00 C ATOM 1578 C VAL B 44 8.697 -14.983 -6.842 1.00 0.00 C ATOM 1579 O VAL B 44 9.338 -14.111 -6.253 1.00 0.00 O ATOM 1580 CB VAL B 44 6.868 -13.801 -8.062 1.00 0.00 C ATOM 1581 CG1 VAL B 44 7.415 -12.447 -7.636 1.00 0.00 C ATOM 1582 CG2 VAL B 44 7.431 -14.212 -9.414 1.00 0.00 C ATOM 0 HA VAL B 44 6.783 -15.829 -7.328 1.00 0.00 H new ATOM 0 HB VAL B 44 5.785 -13.715 -8.156 1.00 0.00 H new ATOM 0 HG11 VAL B 44 7.182 -11.704 -8.399 1.00 0.00 H new ATOM 0 HG12 VAL B 44 6.959 -12.151 -6.691 1.00 0.00 H new ATOM 0 HG13 VAL B 44 8.496 -12.514 -7.512 1.00 0.00 H new ATOM 0 HG21 VAL B 44 7.199 -13.445 -10.153 1.00 0.00 H new ATOM 0 HG22 VAL B 44 8.512 -14.327 -9.338 1.00 0.00 H new ATOM 0 HG23 VAL B 44 6.986 -15.159 -9.721 1.00 0.00 H new ATOM 1592 N THR B 45 9.263 -16.062 -7.372 1.00 0.00 N ATOM 1593 CA THR B 45 10.700 -16.290 -7.290 1.00 0.00 C ATOM 1594 C THR B 45 11.302 -16.508 -8.674 1.00 0.00 C ATOM 1595 O THR B 45 10.887 -17.406 -9.408 1.00 0.00 O ATOM 1596 CB THR B 45 11.026 -17.506 -6.403 1.00 0.00 C ATOM 1597 OG1 THR B 45 10.365 -17.382 -5.139 1.00 0.00 O ATOM 1598 CG2 THR B 45 12.527 -17.630 -6.186 1.00 0.00 C ATOM 0 H THR B 45 8.748 -16.792 -7.863 1.00 0.00 H new ATOM 0 HA THR B 45 11.137 -15.397 -6.844 1.00 0.00 H new ATOM 0 HB THR B 45 10.672 -18.403 -6.911 1.00 0.00 H new ATOM 0 HG1 THR B 45 10.576 -18.160 -4.582 1.00 0.00 H new ATOM 0 HG21 THR B 45 12.733 -18.496 -5.557 1.00 0.00 H new ATOM 0 HG22 THR B 45 13.025 -17.754 -7.148 1.00 0.00 H new ATOM 0 HG23 THR B 45 12.900 -16.730 -5.698 1.00 0.00 H new ATOM 1606 N VAL B 46 12.282 -15.682 -9.025 1.00 0.00 N ATOM 1607 CA VAL B 46 12.943 -15.786 -10.320 1.00 0.00 C ATOM 1608 C VAL B 46 14.254 -16.555 -10.208 1.00 0.00 C ATOM 1609 O VAL B 46 15.027 -16.350 -9.273 1.00 0.00 O ATOM 1610 CB VAL B 46 13.225 -14.396 -10.920 1.00 0.00 C ATOM 1611 CG1 VAL B 46 14.323 -13.690 -10.139 1.00 0.00 C ATOM 1612 CG2 VAL B 46 13.597 -14.515 -12.390 1.00 0.00 C ATOM 0 H VAL B 46 12.636 -14.933 -8.430 1.00 0.00 H new ATOM 0 HA VAL B 46 12.264 -16.327 -10.979 1.00 0.00 H new ATOM 0 HB VAL B 46 12.317 -13.797 -10.846 1.00 0.00 H new ATOM 0 HG11 VAL B 46 14.509 -12.709 -10.578 1.00 0.00 H new ATOM 0 HG12 VAL B 46 14.012 -13.570 -9.101 1.00 0.00 H new ATOM 0 HG13 VAL B 46 15.236 -14.284 -10.178 1.00 0.00 H new ATOM 0 HG21 VAL B 46 13.793 -13.523 -12.797 1.00 0.00 H new ATOM 0 HG22 VAL B 46 14.490 -15.131 -12.490 1.00 0.00 H new ATOM 0 HG23 VAL B 46 12.775 -14.976 -12.937 1.00 0.00 H new ATOM 1622 N GLU B 47 14.499 -17.440 -11.169 1.00 0.00 N ATOM 1623 CA GLU B 47 15.719 -18.240 -11.177 1.00 0.00 C ATOM 1624 C GLU B 47 16.523 -17.993 -12.451 1.00 0.00 C ATOM 1625 O GLU B 47 16.061 -18.278 -13.555 1.00 0.00 O ATOM 1626 CB GLU B 47 15.380 -19.727 -11.055 1.00 0.00 C ATOM 1627 CG GLU B 47 15.343 -20.227 -9.621 1.00 0.00 C ATOM 1628 CD GLU B 47 14.950 -21.688 -9.522 1.00 0.00 C ATOM 1629 OE1 GLU B 47 14.074 -22.122 -10.300 1.00 0.00 O ATOM 1630 OE2 GLU B 47 15.519 -22.399 -8.667 1.00 0.00 O ATOM 0 H GLU B 47 13.870 -17.621 -11.951 1.00 0.00 H new ATOM 0 HA GLU B 47 16.325 -17.941 -10.322 1.00 0.00 H new ATOM 0 HB2 GLU B 47 14.411 -19.909 -11.520 1.00 0.00 H new ATOM 0 HB3 GLU B 47 16.115 -20.306 -11.614 1.00 0.00 H new ATOM 0 HG2 GLU B 47 16.324 -20.087 -9.166 1.00 0.00 H new ATOM 0 HG3 GLU B 47 14.637 -19.625 -9.049 1.00 0.00 H new ATOM 1637 N GLY B 48 17.730 -17.460 -12.287 1.00 0.00 N ATOM 1638 CA GLY B 48 18.579 -17.182 -13.431 1.00 0.00 C ATOM 1639 C GLY B 48 19.971 -17.760 -13.273 1.00 0.00 C ATOM 1640 O GLY B 48 20.523 -17.772 -12.173 1.00 0.00 O ATOM 0 H GLY B 48 18.135 -17.216 -11.383 1.00 0.00 H new ATOM 0 HA2 GLY B 48 18.118 -17.592 -14.330 1.00 0.00 H new ATOM 0 HA3 GLY B 48 18.651 -16.104 -13.573 1.00 0.00 H new ATOM 1644 N GLN B 49 20.540 -18.240 -14.374 1.00 0.00 N ATOM 1645 CA GLN B 49 21.876 -18.824 -14.351 1.00 0.00 C ATOM 1646 C GLN B 49 22.783 -18.147 -15.373 1.00 0.00 C ATOM 1647 O GLN B 49 22.331 -17.729 -16.440 1.00 0.00 O ATOM 1648 CB GLN B 49 21.804 -20.326 -14.631 1.00 0.00 C ATOM 1649 CG GLN B 49 21.382 -20.660 -16.053 1.00 0.00 C ATOM 1650 CD GLN B 49 19.913 -20.388 -16.306 1.00 0.00 C ATOM 1651 OE1 GLN B 49 19.623 -19.286 -16.989 1.00 0.00 O flip ATOM 1652 NE2 GLN B 49 19.046 -21.158 -15.891 1.00 0.00 N flip ATOM 0 H GLN B 49 20.097 -18.236 -15.293 1.00 0.00 H new ATOM 0 HA GLN B 49 22.297 -18.667 -13.358 1.00 0.00 H new ATOM 0 HB2 GLN B 49 22.780 -20.771 -14.437 1.00 0.00 H new ATOM 0 HB3 GLN B 49 21.101 -20.784 -13.935 1.00 0.00 H new ATOM 0 HG2 GLN B 49 21.981 -20.076 -16.752 1.00 0.00 H new ATOM 0 HG3 GLN B 49 21.592 -21.711 -16.253 1.00 0.00 H new ATOM 0 HE21 GLN B 49 19.313 -21.994 -15.370 1.00 0.00 H new ATOM 0 HE22 GLN B 49 18.061 -20.960 -16.068 1.00 0.00 H new ATOM 1661 N LEU B 50 24.065 -18.041 -15.040 1.00 0.00 N ATOM 1662 CA LEU B 50 25.037 -17.414 -15.929 1.00 0.00 C ATOM 1663 C LEU B 50 25.954 -18.459 -16.558 1.00 0.00 C ATOM 1664 O LEU B 50 26.358 -19.418 -15.901 1.00 0.00 O ATOM 1665 CB LEU B 50 25.869 -16.385 -15.163 1.00 0.00 C ATOM 1666 CG LEU B 50 26.079 -15.039 -15.859 1.00 0.00 C ATOM 1667 CD1 LEU B 50 27.070 -14.186 -15.082 1.00 0.00 C ATOM 1668 CD2 LEU B 50 26.559 -15.248 -17.288 1.00 0.00 C ATOM 0 H LEU B 50 24.455 -18.381 -14.161 1.00 0.00 H new ATOM 0 HA LEU B 50 24.490 -16.910 -16.726 1.00 0.00 H new ATOM 0 HB2 LEU B 50 25.390 -16.203 -14.201 1.00 0.00 H new ATOM 0 HB3 LEU B 50 26.846 -16.820 -14.955 1.00 0.00 H new ATOM 0 HG LEU B 50 25.124 -14.514 -15.890 1.00 0.00 H new ATOM 0 HD11 LEU B 50 27.207 -13.232 -15.592 1.00 0.00 H new ATOM 0 HD12 LEU B 50 26.688 -14.009 -14.077 1.00 0.00 H new ATOM 0 HD13 LEU B 50 28.026 -14.705 -15.020 1.00 0.00 H new ATOM 0 HD21 LEU B 50 26.703 -14.280 -17.769 1.00 0.00 H new ATOM 0 HD22 LEU B 50 27.503 -15.793 -17.279 1.00 0.00 H new ATOM 0 HD23 LEU B 50 25.815 -15.821 -17.842 1.00 0.00 H new