USER MOD reduce.3.24.130724 H: found=0, std=0, add=739, rem=0, adj=16 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= -0.175 USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 THR OG1 : rot 180:sc= -0.289 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 180:sc= -1.98! USER MOD Single : A 33 ASN :FLIP amide:sc= 0.00434 F(o=-0.63,f=0.0043) USER MOD Single : A 36 ASN : amide:sc= 0 X(o=0,f=-0.0082) USER MOD Single : A 38 THR OG1 : rot 45:sc= 0.125 USER MOD Single : A 43 THR OG1 : rot 22:sc= 0.522 USER MOD Single : A 45 THR OG1 : rot 180:sc= -0.5 USER MOD Single : A 49 GLN : amide:sc= -0.829 X(o=-0.83,f=-0.35) USER MOD Single : B 7 SER OG : rot 180:sc= -0.12 USER MOD Single : B 9 THR OG1 : rot 180:sc= 0 USER MOD Single : B 12 THR OG1 : rot 180:sc= -0.253 USER MOD Single : B 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 14 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.101) 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= -0.945! USER MOD Single : B 33 ASN : amide:sc= -0.0081 X(o=-0.0081,f=-0.0081) USER MOD Single : B 36 ASN : amide:sc= 0 X(o=0,f=-0.071) USER MOD Single : B 38 THR OG1 : rot 42:sc= 0.216 USER MOD Single : B 45 THR OG1 : rot 180:sc= -0.575 USER MOD Single : B 49 GLN :FLIP amide:sc= -0.618 F(o=-1.8!,f=-0.62) USER MOD ----------------------------------------------------------------- ATOM 16 N ARG A 3 3.722 -2.349 1.159 1.00 0.00 N ATOM 17 CA ARG A 3 5.124 -2.613 1.459 1.00 0.00 C ATOM 18 C ARG A 3 5.694 -3.667 0.514 1.00 0.00 C ATOM 19 O ARG A 3 5.165 -4.774 0.410 1.00 0.00 O ATOM 20 CB ARG A 3 5.279 -3.076 2.909 1.00 0.00 C ATOM 21 CG ARG A 3 6.673 -3.584 3.241 1.00 0.00 C ATOM 22 CD ARG A 3 6.758 -5.097 3.120 1.00 0.00 C ATOM 23 NE ARG A 3 7.267 -5.716 4.341 1.00 0.00 N ATOM 24 CZ ARG A 3 7.267 -7.027 4.556 1.00 0.00 C ATOM 25 NH1 ARG A 3 6.789 -7.853 3.636 1.00 0.00 N ATOM 26 NH2 ARG A 3 7.748 -7.514 5.693 1.00 0.00 N ATOM 0 HA ARG A 3 5.680 -1.686 1.319 1.00 0.00 H new ATOM 0 HB2 ARG A 3 5.036 -2.247 3.574 1.00 0.00 H new ATOM 0 HB3 ARG A 3 4.556 -3.867 3.108 1.00 0.00 H new ATOM 0 HG2 ARG A 3 7.399 -3.123 2.571 1.00 0.00 H new ATOM 0 HG3 ARG A 3 6.939 -3.283 4.254 1.00 0.00 H new ATOM 0 HD2 ARG A 3 5.770 -5.499 2.895 1.00 0.00 H new ATOM 0 HD3 ARG A 3 7.407 -5.358 2.284 1.00 0.00 H new ATOM 0 HE ARG A 3 7.643 -5.108 5.069 1.00 0.00 H new ATOM 0 HH11 ARG A 3 6.420 -7.482 2.760 1.00 0.00 H new ATOM 0 HH12 ARG A 3 6.790 -8.859 3.804 1.00 0.00 H new ATOM 0 HH21 ARG A 3 8.118 -6.882 6.403 1.00 0.00 H new ATOM 0 HH22 ARG A 3 7.748 -8.521 5.857 1.00 0.00 H new ATOM 40 N VAL A 4 6.775 -3.315 -0.174 1.00 0.00 N ATOM 41 CA VAL A 4 7.417 -4.230 -1.111 1.00 0.00 C ATOM 42 C VAL A 4 8.790 -4.658 -0.607 1.00 0.00 C ATOM 43 O VAL A 4 9.645 -3.821 -0.316 1.00 0.00 O ATOM 44 CB VAL A 4 7.569 -3.591 -2.504 1.00 0.00 C ATOM 45 CG1 VAL A 4 8.190 -4.580 -3.479 1.00 0.00 C ATOM 46 CG2 VAL A 4 6.223 -3.100 -3.015 1.00 0.00 C ATOM 0 H VAL A 4 7.225 -2.403 -0.100 1.00 0.00 H new ATOM 0 HA VAL A 4 6.773 -5.106 -1.190 1.00 0.00 H new ATOM 0 HB VAL A 4 8.235 -2.732 -2.420 1.00 0.00 H new ATOM 0 HG11 VAL A 4 8.290 -4.112 -4.458 1.00 0.00 H new ATOM 0 HG12 VAL A 4 9.174 -4.878 -3.117 1.00 0.00 H new ATOM 0 HG13 VAL A 4 7.552 -5.460 -3.561 1.00 0.00 H new ATOM 0 HG21 VAL A 4 6.350 -2.651 -4.000 1.00 0.00 H new ATOM 0 HG22 VAL A 4 5.532 -3.940 -3.085 1.00 0.00 H new ATOM 0 HG23 VAL A 4 5.822 -2.356 -2.327 1.00 0.00 H new ATOM 56 N ARG A 5 8.996 -5.967 -0.505 1.00 0.00 N ATOM 57 CA ARG A 5 10.266 -6.507 -0.035 1.00 0.00 C ATOM 58 C ARG A 5 10.784 -7.583 -0.985 1.00 0.00 C ATOM 59 O ARG A 5 10.052 -8.501 -1.357 1.00 0.00 O ATOM 60 CB ARG A 5 10.109 -7.086 1.372 1.00 0.00 C ATOM 61 CG ARG A 5 11.350 -7.804 1.876 1.00 0.00 C ATOM 62 CD ARG A 5 11.248 -8.114 3.362 1.00 0.00 C ATOM 63 NE ARG A 5 11.321 -9.549 3.628 1.00 0.00 N ATOM 64 CZ ARG A 5 10.287 -10.373 3.502 1.00 0.00 C ATOM 65 NH1 ARG A 5 9.107 -9.907 3.116 1.00 0.00 N ATOM 66 NH2 ARG A 5 10.431 -11.665 3.763 1.00 0.00 N ATOM 0 H ARG A 5 8.299 -6.673 -0.742 1.00 0.00 H new ATOM 0 HA ARG A 5 10.990 -5.693 -0.006 1.00 0.00 H new ATOM 0 HB2 ARG A 5 9.860 -6.280 2.062 1.00 0.00 H new ATOM 0 HB3 ARG A 5 9.269 -7.781 1.378 1.00 0.00 H new ATOM 0 HG2 ARG A 5 11.488 -8.730 1.318 1.00 0.00 H new ATOM 0 HG3 ARG A 5 12.229 -7.187 1.691 1.00 0.00 H new ATOM 0 HD2 ARG A 5 12.052 -7.605 3.894 1.00 0.00 H new ATOM 0 HD3 ARG A 5 10.309 -7.720 3.751 1.00 0.00 H new ATOM 0 HE ARG A 5 12.215 -9.939 3.927 1.00 0.00 H new ATOM 0 HH11 ARG A 5 8.992 -8.914 2.915 1.00 0.00 H new ATOM 0 HH12 ARG A 5 8.315 -10.542 3.020 1.00 0.00 H new ATOM 0 HH21 ARG A 5 11.337 -12.027 4.061 1.00 0.00 H new ATOM 0 HH22 ARG A 5 9.636 -12.297 3.666 1.00 0.00 H new ATOM 80 N ILE A 6 12.049 -7.463 -1.373 1.00 0.00 N ATOM 81 CA ILE A 6 12.665 -8.425 -2.279 1.00 0.00 C ATOM 82 C ILE A 6 13.938 -9.010 -1.677 1.00 0.00 C ATOM 83 O ILE A 6 14.845 -8.277 -1.286 1.00 0.00 O ATOM 84 CB ILE A 6 13.000 -7.784 -3.638 1.00 0.00 C ATOM 85 CG1 ILE A 6 11.743 -7.179 -4.266 1.00 0.00 C ATOM 86 CG2 ILE A 6 13.621 -8.814 -4.571 1.00 0.00 C ATOM 87 CD1 ILE A 6 12.011 -6.426 -5.550 1.00 0.00 C ATOM 0 H ILE A 6 12.668 -6.709 -1.074 1.00 0.00 H new ATOM 0 HA ILE A 6 11.939 -9.223 -2.433 1.00 0.00 H new ATOM 0 HB ILE A 6 13.723 -6.985 -3.477 1.00 0.00 H new ATOM 0 HG12 ILE A 6 11.026 -7.976 -4.465 1.00 0.00 H new ATOM 0 HG13 ILE A 6 11.277 -6.503 -3.549 1.00 0.00 H new ATOM 0 HG21 ILE A 6 13.852 -8.346 -5.528 1.00 0.00 H new ATOM 0 HG22 ILE A 6 14.537 -9.202 -4.126 1.00 0.00 H new ATOM 0 HG23 ILE A 6 12.919 -9.633 -4.728 1.00 0.00 H new ATOM 0 HD11 ILE A 6 11.075 -6.025 -5.939 1.00 0.00 H new ATOM 0 HD12 ILE A 6 12.703 -5.607 -5.354 1.00 0.00 H new ATOM 0 HD13 ILE A 6 12.448 -7.103 -6.284 1.00 0.00 H new ATOM 99 N SER A 7 13.998 -10.336 -1.608 1.00 0.00 N ATOM 100 CA SER A 7 15.159 -11.020 -1.052 1.00 0.00 C ATOM 101 C SER A 7 15.931 -11.755 -2.143 1.00 0.00 C ATOM 102 O SER A 7 15.372 -12.582 -2.864 1.00 0.00 O ATOM 103 CB SER A 7 14.725 -12.007 0.034 1.00 0.00 C ATOM 104 OG SER A 7 13.372 -11.800 0.400 1.00 0.00 O ATOM 0 H SER A 7 13.256 -10.958 -1.930 1.00 0.00 H new ATOM 0 HA SER A 7 15.814 -10.269 -0.610 1.00 0.00 H new ATOM 0 HB2 SER A 7 14.856 -13.028 -0.325 1.00 0.00 H new ATOM 0 HB3 SER A 7 15.364 -11.893 0.910 1.00 0.00 H new ATOM 0 HG SER A 7 13.119 -12.444 1.094 1.00 0.00 H new ATOM 110 N ILE A 8 17.218 -11.447 -2.259 1.00 0.00 N ATOM 111 CA ILE A 8 18.068 -12.078 -3.261 1.00 0.00 C ATOM 112 C ILE A 8 19.091 -13.003 -2.611 1.00 0.00 C ATOM 113 O ILE A 8 19.721 -12.648 -1.614 1.00 0.00 O ATOM 114 CB ILE A 8 18.807 -11.030 -4.114 1.00 0.00 C ATOM 115 CG1 ILE A 8 19.843 -10.289 -3.265 1.00 0.00 C ATOM 116 CG2 ILE A 8 17.817 -10.050 -4.725 1.00 0.00 C ATOM 117 CD1 ILE A 8 20.468 -9.107 -3.970 1.00 0.00 C ATOM 0 H ILE A 8 17.695 -10.764 -1.671 1.00 0.00 H new ATOM 0 HA ILE A 8 17.413 -12.663 -3.907 1.00 0.00 H new ATOM 0 HB ILE A 8 19.327 -11.543 -4.923 1.00 0.00 H new ATOM 0 HG12 ILE A 8 19.368 -9.944 -2.346 1.00 0.00 H new ATOM 0 HG13 ILE A 8 20.629 -10.986 -2.975 1.00 0.00 H new ATOM 0 HG21 ILE A 8 18.355 -9.316 -5.325 1.00 0.00 H new ATOM 0 HG22 ILE A 8 17.114 -10.591 -5.358 1.00 0.00 H new ATOM 0 HG23 ILE A 8 17.272 -9.540 -3.930 1.00 0.00 H new ATOM 0 HD11 ILE A 8 21.192 -8.630 -3.309 1.00 0.00 H new ATOM 0 HD12 ILE A 8 20.972 -9.448 -4.875 1.00 0.00 H new ATOM 0 HD13 ILE A 8 19.692 -8.390 -4.236 1.00 0.00 H new ATOM 129 N THR A 9 19.256 -14.191 -3.184 1.00 0.00 N ATOM 130 CA THR A 9 20.203 -15.167 -2.662 1.00 0.00 C ATOM 131 C THR A 9 21.363 -15.380 -3.629 1.00 0.00 C ATOM 132 O THR A 9 21.224 -16.075 -4.635 1.00 0.00 O ATOM 133 CB THR A 9 19.522 -16.521 -2.389 1.00 0.00 C ATOM 134 OG1 THR A 9 18.124 -16.435 -2.686 1.00 0.00 O ATOM 135 CG2 THR A 9 19.713 -16.940 -0.939 1.00 0.00 C ATOM 0 H THR A 9 18.745 -14.500 -4.011 1.00 0.00 H new ATOM 0 HA THR A 9 20.585 -14.765 -1.723 1.00 0.00 H new ATOM 0 HB THR A 9 19.984 -17.271 -3.031 1.00 0.00 H new ATOM 0 HG1 THR A 9 17.699 -17.300 -2.511 1.00 0.00 H new ATOM 0 HG21 THR A 9 19.223 -17.899 -0.770 1.00 0.00 H new ATOM 0 HG22 THR A 9 20.778 -17.033 -0.724 1.00 0.00 H new ATOM 0 HG23 THR A 9 19.275 -16.188 -0.282 1.00 0.00 H new ATOM 143 N ALA A 10 22.505 -14.778 -3.317 1.00 0.00 N ATOM 144 CA ALA A 10 23.689 -14.904 -4.157 1.00 0.00 C ATOM 145 C ALA A 10 24.768 -15.731 -3.465 1.00 0.00 C ATOM 146 O ALA A 10 24.670 -16.023 -2.273 1.00 0.00 O ATOM 147 CB ALA A 10 24.228 -13.528 -4.520 1.00 0.00 C ATOM 0 H ALA A 10 22.636 -14.198 -2.488 1.00 0.00 H new ATOM 0 HA ALA A 10 23.401 -15.422 -5.072 1.00 0.00 H new ATOM 0 HB1 ALA A 10 25.112 -13.638 -5.148 1.00 0.00 H new ATOM 0 HB2 ALA A 10 23.465 -12.970 -5.063 1.00 0.00 H new ATOM 0 HB3 ALA A 10 24.493 -12.990 -3.610 1.00 0.00 H new ATOM 153 N ARG A 11 25.795 -16.105 -4.221 1.00 0.00 N ATOM 154 CA ARG A 11 26.891 -16.901 -3.680 1.00 0.00 C ATOM 155 C ARG A 11 27.719 -16.084 -2.692 1.00 0.00 C ATOM 156 O ARG A 11 27.916 -16.490 -1.546 1.00 0.00 O ATOM 157 CB ARG A 11 27.786 -17.411 -4.811 1.00 0.00 C ATOM 158 CG ARG A 11 28.614 -18.628 -4.431 1.00 0.00 C ATOM 159 CD ARG A 11 29.415 -19.148 -5.614 1.00 0.00 C ATOM 160 NE ARG A 11 30.655 -19.796 -5.193 1.00 0.00 N ATOM 161 CZ ARG A 11 31.684 -20.010 -6.004 1.00 0.00 C ATOM 162 NH1 ARG A 11 31.624 -19.628 -7.272 1.00 0.00 N ATOM 163 NH2 ARG A 11 32.778 -20.606 -5.546 1.00 0.00 N ATOM 0 H ARG A 11 25.891 -15.870 -5.209 1.00 0.00 H new ATOM 0 HA ARG A 11 26.462 -17.753 -3.153 1.00 0.00 H new ATOM 0 HB2 ARG A 11 27.164 -17.659 -5.671 1.00 0.00 H new ATOM 0 HB3 ARG A 11 28.456 -16.609 -5.123 1.00 0.00 H new ATOM 0 HG2 ARG A 11 29.291 -18.369 -3.617 1.00 0.00 H new ATOM 0 HG3 ARG A 11 27.957 -19.415 -4.061 1.00 0.00 H new ATOM 0 HD2 ARG A 11 28.809 -19.857 -6.179 1.00 0.00 H new ATOM 0 HD3 ARG A 11 29.648 -18.322 -6.286 1.00 0.00 H new ATOM 0 HE ARG A 11 30.734 -20.101 -4.223 1.00 0.00 H new ATOM 0 HH11 ARG A 11 30.786 -19.168 -7.627 1.00 0.00 H new ATOM 0 HH12 ARG A 11 32.416 -19.794 -7.893 1.00 0.00 H new ATOM 0 HH21 ARG A 11 32.828 -20.900 -4.571 1.00 0.00 H new ATOM 0 HH22 ARG A 11 33.568 -20.770 -6.170 1.00 0.00 H new ATOM 177 N THR A 12 28.202 -14.931 -3.143 1.00 0.00 N ATOM 178 CA THR A 12 29.010 -14.059 -2.300 1.00 0.00 C ATOM 179 C THR A 12 28.326 -12.713 -2.086 1.00 0.00 C ATOM 180 O THR A 12 27.424 -12.338 -2.835 1.00 0.00 O ATOM 181 CB THR A 12 30.404 -13.822 -2.910 1.00 0.00 C ATOM 182 OG1 THR A 12 31.140 -12.893 -2.105 1.00 0.00 O ATOM 183 CG2 THR A 12 30.290 -13.290 -4.331 1.00 0.00 C ATOM 0 H THR A 12 28.048 -14.579 -4.088 1.00 0.00 H new ATOM 0 HA THR A 12 29.122 -14.563 -1.340 1.00 0.00 H new ATOM 0 HB THR A 12 30.931 -14.776 -2.937 1.00 0.00 H new ATOM 0 HG1 THR A 12 32.026 -12.749 -2.499 1.00 0.00 H new ATOM 0 HG21 THR A 12 31.287 -13.130 -4.741 1.00 0.00 H new ATOM 0 HG22 THR A 12 29.755 -14.012 -4.948 1.00 0.00 H new ATOM 0 HG23 THR A 12 29.745 -12.346 -4.323 1.00 0.00 H new ATOM 191 N LYS A 13 28.761 -11.990 -1.060 1.00 0.00 N ATOM 192 CA LYS A 13 28.192 -10.684 -0.749 1.00 0.00 C ATOM 193 C LYS A 13 28.322 -9.736 -1.937 1.00 0.00 C ATOM 194 O LYS A 13 27.398 -8.986 -2.250 1.00 0.00 O ATOM 195 CB LYS A 13 28.886 -10.082 0.476 1.00 0.00 C ATOM 196 CG LYS A 13 30.397 -10.004 0.342 1.00 0.00 C ATOM 197 CD LYS A 13 31.068 -9.826 1.693 1.00 0.00 C ATOM 198 CE LYS A 13 31.131 -8.361 2.096 1.00 0.00 C ATOM 199 NZ LYS A 13 32.318 -8.070 2.946 1.00 0.00 N ATOM 0 H LYS A 13 29.506 -12.286 -0.429 1.00 0.00 H new ATOM 0 HA LYS A 13 27.133 -10.820 -0.530 1.00 0.00 H new ATOM 0 HB2 LYS A 13 28.493 -9.080 0.650 1.00 0.00 H new ATOM 0 HB3 LYS A 13 28.638 -10.679 1.354 1.00 0.00 H new ATOM 0 HG2 LYS A 13 30.768 -10.912 -0.133 1.00 0.00 H new ATOM 0 HG3 LYS A 13 30.663 -9.172 -0.310 1.00 0.00 H new ATOM 0 HD2 LYS A 13 30.521 -10.389 2.449 1.00 0.00 H new ATOM 0 HD3 LYS A 13 32.076 -10.238 1.657 1.00 0.00 H new ATOM 0 HE2 LYS A 13 31.164 -7.739 1.201 1.00 0.00 H new ATOM 0 HE3 LYS A 13 30.223 -8.094 2.637 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 32.325 -7.061 3.199 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 32.274 -8.644 3.812 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 33.186 -8.301 2.421 1.00 0.00 H new ATOM 213 N LYS A 14 29.475 -9.776 -2.596 1.00 0.00 N ATOM 214 CA LYS A 14 29.726 -8.923 -3.752 1.00 0.00 C ATOM 215 C LYS A 14 28.694 -9.174 -4.847 1.00 0.00 C ATOM 216 O LYS A 14 28.284 -8.250 -5.550 1.00 0.00 O ATOM 217 CB LYS A 14 31.134 -9.169 -4.298 1.00 0.00 C ATOM 218 CG LYS A 14 32.013 -7.930 -4.295 1.00 0.00 C ATOM 219 CD LYS A 14 32.856 -7.848 -3.034 1.00 0.00 C ATOM 220 CE LYS A 14 32.148 -7.064 -1.939 1.00 0.00 C ATOM 221 NZ LYS A 14 33.066 -6.110 -1.257 1.00 0.00 N ATOM 0 H LYS A 14 30.251 -10.390 -2.349 1.00 0.00 H new ATOM 0 HA LYS A 14 29.644 -7.885 -3.430 1.00 0.00 H new ATOM 0 HB2 LYS A 14 31.614 -9.946 -3.704 1.00 0.00 H new ATOM 0 HB3 LYS A 14 31.058 -9.548 -5.317 1.00 0.00 H new ATOM 0 HG2 LYS A 14 32.664 -7.943 -5.169 1.00 0.00 H new ATOM 0 HG3 LYS A 14 31.389 -7.040 -4.375 1.00 0.00 H new ATOM 0 HD2 LYS A 14 33.078 -8.854 -2.677 1.00 0.00 H new ATOM 0 HD3 LYS A 14 33.810 -7.374 -3.263 1.00 0.00 H new ATOM 0 HE2 LYS A 14 31.309 -6.516 -2.369 1.00 0.00 H new ATOM 0 HE3 LYS A 14 31.734 -7.757 -1.206 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 32.546 -5.596 -0.518 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 33.853 -6.635 -0.825 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 33.441 -5.433 -1.951 1.00 0.00 H new ATOM 235 N GLU A 15 28.278 -10.429 -4.986 1.00 0.00 N ATOM 236 CA GLU A 15 27.293 -10.800 -5.996 1.00 0.00 C ATOM 237 C GLU A 15 25.936 -10.175 -5.687 1.00 0.00 C ATOM 238 O GLU A 15 25.333 -9.522 -6.538 1.00 0.00 O ATOM 239 CB GLU A 15 27.160 -12.322 -6.075 1.00 0.00 C ATOM 240 CG GLU A 15 28.114 -12.965 -7.067 1.00 0.00 C ATOM 241 CD GLU A 15 27.415 -13.437 -8.328 1.00 0.00 C ATOM 242 OE1 GLU A 15 27.253 -12.620 -9.258 1.00 0.00 O ATOM 243 OE2 GLU A 15 27.031 -14.624 -8.383 1.00 0.00 O ATOM 0 H GLU A 15 28.607 -11.206 -4.412 1.00 0.00 H new ATOM 0 HA GLU A 15 27.637 -10.422 -6.959 1.00 0.00 H new ATOM 0 HB2 GLU A 15 27.337 -12.746 -5.086 1.00 0.00 H new ATOM 0 HB3 GLU A 15 26.136 -12.575 -6.352 1.00 0.00 H new ATOM 0 HG2 GLU A 15 28.892 -12.249 -7.334 1.00 0.00 H new ATOM 0 HG3 GLU A 15 28.609 -13.812 -6.592 1.00 0.00 H new ATOM 250 N ALA A 16 25.461 -10.380 -4.463 1.00 0.00 N ATOM 251 CA ALA A 16 24.176 -9.837 -4.041 1.00 0.00 C ATOM 252 C ALA A 16 24.181 -8.313 -4.092 1.00 0.00 C ATOM 253 O ALA A 16 23.206 -7.694 -4.516 1.00 0.00 O ATOM 254 CB ALA A 16 23.834 -10.319 -2.639 1.00 0.00 C ATOM 0 H ALA A 16 25.947 -10.918 -3.746 1.00 0.00 H new ATOM 0 HA ALA A 16 23.413 -10.195 -4.732 1.00 0.00 H new ATOM 0 HB1 ALA A 16 22.872 -9.906 -2.337 1.00 0.00 H new ATOM 0 HB2 ALA A 16 23.780 -11.408 -2.632 1.00 0.00 H new ATOM 0 HB3 ALA A 16 24.605 -9.989 -1.943 1.00 0.00 H new ATOM 260 N GLU A 17 25.285 -7.714 -3.656 1.00 0.00 N ATOM 261 CA GLU A 17 25.415 -6.262 -3.651 1.00 0.00 C ATOM 262 C GLU A 17 25.228 -5.694 -5.056 1.00 0.00 C ATOM 263 O GLU A 17 24.604 -4.649 -5.237 1.00 0.00 O ATOM 264 CB GLU A 17 26.783 -5.852 -3.102 1.00 0.00 C ATOM 265 CG GLU A 17 26.723 -5.245 -1.710 1.00 0.00 C ATOM 266 CD GLU A 17 27.904 -4.340 -1.417 1.00 0.00 C ATOM 267 OE1 GLU A 17 27.870 -3.165 -1.838 1.00 0.00 O ATOM 268 OE2 GLU A 17 28.863 -4.807 -0.767 1.00 0.00 O ATOM 0 H GLU A 17 26.102 -8.212 -3.302 1.00 0.00 H new ATOM 0 HA GLU A 17 24.636 -5.855 -3.006 1.00 0.00 H new ATOM 0 HB2 GLU A 17 27.433 -6.726 -3.080 1.00 0.00 H new ATOM 0 HB3 GLU A 17 27.238 -5.133 -3.783 1.00 0.00 H new ATOM 0 HG2 GLU A 17 25.799 -4.676 -1.605 1.00 0.00 H new ATOM 0 HG3 GLU A 17 26.690 -6.045 -0.970 1.00 0.00 H new ATOM 275 N LYS A 18 25.774 -6.391 -6.046 1.00 0.00 N ATOM 276 CA LYS A 18 25.668 -5.960 -7.435 1.00 0.00 C ATOM 277 C LYS A 18 24.207 -5.869 -7.867 1.00 0.00 C ATOM 278 O LYS A 18 23.845 -5.031 -8.693 1.00 0.00 O ATOM 279 CB LYS A 18 26.422 -6.926 -8.350 1.00 0.00 C ATOM 280 CG LYS A 18 27.923 -6.938 -8.118 1.00 0.00 C ATOM 281 CD LYS A 18 28.663 -6.196 -9.219 1.00 0.00 C ATOM 282 CE LYS A 18 30.160 -6.457 -9.158 1.00 0.00 C ATOM 283 NZ LYS A 18 30.949 -5.254 -9.543 1.00 0.00 N ATOM 0 H LYS A 18 26.295 -7.258 -5.912 1.00 0.00 H new ATOM 0 HA LYS A 18 26.115 -4.969 -7.516 1.00 0.00 H new ATOM 0 HB2 LYS A 18 26.032 -7.933 -8.201 1.00 0.00 H new ATOM 0 HB3 LYS A 18 26.225 -6.658 -9.388 1.00 0.00 H new ATOM 0 HG2 LYS A 18 28.147 -6.480 -7.155 1.00 0.00 H new ATOM 0 HG3 LYS A 18 28.277 -7.968 -8.071 1.00 0.00 H new ATOM 0 HD2 LYS A 18 28.278 -6.506 -10.190 1.00 0.00 H new ATOM 0 HD3 LYS A 18 28.475 -5.126 -9.128 1.00 0.00 H new ATOM 0 HE2 LYS A 18 30.434 -6.763 -8.149 1.00 0.00 H new ATOM 0 HE3 LYS A 18 30.412 -7.284 -9.822 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 31.964 -5.473 -9.489 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 30.706 -4.976 -10.515 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 30.728 -4.472 -8.894 1.00 0.00 H new ATOM 297 N PHE A 19 23.373 -6.736 -7.302 1.00 0.00 N ATOM 298 CA PHE A 19 21.952 -6.753 -7.628 1.00 0.00 C ATOM 299 C PHE A 19 21.201 -5.681 -6.845 1.00 0.00 C ATOM 300 O PHE A 19 20.296 -5.033 -7.370 1.00 0.00 O ATOM 301 CB PHE A 19 21.356 -8.130 -7.330 1.00 0.00 C ATOM 302 CG PHE A 19 21.515 -9.110 -8.457 1.00 0.00 C ATOM 303 CD1 PHE A 19 22.677 -9.855 -8.585 1.00 0.00 C ATOM 304 CD2 PHE A 19 20.505 -9.286 -9.389 1.00 0.00 C ATOM 305 CE1 PHE A 19 22.826 -10.757 -9.622 1.00 0.00 C ATOM 306 CE2 PHE A 19 20.649 -10.186 -10.427 1.00 0.00 C ATOM 307 CZ PHE A 19 21.811 -10.923 -10.543 1.00 0.00 C ATOM 0 H PHE A 19 23.657 -7.436 -6.616 1.00 0.00 H new ATOM 0 HA PHE A 19 21.846 -6.541 -8.692 1.00 0.00 H new ATOM 0 HB2 PHE A 19 21.830 -8.536 -6.437 1.00 0.00 H new ATOM 0 HB3 PHE A 19 20.296 -8.017 -7.105 1.00 0.00 H new ATOM 0 HD1 PHE A 19 23.474 -9.729 -7.867 1.00 0.00 H new ATOM 0 HD2 PHE A 19 19.594 -8.712 -9.303 1.00 0.00 H new ATOM 0 HE1 PHE A 19 23.736 -11.332 -9.712 1.00 0.00 H new ATOM 0 HE2 PHE A 19 19.854 -10.313 -11.147 1.00 0.00 H new ATOM 0 HZ PHE A 19 21.926 -11.628 -11.353 1.00 0.00 H new ATOM 317 N ALA A 20 21.584 -5.500 -5.585 1.00 0.00 N ATOM 318 CA ALA A 20 20.948 -4.505 -4.729 1.00 0.00 C ATOM 319 C ALA A 20 21.004 -3.120 -5.363 1.00 0.00 C ATOM 320 O ALA A 20 20.023 -2.377 -5.341 1.00 0.00 O ATOM 321 CB ALA A 20 21.610 -4.489 -3.359 1.00 0.00 C ATOM 0 H ALA A 20 22.331 -6.029 -5.135 1.00 0.00 H new ATOM 0 HA ALA A 20 19.900 -4.779 -4.611 1.00 0.00 H new ATOM 0 HB1 ALA A 20 21.126 -3.742 -2.730 1.00 0.00 H new ATOM 0 HB2 ALA A 20 21.513 -5.471 -2.896 1.00 0.00 H new ATOM 0 HB3 ALA A 20 22.666 -4.242 -3.468 1.00 0.00 H new ATOM 327 N ALA A 21 22.158 -2.778 -5.926 1.00 0.00 N ATOM 328 CA ALA A 21 22.341 -1.481 -6.567 1.00 0.00 C ATOM 329 C ALA A 21 21.258 -1.227 -7.610 1.00 0.00 C ATOM 330 O ALA A 21 20.699 -0.133 -7.684 1.00 0.00 O ATOM 331 CB ALA A 21 23.720 -1.397 -7.203 1.00 0.00 C ATOM 0 H ALA A 21 22.980 -3.381 -5.951 1.00 0.00 H new ATOM 0 HA ALA A 21 22.259 -0.710 -5.801 1.00 0.00 H new ATOM 0 HB1 ALA A 21 23.843 -0.424 -7.678 1.00 0.00 H new ATOM 0 HB2 ALA A 21 24.483 -1.525 -6.435 1.00 0.00 H new ATOM 0 HB3 ALA A 21 23.824 -2.182 -7.952 1.00 0.00 H new ATOM 337 N ILE A 22 20.969 -2.244 -8.415 1.00 0.00 N ATOM 338 CA ILE A 22 19.953 -2.130 -9.454 1.00 0.00 C ATOM 339 C ILE A 22 18.559 -2.004 -8.848 1.00 0.00 C ATOM 340 O ILE A 22 17.788 -1.117 -9.217 1.00 0.00 O ATOM 341 CB ILE A 22 19.980 -3.342 -10.403 1.00 0.00 C ATOM 342 CG1 ILE A 22 21.350 -3.462 -11.074 1.00 0.00 C ATOM 343 CG2 ILE A 22 18.881 -3.221 -11.449 1.00 0.00 C ATOM 344 CD1 ILE A 22 21.724 -4.883 -11.436 1.00 0.00 C ATOM 0 H ILE A 22 21.424 -3.156 -8.368 1.00 0.00 H new ATOM 0 HA ILE A 22 20.183 -1.229 -10.022 1.00 0.00 H new ATOM 0 HB ILE A 22 19.802 -4.245 -9.819 1.00 0.00 H new ATOM 0 HG12 ILE A 22 21.358 -2.852 -11.977 1.00 0.00 H new ATOM 0 HG13 ILE A 22 22.109 -3.054 -10.407 1.00 0.00 H new ATOM 0 HG21 ILE A 22 18.913 -4.085 -12.112 1.00 0.00 H new ATOM 0 HG22 ILE A 22 17.911 -3.179 -10.954 1.00 0.00 H new ATOM 0 HG23 ILE A 22 19.031 -2.311 -12.031 1.00 0.00 H new ATOM 0 HD11 ILE A 22 22.707 -4.892 -11.907 1.00 0.00 H new ATOM 0 HD12 ILE A 22 21.749 -5.494 -10.534 1.00 0.00 H new ATOM 0 HD13 ILE A 22 20.986 -5.288 -12.128 1.00 0.00 H new ATOM 356 N LEU A 23 18.242 -2.896 -7.916 1.00 0.00 N ATOM 357 CA LEU A 23 16.941 -2.884 -7.257 1.00 0.00 C ATOM 358 C LEU A 23 16.641 -1.508 -6.670 1.00 0.00 C ATOM 359 O LEU A 23 15.506 -1.033 -6.725 1.00 0.00 O ATOM 360 CB LEU A 23 16.897 -3.942 -6.153 1.00 0.00 C ATOM 361 CG LEU A 23 15.987 -5.144 -6.412 1.00 0.00 C ATOM 362 CD1 LEU A 23 14.534 -4.704 -6.498 1.00 0.00 C ATOM 363 CD2 LEU A 23 16.404 -5.864 -7.685 1.00 0.00 C ATOM 0 H LEU A 23 18.868 -3.637 -7.600 1.00 0.00 H new ATOM 0 HA LEU A 23 16.181 -3.114 -8.003 1.00 0.00 H new ATOM 0 HB2 LEU A 23 17.910 -4.308 -5.987 1.00 0.00 H new ATOM 0 HB3 LEU A 23 16.576 -3.461 -5.229 1.00 0.00 H new ATOM 0 HG LEU A 23 16.087 -5.838 -5.577 1.00 0.00 H new ATOM 0 HD11 LEU A 23 13.901 -5.572 -6.683 1.00 0.00 H new ATOM 0 HD12 LEU A 23 14.240 -4.234 -5.560 1.00 0.00 H new ATOM 0 HD13 LEU A 23 14.418 -3.990 -7.314 1.00 0.00 H new ATOM 0 HD21 LEU A 23 15.746 -6.716 -7.853 1.00 0.00 H new ATOM 0 HD22 LEU A 23 16.334 -5.179 -8.530 1.00 0.00 H new ATOM 0 HD23 LEU A 23 17.432 -6.214 -7.585 1.00 0.00 H new ATOM 375 N ILE A 24 17.665 -0.873 -6.111 1.00 0.00 N ATOM 376 CA ILE A 24 17.511 0.450 -5.517 1.00 0.00 C ATOM 377 C ILE A 24 17.062 1.470 -6.558 1.00 0.00 C ATOM 378 O ILE A 24 16.192 2.300 -6.295 1.00 0.00 O ATOM 379 CB ILE A 24 18.823 0.933 -4.872 1.00 0.00 C ATOM 380 CG1 ILE A 24 19.247 -0.018 -3.751 1.00 0.00 C ATOM 381 CG2 ILE A 24 18.660 2.349 -4.338 1.00 0.00 C ATOM 382 CD1 ILE A 24 20.746 -0.165 -3.619 1.00 0.00 C ATOM 0 H ILE A 24 18.610 -1.253 -6.057 1.00 0.00 H new ATOM 0 HA ILE A 24 16.747 0.363 -4.744 1.00 0.00 H new ATOM 0 HB ILE A 24 19.604 0.939 -5.633 1.00 0.00 H new ATOM 0 HG12 ILE A 24 18.841 0.343 -2.806 1.00 0.00 H new ATOM 0 HG13 ILE A 24 18.808 -0.999 -3.932 1.00 0.00 H new ATOM 0 HG21 ILE A 24 19.596 2.677 -3.885 1.00 0.00 H new ATOM 0 HG22 ILE A 24 18.399 3.019 -5.157 1.00 0.00 H new ATOM 0 HG23 ILE A 24 17.868 2.366 -3.589 1.00 0.00 H new ATOM 0 HD11 ILE A 24 20.974 -0.853 -2.805 1.00 0.00 H new ATOM 0 HD12 ILE A 24 21.157 -0.555 -4.550 1.00 0.00 H new ATOM 0 HD13 ILE A 24 21.190 0.808 -3.406 1.00 0.00 H new ATOM 394 N LYS A 25 17.662 1.402 -7.741 1.00 0.00 N ATOM 395 CA LYS A 25 17.323 2.318 -8.825 1.00 0.00 C ATOM 396 C LYS A 25 15.891 2.092 -9.300 1.00 0.00 C ATOM 397 O LYS A 25 15.153 3.045 -9.551 1.00 0.00 O ATOM 398 CB LYS A 25 18.294 2.139 -9.994 1.00 0.00 C ATOM 399 CG LYS A 25 19.752 2.312 -9.605 1.00 0.00 C ATOM 400 CD LYS A 25 20.245 3.718 -9.904 1.00 0.00 C ATOM 401 CE LYS A 25 19.478 4.760 -9.104 1.00 0.00 C ATOM 402 NZ LYS A 25 20.309 5.963 -8.819 1.00 0.00 N ATOM 0 H LYS A 25 18.386 0.722 -7.974 1.00 0.00 H new ATOM 0 HA LYS A 25 17.405 3.337 -8.446 1.00 0.00 H new ATOM 0 HB2 LYS A 25 18.156 1.146 -10.421 1.00 0.00 H new ATOM 0 HB3 LYS A 25 18.047 2.859 -10.774 1.00 0.00 H new ATOM 0 HG2 LYS A 25 19.874 2.101 -8.543 1.00 0.00 H new ATOM 0 HG3 LYS A 25 20.362 1.589 -10.146 1.00 0.00 H new ATOM 0 HD2 LYS A 25 21.308 3.789 -9.672 1.00 0.00 H new ATOM 0 HD3 LYS A 25 20.137 3.924 -10.969 1.00 0.00 H new ATOM 0 HE2 LYS A 25 18.586 5.057 -9.656 1.00 0.00 H new ATOM 0 HE3 LYS A 25 19.141 4.321 -8.165 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 19.750 6.649 -8.272 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 21.147 5.684 -8.271 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 20.610 6.397 -9.715 1.00 0.00 H new ATOM 416 N VAL A 26 15.505 0.826 -9.421 1.00 0.00 N ATOM 417 CA VAL A 26 14.161 0.476 -9.863 1.00 0.00 C ATOM 418 C VAL A 26 13.112 0.947 -8.862 1.00 0.00 C ATOM 419 O VAL A 26 12.051 1.440 -9.243 1.00 0.00 O ATOM 420 CB VAL A 26 14.015 -1.044 -10.067 1.00 0.00 C ATOM 421 CG1 VAL A 26 12.695 -1.367 -10.751 1.00 0.00 C ATOM 422 CG2 VAL A 26 15.188 -1.589 -10.867 1.00 0.00 C ATOM 0 H VAL A 26 16.104 0.026 -9.219 1.00 0.00 H new ATOM 0 HA VAL A 26 14.001 0.980 -10.816 1.00 0.00 H new ATOM 0 HB VAL A 26 14.017 -1.526 -9.089 1.00 0.00 H new ATOM 0 HG11 VAL A 26 12.610 -2.445 -10.887 1.00 0.00 H new ATOM 0 HG12 VAL A 26 11.869 -1.012 -10.134 1.00 0.00 H new ATOM 0 HG13 VAL A 26 12.659 -0.875 -11.723 1.00 0.00 H new ATOM 0 HG21 VAL A 26 15.068 -2.664 -11.002 1.00 0.00 H new ATOM 0 HG22 VAL A 26 15.221 -1.103 -11.842 1.00 0.00 H new ATOM 0 HG23 VAL A 26 16.117 -1.391 -10.332 1.00 0.00 H new ATOM 432 N PHE A 27 13.417 0.791 -7.578 1.00 0.00 N ATOM 433 CA PHE A 27 12.500 1.200 -6.519 1.00 0.00 C ATOM 434 C PHE A 27 12.340 2.717 -6.495 1.00 0.00 C ATOM 435 O PHE A 27 11.234 3.233 -6.337 1.00 0.00 O ATOM 436 CB PHE A 27 13.003 0.707 -5.161 1.00 0.00 C ATOM 437 CG PHE A 27 12.478 -0.648 -4.783 1.00 0.00 C ATOM 438 CD1 PHE A 27 11.114 -0.881 -4.708 1.00 0.00 C ATOM 439 CD2 PHE A 27 13.348 -1.690 -4.503 1.00 0.00 C ATOM 440 CE1 PHE A 27 10.627 -2.127 -4.361 1.00 0.00 C ATOM 441 CE2 PHE A 27 12.867 -2.938 -4.156 1.00 0.00 C ATOM 442 CZ PHE A 27 11.505 -3.157 -4.084 1.00 0.00 C ATOM 0 H PHE A 27 14.291 0.385 -7.245 1.00 0.00 H new ATOM 0 HA PHE A 27 11.527 0.753 -6.722 1.00 0.00 H new ATOM 0 HB2 PHE A 27 14.092 0.674 -5.176 1.00 0.00 H new ATOM 0 HB3 PHE A 27 12.716 1.426 -4.394 1.00 0.00 H new ATOM 0 HD1 PHE A 27 10.423 -0.079 -4.923 1.00 0.00 H new ATOM 0 HD2 PHE A 27 14.414 -1.525 -4.557 1.00 0.00 H new ATOM 0 HE1 PHE A 27 9.562 -2.295 -4.306 1.00 0.00 H new ATOM 0 HE2 PHE A 27 13.556 -3.742 -3.941 1.00 0.00 H new ATOM 0 HZ PHE A 27 11.127 -4.131 -3.812 1.00 0.00 H new ATOM 452 N ALA A 28 13.453 3.426 -6.651 1.00 0.00 N ATOM 453 CA ALA A 28 13.437 4.884 -6.649 1.00 0.00 C ATOM 454 C ALA A 28 12.608 5.426 -7.808 1.00 0.00 C ATOM 455 O ALA A 28 11.792 6.330 -7.630 1.00 0.00 O ATOM 456 CB ALA A 28 14.856 5.428 -6.713 1.00 0.00 C ATOM 0 H ALA A 28 14.377 3.015 -6.780 1.00 0.00 H new ATOM 0 HA ALA A 28 12.974 5.216 -5.720 1.00 0.00 H new ATOM 0 HB1 ALA A 28 14.828 6.518 -6.711 1.00 0.00 H new ATOM 0 HB2 ALA A 28 15.419 5.078 -5.848 1.00 0.00 H new ATOM 0 HB3 ALA A 28 15.339 5.079 -7.626 1.00 0.00 H new ATOM 462 N GLU A 29 12.823 4.868 -8.995 1.00 0.00 N ATOM 463 CA GLU A 29 12.096 5.297 -10.184 1.00 0.00 C ATOM 464 C GLU A 29 10.627 4.892 -10.099 1.00 0.00 C ATOM 465 O GLU A 29 9.779 5.438 -10.807 1.00 0.00 O ATOM 466 CB GLU A 29 12.730 4.698 -11.441 1.00 0.00 C ATOM 467 CG GLU A 29 12.179 3.331 -11.809 1.00 0.00 C ATOM 468 CD GLU A 29 11.114 3.401 -12.886 1.00 0.00 C ATOM 469 OE1 GLU A 29 11.478 3.513 -14.075 1.00 0.00 O ATOM 470 OE2 GLU A 29 9.915 3.345 -12.539 1.00 0.00 O ATOM 0 H GLU A 29 13.495 4.118 -9.159 1.00 0.00 H new ATOM 0 HA GLU A 29 12.153 6.384 -10.241 1.00 0.00 H new ATOM 0 HB2 GLU A 29 12.574 5.380 -12.277 1.00 0.00 H new ATOM 0 HB3 GLU A 29 13.807 4.618 -11.292 1.00 0.00 H new ATOM 0 HG2 GLU A 29 12.995 2.695 -12.151 1.00 0.00 H new ATOM 0 HG3 GLU A 29 11.760 2.861 -10.919 1.00 0.00 H new ATOM 477 N LEU A 30 10.334 3.932 -9.229 1.00 0.00 N ATOM 478 CA LEU A 30 8.968 3.453 -9.052 1.00 0.00 C ATOM 479 C LEU A 30 8.241 4.263 -7.983 1.00 0.00 C ATOM 480 O LEU A 30 7.035 4.114 -7.790 1.00 0.00 O ATOM 481 CB LEU A 30 8.972 1.971 -8.670 1.00 0.00 C ATOM 482 CG LEU A 30 9.246 0.986 -9.806 1.00 0.00 C ATOM 483 CD1 LEU A 30 9.758 -0.336 -9.255 1.00 0.00 C ATOM 484 CD2 LEU A 30 7.990 0.768 -10.638 1.00 0.00 C ATOM 0 H LEU A 30 11.023 3.470 -8.636 1.00 0.00 H new ATOM 0 HA LEU A 30 8.440 3.577 -9.998 1.00 0.00 H new ATOM 0 HB2 LEU A 30 9.723 1.818 -7.895 1.00 0.00 H new ATOM 0 HB3 LEU A 30 8.005 1.727 -8.230 1.00 0.00 H new ATOM 0 HG LEU A 30 10.016 1.410 -10.451 1.00 0.00 H new ATOM 0 HD11 LEU A 30 9.947 -1.024 -10.079 1.00 0.00 H new ATOM 0 HD12 LEU A 30 10.683 -0.167 -8.704 1.00 0.00 H new ATOM 0 HD13 LEU A 30 9.011 -0.766 -8.587 1.00 0.00 H new ATOM 0 HD21 LEU A 30 8.204 0.064 -11.442 1.00 0.00 H new ATOM 0 HD22 LEU A 30 7.199 0.366 -10.005 1.00 0.00 H new ATOM 0 HD23 LEU A 30 7.666 1.718 -11.064 1.00 0.00 H new ATOM 496 N GLY A 31 8.983 5.123 -7.292 1.00 0.00 N ATOM 497 CA GLY A 31 8.392 5.945 -6.253 1.00 0.00 C ATOM 498 C GLY A 31 8.565 5.347 -4.871 1.00 0.00 C ATOM 499 O GLY A 31 8.002 5.845 -3.896 1.00 0.00 O ATOM 0 H GLY A 31 9.983 5.265 -7.434 1.00 0.00 H new ATOM 0 HA2 GLY A 31 8.846 6.936 -6.276 1.00 0.00 H new ATOM 0 HA3 GLY A 31 7.330 6.076 -6.458 1.00 0.00 H new ATOM 503 N TYR A 32 9.344 4.274 -4.786 1.00 0.00 N ATOM 504 CA TYR A 32 9.586 3.605 -3.514 1.00 0.00 C ATOM 505 C TYR A 32 10.866 4.119 -2.861 1.00 0.00 C ATOM 506 O TYR A 32 11.596 3.365 -2.221 1.00 0.00 O ATOM 507 CB TYR A 32 9.678 2.092 -3.719 1.00 0.00 C ATOM 508 CG TYR A 32 8.388 1.466 -4.200 1.00 0.00 C ATOM 509 CD1 TYR A 32 7.926 1.686 -5.492 1.00 0.00 C ATOM 510 CD2 TYR A 32 7.633 0.655 -3.363 1.00 0.00 C ATOM 511 CE1 TYR A 32 6.747 1.117 -5.935 1.00 0.00 C ATOM 512 CE2 TYR A 32 6.454 0.081 -3.798 1.00 0.00 C ATOM 513 CZ TYR A 32 6.015 0.315 -5.084 1.00 0.00 C ATOM 514 OH TYR A 32 4.842 -0.255 -5.522 1.00 0.00 O ATOM 0 H TYR A 32 9.818 3.849 -5.583 1.00 0.00 H new ATOM 0 HA TYR A 32 8.748 3.826 -2.852 1.00 0.00 H new ATOM 0 HB2 TYR A 32 10.467 1.879 -4.441 1.00 0.00 H new ATOM 0 HB3 TYR A 32 9.971 1.624 -2.779 1.00 0.00 H new ATOM 0 HD1 TYR A 32 8.498 2.312 -6.161 1.00 0.00 H new ATOM 0 HD2 TYR A 32 7.973 0.470 -2.355 1.00 0.00 H new ATOM 0 HE1 TYR A 32 6.401 1.299 -6.942 1.00 0.00 H new ATOM 0 HE2 TYR A 32 5.879 -0.548 -3.134 1.00 0.00 H new ATOM 0 HH TYR A 32 4.450 -0.791 -4.801 1.00 0.00 H new ATOM 524 N ASN A 33 11.129 5.411 -3.030 1.00 0.00 N ATOM 525 CA ASN A 33 12.320 6.029 -2.458 1.00 0.00 C ATOM 526 C ASN A 33 12.455 5.683 -0.978 1.00 0.00 C ATOM 527 O ASN A 33 11.488 5.279 -0.334 1.00 0.00 O ATOM 528 CB ASN A 33 12.268 7.548 -2.635 1.00 0.00 C ATOM 529 CG ASN A 33 13.635 8.146 -2.902 1.00 0.00 C ATOM 530 OD1 ASN A 33 14.398 8.376 -1.840 1.00 0.00 O flip ATOM 531 ND2 ASN A 33 14.001 8.399 -4.050 1.00 0.00 N flip ATOM 0 H ASN A 33 10.534 6.050 -3.558 1.00 0.00 H new ATOM 0 HA ASN A 33 13.190 5.638 -2.986 1.00 0.00 H new ATOM 0 HB2 ASN A 33 11.600 7.792 -3.461 1.00 0.00 H new ATOM 0 HB3 ASN A 33 11.845 8.001 -1.738 1.00 0.00 H new ATOM 0 HD21 ASN A 33 13.382 8.206 -4.837 1.00 0.00 H new ATOM 0 HD22 ASN A 33 14.924 8.802 -4.214 1.00 0.00 H new ATOM 538 N ASP A 34 13.662 5.846 -0.446 1.00 0.00 N ATOM 539 CA ASP A 34 13.924 5.552 0.959 1.00 0.00 C ATOM 540 C ASP A 34 13.838 4.053 1.226 1.00 0.00 C ATOM 541 O ASP A 34 12.989 3.597 1.992 1.00 0.00 O ATOM 542 CB ASP A 34 12.932 6.300 1.851 1.00 0.00 C ATOM 543 CG ASP A 34 13.509 6.620 3.216 1.00 0.00 C ATOM 544 OD1 ASP A 34 13.436 5.752 4.111 1.00 0.00 O ATOM 545 OD2 ASP A 34 14.036 7.739 3.389 1.00 0.00 O ATOM 0 H ASP A 34 14.474 6.180 -0.966 1.00 0.00 H new ATOM 0 HA ASP A 34 14.935 5.886 1.193 1.00 0.00 H new ATOM 0 HB2 ASP A 34 12.633 7.226 1.360 1.00 0.00 H new ATOM 0 HB3 ASP A 34 12.031 5.698 1.972 1.00 0.00 H new ATOM 550 N ILE A 35 14.721 3.292 0.588 1.00 0.00 N ATOM 551 CA ILE A 35 14.745 1.845 0.758 1.00 0.00 C ATOM 552 C ILE A 35 15.681 1.439 1.890 1.00 0.00 C ATOM 553 O ILE A 35 16.680 2.107 2.153 1.00 0.00 O ATOM 554 CB ILE A 35 15.183 1.133 -0.536 1.00 0.00 C ATOM 555 CG1 ILE A 35 14.079 0.195 -1.028 1.00 0.00 C ATOM 556 CG2 ILE A 35 16.476 0.365 -0.306 1.00 0.00 C ATOM 557 CD1 ILE A 35 13.002 0.895 -1.826 1.00 0.00 C ATOM 0 H ILE A 35 15.429 3.654 -0.051 1.00 0.00 H new ATOM 0 HA ILE A 35 13.728 1.540 1.005 1.00 0.00 H new ATOM 0 HB ILE A 35 15.362 1.885 -1.304 1.00 0.00 H new ATOM 0 HG12 ILE A 35 14.525 -0.587 -1.643 1.00 0.00 H new ATOM 0 HG13 ILE A 35 13.622 -0.297 -0.169 1.00 0.00 H new ATOM 0 HG21 ILE A 35 16.773 -0.133 -1.229 1.00 0.00 H new ATOM 0 HG22 ILE A 35 17.260 1.057 0.002 1.00 0.00 H new ATOM 0 HG23 ILE A 35 16.323 -0.380 0.475 1.00 0.00 H new ATOM 0 HD11 ILE A 35 12.253 0.169 -2.142 1.00 0.00 H new ATOM 0 HD12 ILE A 35 12.529 1.658 -1.208 1.00 0.00 H new ATOM 0 HD13 ILE A 35 13.446 1.363 -2.704 1.00 0.00 H new ATOM 569 N ASN A 36 15.352 0.337 2.557 1.00 0.00 N ATOM 570 CA ASN A 36 16.165 -0.160 3.662 1.00 0.00 C ATOM 571 C ASN A 36 16.569 -1.612 3.429 1.00 0.00 C ATOM 572 O ASN A 36 15.719 -2.482 3.242 1.00 0.00 O ATOM 573 CB ASN A 36 15.400 -0.036 4.981 1.00 0.00 C ATOM 574 CG ASN A 36 15.664 1.282 5.681 1.00 0.00 C ATOM 575 OD1 ASN A 36 15.325 2.349 5.169 1.00 0.00 O ATOM 576 ND2 ASN A 36 16.272 1.214 6.860 1.00 0.00 N ATOM 0 H ASN A 36 14.528 -0.229 2.352 1.00 0.00 H new ATOM 0 HA ASN A 36 17.070 0.446 3.717 1.00 0.00 H new ATOM 0 HB2 ASN A 36 14.332 -0.134 4.789 1.00 0.00 H new ATOM 0 HB3 ASN A 36 15.682 -0.857 5.640 1.00 0.00 H new ATOM 0 HD21 ASN A 36 16.476 2.068 7.379 1.00 0.00 H new ATOM 0 HD22 ASN A 36 16.535 0.308 7.247 1.00 0.00 H new ATOM 583 N VAL A 37 17.874 -1.867 3.443 1.00 0.00 N ATOM 584 CA VAL A 37 18.392 -3.214 3.236 1.00 0.00 C ATOM 585 C VAL A 37 18.747 -3.876 4.562 1.00 0.00 C ATOM 586 O VAL A 37 19.356 -3.257 5.435 1.00 0.00 O ATOM 587 CB VAL A 37 19.638 -3.203 2.330 1.00 0.00 C ATOM 588 CG1 VAL A 37 20.803 -2.524 3.033 1.00 0.00 C ATOM 589 CG2 VAL A 37 20.007 -4.619 1.915 1.00 0.00 C ATOM 0 H VAL A 37 18.591 -1.158 3.596 1.00 0.00 H new ATOM 0 HA VAL A 37 17.602 -3.785 2.748 1.00 0.00 H new ATOM 0 HB VAL A 37 19.406 -2.634 1.430 1.00 0.00 H new ATOM 0 HG11 VAL A 37 21.674 -2.526 2.378 1.00 0.00 H new ATOM 0 HG12 VAL A 37 20.533 -1.496 3.275 1.00 0.00 H new ATOM 0 HG13 VAL A 37 21.038 -3.063 3.951 1.00 0.00 H new ATOM 0 HG21 VAL A 37 20.889 -4.592 1.275 1.00 0.00 H new ATOM 0 HG22 VAL A 37 20.220 -5.214 2.803 1.00 0.00 H new ATOM 0 HG23 VAL A 37 19.176 -5.066 1.369 1.00 0.00 H new ATOM 599 N THR A 38 18.363 -5.141 4.707 1.00 0.00 N ATOM 600 CA THR A 38 18.640 -5.888 5.928 1.00 0.00 C ATOM 601 C THR A 38 19.259 -7.245 5.612 1.00 0.00 C ATOM 602 O THR A 38 18.613 -8.110 5.020 1.00 0.00 O ATOM 603 CB THR A 38 17.361 -6.101 6.759 1.00 0.00 C ATOM 604 OG1 THR A 38 16.289 -6.522 5.909 1.00 0.00 O ATOM 605 CG2 THR A 38 16.968 -4.822 7.484 1.00 0.00 C ATOM 0 H THR A 38 17.860 -5.669 3.994 1.00 0.00 H new ATOM 0 HA THR A 38 19.346 -5.295 6.509 1.00 0.00 H new ATOM 0 HB THR A 38 17.561 -6.874 7.501 1.00 0.00 H new ATOM 0 HG1 THR A 38 16.612 -7.213 5.294 1.00 0.00 H new ATOM 0 HG21 THR A 38 16.062 -4.996 8.064 1.00 0.00 H new ATOM 0 HG22 THR A 38 17.774 -4.520 8.152 1.00 0.00 H new ATOM 0 HG23 THR A 38 16.786 -4.032 6.755 1.00 0.00 H new ATOM 613 N TRP A 39 20.512 -7.426 6.013 1.00 0.00 N ATOM 614 CA TRP A 39 21.218 -8.679 5.773 1.00 0.00 C ATOM 615 C TRP A 39 21.385 -9.467 7.068 1.00 0.00 C ATOM 616 O TRP A 39 21.634 -8.891 8.127 1.00 0.00 O ATOM 617 CB TRP A 39 22.587 -8.406 5.148 1.00 0.00 C ATOM 618 CG TRP A 39 23.507 -7.635 6.045 1.00 0.00 C ATOM 619 CD1 TRP A 39 23.645 -6.277 6.106 1.00 0.00 C ATOM 620 CD2 TRP A 39 24.417 -8.176 7.009 1.00 0.00 C ATOM 621 NE1 TRP A 39 24.586 -5.942 7.049 1.00 0.00 N ATOM 622 CE2 TRP A 39 25.074 -7.089 7.618 1.00 0.00 C ATOM 623 CE3 TRP A 39 24.739 -9.473 7.418 1.00 0.00 C ATOM 624 CZ2 TRP A 39 26.034 -7.261 8.611 1.00 0.00 C ATOM 625 CZ3 TRP A 39 25.692 -9.642 8.405 1.00 0.00 C ATOM 626 CH2 TRP A 39 26.330 -8.542 8.993 1.00 0.00 C ATOM 0 H TRP A 39 21.060 -6.721 6.506 1.00 0.00 H new ATOM 0 HA TRP A 39 20.623 -9.275 5.081 1.00 0.00 H new ATOM 0 HB2 TRP A 39 23.056 -9.355 4.889 1.00 0.00 H new ATOM 0 HB3 TRP A 39 22.450 -7.853 4.218 1.00 0.00 H new ATOM 0 HD1 TRP A 39 23.095 -5.571 5.502 1.00 0.00 H new ATOM 0 HE1 TRP A 39 24.875 -4.993 7.287 1.00 0.00 H new ATOM 0 HE3 TRP A 39 24.252 -10.327 6.971 1.00 0.00 H new ATOM 0 HZ2 TRP A 39 26.528 -6.414 9.064 1.00 0.00 H new ATOM 0 HZ3 TRP A 39 25.949 -10.640 8.729 1.00 0.00 H new ATOM 0 HH2 TRP A 39 27.070 -8.708 9.762 1.00 0.00 H new ATOM 668 N THR A 43 22.310 -13.628 3.556 1.00 0.00 N ATOM 669 CA THR A 43 21.162 -13.296 2.722 1.00 0.00 C ATOM 670 C THR A 43 20.808 -11.818 2.836 1.00 0.00 C ATOM 671 O THR A 43 20.712 -11.275 3.936 1.00 0.00 O ATOM 672 CB THR A 43 19.929 -14.139 3.102 1.00 0.00 C ATOM 673 OG1 THR A 43 20.344 -15.405 3.625 1.00 0.00 O ATOM 674 CG2 THR A 43 19.027 -14.352 1.897 1.00 0.00 C ATOM 0 HA THR A 43 21.444 -13.520 1.693 1.00 0.00 H new ATOM 0 HB THR A 43 19.367 -13.599 3.864 1.00 0.00 H new ATOM 0 HG1 THR A 43 21.267 -15.339 3.947 1.00 0.00 H new ATOM 0 HG21 THR A 43 18.164 -14.950 2.190 1.00 0.00 H new ATOM 0 HG22 THR A 43 18.689 -13.387 1.520 1.00 0.00 H new ATOM 0 HG23 THR A 43 19.581 -14.873 1.116 1.00 0.00 H new ATOM 682 N VAL A 44 20.615 -11.171 1.691 1.00 0.00 N ATOM 683 CA VAL A 44 20.269 -9.755 1.662 1.00 0.00 C ATOM 684 C VAL A 44 18.843 -9.547 1.167 1.00 0.00 C ATOM 685 O VAL A 44 18.447 -10.085 0.132 1.00 0.00 O ATOM 686 CB VAL A 44 21.234 -8.960 0.763 1.00 0.00 C ATOM 687 CG1 VAL A 44 22.571 -8.759 1.459 1.00 0.00 C ATOM 688 CG2 VAL A 44 21.419 -9.664 -0.573 1.00 0.00 C ATOM 0 H VAL A 44 20.692 -11.605 0.771 1.00 0.00 H new ATOM 0 HA VAL A 44 20.352 -9.388 2.685 1.00 0.00 H new ATOM 0 HB VAL A 44 20.800 -7.978 0.574 1.00 0.00 H new ATOM 0 HG11 VAL A 44 23.239 -8.195 0.808 1.00 0.00 H new ATOM 0 HG12 VAL A 44 22.419 -8.208 2.387 1.00 0.00 H new ATOM 0 HG13 VAL A 44 23.015 -9.729 1.682 1.00 0.00 H new ATOM 0 HG21 VAL A 44 22.104 -9.088 -1.196 1.00 0.00 H new ATOM 0 HG22 VAL A 44 21.830 -10.660 -0.406 1.00 0.00 H new ATOM 0 HG23 VAL A 44 20.456 -9.749 -1.076 1.00 0.00 H new ATOM 698 N THR A 45 18.071 -8.761 1.913 1.00 0.00 N ATOM 699 CA THR A 45 16.688 -8.482 1.551 1.00 0.00 C ATOM 700 C THR A 45 16.405 -6.984 1.573 1.00 0.00 C ATOM 701 O THR A 45 16.648 -6.311 2.575 1.00 0.00 O ATOM 702 CB THR A 45 15.704 -9.193 2.499 1.00 0.00 C ATOM 703 OG1 THR A 45 16.096 -10.559 2.678 1.00 0.00 O ATOM 704 CG2 THR A 45 14.286 -9.135 1.952 1.00 0.00 C ATOM 0 H THR A 45 18.382 -8.307 2.772 1.00 0.00 H new ATOM 0 HA THR A 45 16.544 -8.861 0.539 1.00 0.00 H new ATOM 0 HB THR A 45 15.726 -8.680 3.460 1.00 0.00 H new ATOM 0 HG1 THR A 45 15.466 -11.003 3.283 1.00 0.00 H new ATOM 0 HG21 THR A 45 13.610 -9.644 2.639 1.00 0.00 H new ATOM 0 HG22 THR A 45 13.979 -8.094 1.845 1.00 0.00 H new ATOM 0 HG23 THR A 45 14.251 -9.625 0.979 1.00 0.00 H new ATOM 712 N VAL A 46 15.888 -6.468 0.463 1.00 0.00 N ATOM 713 CA VAL A 46 15.570 -5.049 0.356 1.00 0.00 C ATOM 714 C VAL A 46 14.135 -4.773 0.788 1.00 0.00 C ATOM 715 O VAL A 46 13.220 -5.525 0.453 1.00 0.00 O ATOM 716 CB VAL A 46 15.769 -4.536 -1.083 1.00 0.00 C ATOM 717 CG1 VAL A 46 14.695 -5.095 -2.002 1.00 0.00 C ATOM 718 CG2 VAL A 46 15.768 -3.015 -1.111 1.00 0.00 C ATOM 0 H VAL A 46 15.680 -7.011 -0.375 1.00 0.00 H new ATOM 0 HA VAL A 46 16.254 -4.521 1.020 1.00 0.00 H new ATOM 0 HB VAL A 46 16.738 -4.882 -1.443 1.00 0.00 H new ATOM 0 HG11 VAL A 46 14.852 -4.722 -3.014 1.00 0.00 H new ATOM 0 HG12 VAL A 46 14.749 -6.184 -2.004 1.00 0.00 H new ATOM 0 HG13 VAL A 46 13.713 -4.781 -1.648 1.00 0.00 H new ATOM 0 HG21 VAL A 46 15.910 -2.670 -2.135 1.00 0.00 H new ATOM 0 HG22 VAL A 46 14.816 -2.645 -0.732 1.00 0.00 H new ATOM 0 HG23 VAL A 46 16.578 -2.639 -0.486 1.00 0.00 H new ATOM 728 N GLU A 47 13.944 -3.689 1.534 1.00 0.00 N ATOM 729 CA GLU A 47 12.619 -3.315 2.012 1.00 0.00 C ATOM 730 C GLU A 47 12.269 -1.892 1.587 1.00 0.00 C ATOM 731 O GLU A 47 12.972 -0.941 1.924 1.00 0.00 O ATOM 732 CB GLU A 47 12.550 -3.435 3.536 1.00 0.00 C ATOM 733 CG GLU A 47 11.983 -4.760 4.017 1.00 0.00 C ATOM 734 CD GLU A 47 11.938 -4.861 5.530 1.00 0.00 C ATOM 735 OE1 GLU A 47 12.824 -4.277 6.189 1.00 0.00 O ATOM 736 OE2 GLU A 47 11.019 -5.523 6.054 1.00 0.00 O ATOM 0 H GLU A 47 14.690 -3.055 1.820 1.00 0.00 H new ATOM 0 HA GLU A 47 11.894 -3.997 1.567 1.00 0.00 H new ATOM 0 HB2 GLU A 47 13.551 -3.307 3.948 1.00 0.00 H new ATOM 0 HB3 GLU A 47 11.938 -2.623 3.929 1.00 0.00 H new ATOM 0 HG2 GLU A 47 10.977 -4.886 3.618 1.00 0.00 H new ATOM 0 HG3 GLU A 47 12.588 -5.575 3.620 1.00 0.00 H new ATOM 743 N GLY A 48 11.176 -1.755 0.842 1.00 0.00 N ATOM 744 CA GLY A 48 10.751 -0.446 0.381 1.00 0.00 C ATOM 745 C GLY A 48 9.294 -0.167 0.693 1.00 0.00 C ATOM 746 O GLY A 48 8.530 -1.084 0.990 1.00 0.00 O ATOM 0 H GLY A 48 10.577 -2.527 0.550 1.00 0.00 H new ATOM 0 HA2 GLY A 48 11.372 0.319 0.847 1.00 0.00 H new ATOM 0 HA3 GLY A 48 10.909 -0.374 -0.695 1.00 0.00 H new ATOM 750 N GLN A 49 8.909 1.104 0.625 1.00 0.00 N ATOM 751 CA GLN A 49 7.534 1.501 0.905 1.00 0.00 C ATOM 752 C GLN A 49 6.999 2.417 -0.191 1.00 0.00 C ATOM 753 O GLN A 49 7.768 3.017 -0.944 1.00 0.00 O ATOM 754 CB GLN A 49 7.450 2.203 2.261 1.00 0.00 C ATOM 755 CG GLN A 49 8.002 3.619 2.248 1.00 0.00 C ATOM 756 CD GLN A 49 9.047 3.848 3.322 1.00 0.00 C ATOM 757 OE1 GLN A 49 8.876 3.433 4.469 1.00 0.00 O ATOM 758 NE2 GLN A 49 10.137 4.512 2.956 1.00 0.00 N ATOM 0 H GLN A 49 9.529 1.875 0.379 1.00 0.00 H new ATOM 0 HA GLN A 49 6.920 0.601 0.932 1.00 0.00 H new ATOM 0 HB2 GLN A 49 6.409 2.231 2.583 1.00 0.00 H new ATOM 0 HB3 GLN A 49 7.996 1.616 2.999 1.00 0.00 H new ATOM 0 HG2 GLN A 49 8.439 3.825 1.271 1.00 0.00 H new ATOM 0 HG3 GLN A 49 7.183 4.325 2.386 1.00 0.00 H new ATOM 0 HE21 GLN A 49 10.237 4.838 1.995 1.00 0.00 H new ATOM 0 HE22 GLN A 49 10.874 4.696 3.636 1.00 0.00 H new ATOM 767 N LEU A 50 5.677 2.522 -0.274 1.00 0.00 N ATOM 768 CA LEU A 50 5.038 3.366 -1.278 1.00 0.00 C ATOM 769 C LEU A 50 4.098 4.373 -0.624 1.00 0.00 C ATOM 770 O LEU A 50 3.381 4.044 0.321 1.00 0.00 O ATOM 771 CB LEU A 50 4.266 2.505 -2.279 1.00 0.00 C ATOM 772 CG LEU A 50 4.417 2.890 -3.752 1.00 0.00 C ATOM 773 CD1 LEU A 50 3.427 2.117 -4.609 1.00 0.00 C ATOM 774 CD2 LEU A 50 4.225 4.389 -3.933 1.00 0.00 C ATOM 0 H LEU A 50 5.027 2.033 0.342 1.00 0.00 H new ATOM 0 HA LEU A 50 5.818 3.915 -1.806 1.00 0.00 H new ATOM 0 HB2 LEU A 50 4.586 1.470 -2.160 1.00 0.00 H new ATOM 0 HB3 LEU A 50 3.208 2.543 -2.021 1.00 0.00 H new ATOM 0 HG LEU A 50 5.425 2.631 -4.075 1.00 0.00 H new ATOM 0 HD11 LEU A 50 3.549 2.404 -5.654 1.00 0.00 H new ATOM 0 HD12 LEU A 50 3.611 1.048 -4.502 1.00 0.00 H new ATOM 0 HD13 LEU A 50 2.411 2.345 -4.286 1.00 0.00 H new ATOM 0 HD21 LEU A 50 4.336 4.645 -4.987 1.00 0.00 H new ATOM 0 HD22 LEU A 50 3.229 4.672 -3.594 1.00 0.00 H new ATOM 0 HD23 LEU A 50 4.973 4.925 -3.349 1.00 0.00 H new ATOM 910 N ARG B 3 24.431 -19.699 -9.841 1.00 0.00 N ATOM 911 CA ARG B 3 22.980 -19.601 -9.949 1.00 0.00 C ATOM 912 C ARG B 3 22.447 -18.460 -9.087 1.00 0.00 C ATOM 913 O ARG B 3 22.806 -18.332 -7.916 1.00 0.00 O ATOM 914 CB ARG B 3 22.326 -20.919 -9.531 1.00 0.00 C ATOM 915 CG ARG B 3 20.814 -20.834 -9.403 1.00 0.00 C ATOM 916 CD ARG B 3 20.383 -20.715 -7.949 1.00 0.00 C ATOM 917 NE ARG B 3 19.140 -21.434 -7.686 1.00 0.00 N ATOM 918 CZ ARG B 3 18.686 -21.695 -6.465 1.00 0.00 C ATOM 919 NH1 ARG B 3 19.370 -21.297 -5.401 1.00 0.00 N ATOM 920 NH2 ARG B 3 17.546 -22.354 -6.307 1.00 0.00 N ATOM 0 HA ARG B 3 22.731 -19.394 -10.990 1.00 0.00 H new ATOM 0 HB2 ARG B 3 22.578 -21.688 -10.262 1.00 0.00 H new ATOM 0 HB3 ARG B 3 22.746 -21.237 -8.577 1.00 0.00 H new ATOM 0 HG2 ARG B 3 20.448 -19.974 -9.963 1.00 0.00 H new ATOM 0 HG3 ARG B 3 20.360 -21.720 -9.847 1.00 0.00 H new ATOM 0 HD2 ARG B 3 21.171 -21.105 -7.304 1.00 0.00 H new ATOM 0 HD3 ARG B 3 20.254 -19.663 -7.694 1.00 0.00 H new ATOM 0 HE ARG B 3 18.590 -21.753 -8.483 1.00 0.00 H new ATOM 0 HH11 ARG B 3 20.247 -20.789 -5.519 1.00 0.00 H new ATOM 0 HH12 ARG B 3 19.019 -21.499 -4.465 1.00 0.00 H new ATOM 0 HH21 ARG B 3 17.017 -22.661 -7.123 1.00 0.00 H new ATOM 0 HH22 ARG B 3 17.198 -22.554 -5.369 1.00 0.00 H new ATOM 934 N VAL B 4 21.589 -17.632 -9.675 1.00 0.00 N ATOM 935 CA VAL B 4 21.006 -16.502 -8.961 1.00 0.00 C ATOM 936 C VAL B 4 19.493 -16.649 -8.841 1.00 0.00 C ATOM 937 O VAL B 4 18.801 -16.878 -9.834 1.00 0.00 O ATOM 938 CB VAL B 4 21.327 -15.169 -9.663 1.00 0.00 C ATOM 939 CG1 VAL B 4 20.695 -14.006 -8.914 1.00 0.00 C ATOM 940 CG2 VAL B 4 22.832 -14.981 -9.785 1.00 0.00 C ATOM 0 H VAL B 4 21.282 -17.723 -10.644 1.00 0.00 H new ATOM 0 HA VAL B 4 21.448 -16.495 -7.964 1.00 0.00 H new ATOM 0 HB VAL B 4 20.904 -15.195 -10.667 1.00 0.00 H new ATOM 0 HG11 VAL B 4 20.932 -13.073 -9.424 1.00 0.00 H new ATOM 0 HG12 VAL B 4 19.613 -14.138 -8.883 1.00 0.00 H new ATOM 0 HG13 VAL B 4 21.086 -13.973 -7.897 1.00 0.00 H new ATOM 0 HG21 VAL B 4 23.041 -14.034 -10.283 1.00 0.00 H new ATOM 0 HG22 VAL B 4 23.280 -14.975 -8.791 1.00 0.00 H new ATOM 0 HG23 VAL B 4 23.255 -15.799 -10.368 1.00 0.00 H new ATOM 950 N ARG B 5 18.986 -16.516 -7.620 1.00 0.00 N ATOM 951 CA ARG B 5 17.555 -16.635 -7.370 1.00 0.00 C ATOM 952 C ARG B 5 17.048 -15.457 -6.543 1.00 0.00 C ATOM 953 O ARG B 5 17.581 -15.163 -5.472 1.00 0.00 O ATOM 954 CB ARG B 5 17.249 -17.949 -6.648 1.00 0.00 C ATOM 955 CG ARG B 5 15.814 -18.055 -6.160 1.00 0.00 C ATOM 956 CD ARG B 5 15.399 -19.505 -5.960 1.00 0.00 C ATOM 957 NE ARG B 5 14.417 -19.650 -4.889 1.00 0.00 N ATOM 958 CZ ARG B 5 14.700 -19.473 -3.603 1.00 0.00 C ATOM 959 NH1 ARG B 5 15.929 -19.144 -3.230 1.00 0.00 N ATOM 960 NH2 ARG B 5 13.751 -19.623 -2.687 1.00 0.00 N ATOM 0 H ARG B 5 19.545 -16.326 -6.788 1.00 0.00 H new ATOM 0 HA ARG B 5 17.042 -16.629 -8.332 1.00 0.00 H new ATOM 0 HB2 ARG B 5 17.457 -18.781 -7.321 1.00 0.00 H new ATOM 0 HB3 ARG B 5 17.922 -18.051 -5.797 1.00 0.00 H new ATOM 0 HG2 ARG B 5 15.707 -17.512 -5.221 1.00 0.00 H new ATOM 0 HG3 ARG B 5 15.148 -17.581 -6.880 1.00 0.00 H new ATOM 0 HD2 ARG B 5 14.982 -19.894 -6.889 1.00 0.00 H new ATOM 0 HD3 ARG B 5 16.279 -20.105 -5.729 1.00 0.00 H new ATOM 0 HE ARG B 5 13.461 -19.901 -5.142 1.00 0.00 H new ATOM 0 HH11 ARG B 5 16.660 -19.026 -3.931 1.00 0.00 H new ATOM 0 HH12 ARG B 5 16.143 -19.009 -2.242 1.00 0.00 H new ATOM 0 HH21 ARG B 5 12.804 -19.874 -2.970 1.00 0.00 H new ATOM 0 HH22 ARG B 5 13.969 -19.487 -1.700 1.00 0.00 H new ATOM 974 N ILE B 6 16.017 -14.788 -7.046 1.00 0.00 N ATOM 975 CA ILE B 6 15.438 -13.643 -6.354 1.00 0.00 C ATOM 976 C ILE B 6 13.941 -13.833 -6.133 1.00 0.00 C ATOM 977 O ILE B 6 13.191 -14.079 -7.078 1.00 0.00 O ATOM 978 CB ILE B 6 15.669 -12.337 -7.135 1.00 0.00 C ATOM 979 CG1 ILE B 6 17.164 -12.114 -7.368 1.00 0.00 C ATOM 980 CG2 ILE B 6 15.062 -11.158 -6.388 1.00 0.00 C ATOM 981 CD1 ILE B 6 17.470 -10.895 -8.210 1.00 0.00 C ATOM 0 H ILE B 6 15.565 -15.019 -7.931 1.00 0.00 H new ATOM 0 HA ILE B 6 15.939 -13.572 -5.388 1.00 0.00 H new ATOM 0 HB ILE B 6 15.178 -12.419 -8.105 1.00 0.00 H new ATOM 0 HG12 ILE B 6 17.663 -12.014 -6.404 1.00 0.00 H new ATOM 0 HG13 ILE B 6 17.583 -12.995 -7.854 1.00 0.00 H new ATOM 0 HG21 ILE B 6 15.234 -10.242 -6.953 1.00 0.00 H new ATOM 0 HG22 ILE B 6 13.990 -11.316 -6.269 1.00 0.00 H new ATOM 0 HG23 ILE B 6 15.527 -11.071 -5.406 1.00 0.00 H new ATOM 0 HD11 ILE B 6 18.549 -10.800 -8.334 1.00 0.00 H new ATOM 0 HD12 ILE B 6 17.001 -11.001 -9.188 1.00 0.00 H new ATOM 0 HD13 ILE B 6 17.081 -10.005 -7.716 1.00 0.00 H new ATOM 993 N SER B 7 13.513 -13.715 -4.881 1.00 0.00 N ATOM 994 CA SER B 7 12.105 -13.876 -4.535 1.00 0.00 C ATOM 995 C SER B 7 11.505 -12.552 -4.073 1.00 0.00 C ATOM 996 O SER B 7 12.020 -11.911 -3.156 1.00 0.00 O ATOM 997 CB SER B 7 11.944 -14.932 -3.441 1.00 0.00 C ATOM 998 OG SER B 7 13.116 -15.720 -3.315 1.00 0.00 O ATOM 0 H SER B 7 14.121 -13.508 -4.088 1.00 0.00 H new ATOM 0 HA SER B 7 11.572 -14.205 -5.427 1.00 0.00 H new ATOM 0 HB2 SER B 7 11.726 -14.445 -2.491 1.00 0.00 H new ATOM 0 HB3 SER B 7 11.094 -15.574 -3.673 1.00 0.00 H new ATOM 0 HG SER B 7 12.988 -16.386 -2.608 1.00 0.00 H new ATOM 1004 N ILE B 8 10.413 -12.149 -4.713 1.00 0.00 N ATOM 1005 CA ILE B 8 9.741 -10.902 -4.367 1.00 0.00 C ATOM 1006 C ILE B 8 8.388 -11.169 -3.717 1.00 0.00 C ATOM 1007 O ILE B 8 7.617 -12.008 -4.183 1.00 0.00 O ATOM 1008 CB ILE B 8 9.536 -10.011 -5.606 1.00 0.00 C ATOM 1009 CG1 ILE B 8 8.522 -10.649 -6.558 1.00 0.00 C ATOM 1010 CG2 ILE B 8 10.861 -9.776 -6.316 1.00 0.00 C ATOM 1011 CD1 ILE B 8 8.406 -9.933 -7.886 1.00 0.00 C ATOM 0 H ILE B 8 9.974 -12.668 -5.474 1.00 0.00 H new ATOM 0 HA ILE B 8 10.385 -10.382 -3.658 1.00 0.00 H new ATOM 0 HB ILE B 8 9.145 -9.047 -5.280 1.00 0.00 H new ATOM 0 HG12 ILE B 8 8.806 -11.686 -6.737 1.00 0.00 H new ATOM 0 HG13 ILE B 8 7.544 -10.665 -6.077 1.00 0.00 H new ATOM 0 HG21 ILE B 8 10.699 -9.144 -7.189 1.00 0.00 H new ATOM 0 HG22 ILE B 8 11.556 -9.283 -5.636 1.00 0.00 H new ATOM 0 HG23 ILE B 8 11.279 -10.732 -6.632 1.00 0.00 H new ATOM 0 HD11 ILE B 8 7.670 -10.440 -8.510 1.00 0.00 H new ATOM 0 HD12 ILE B 8 8.091 -8.903 -7.718 1.00 0.00 H new ATOM 0 HD13 ILE B 8 9.373 -9.939 -8.389 1.00 0.00 H new ATOM 1023 N THR B 9 8.104 -10.447 -2.637 1.00 0.00 N ATOM 1024 CA THR B 9 6.844 -10.605 -1.922 1.00 0.00 C ATOM 1025 C THR B 9 5.958 -9.377 -2.093 1.00 0.00 C ATOM 1026 O THR B 9 6.092 -8.396 -1.361 1.00 0.00 O ATOM 1027 CB THR B 9 7.077 -10.851 -0.419 1.00 0.00 C ATOM 1028 OG1 THR B 9 8.362 -11.448 -0.214 1.00 0.00 O ATOM 1029 CG2 THR B 9 5.996 -11.752 0.156 1.00 0.00 C ATOM 0 H THR B 9 8.730 -9.747 -2.239 1.00 0.00 H new ATOM 0 HA THR B 9 6.344 -11.473 -2.351 1.00 0.00 H new ATOM 0 HB THR B 9 7.037 -9.890 0.094 1.00 0.00 H new ATOM 0 HG1 THR B 9 8.503 -11.600 0.744 1.00 0.00 H new ATOM 0 HG21 THR B 9 6.182 -11.911 1.218 1.00 0.00 H new ATOM 0 HG22 THR B 9 5.022 -11.281 0.025 1.00 0.00 H new ATOM 0 HG23 THR B 9 6.008 -12.711 -0.362 1.00 0.00 H new ATOM 1037 N ALA B 10 5.051 -9.437 -3.063 1.00 0.00 N ATOM 1038 CA ALA B 10 4.141 -8.330 -3.328 1.00 0.00 C ATOM 1039 C ALA B 10 2.737 -8.640 -2.819 1.00 0.00 C ATOM 1040 O ALA B 10 2.436 -9.776 -2.454 1.00 0.00 O ATOM 1041 CB ALA B 10 4.108 -8.018 -4.816 1.00 0.00 C ATOM 0 H ALA B 10 4.927 -10.241 -3.678 1.00 0.00 H new ATOM 0 HA ALA B 10 4.508 -7.454 -2.793 1.00 0.00 H new ATOM 0 HB1 ALA B 10 3.424 -7.189 -4.999 1.00 0.00 H new ATOM 0 HB2 ALA B 10 5.108 -7.744 -5.153 1.00 0.00 H new ATOM 0 HB3 ALA B 10 3.768 -8.896 -5.365 1.00 0.00 H new ATOM 1047 N ARG B 11 1.883 -7.622 -2.796 1.00 0.00 N ATOM 1048 CA ARG B 11 0.511 -7.786 -2.330 1.00 0.00 C ATOM 1049 C ARG B 11 -0.284 -8.675 -3.282 1.00 0.00 C ATOM 1050 O ARG B 11 -0.835 -9.700 -2.879 1.00 0.00 O ATOM 1051 CB ARG B 11 -0.172 -6.424 -2.197 1.00 0.00 C ATOM 1052 CG ARG B 11 -1.120 -6.331 -1.014 1.00 0.00 C ATOM 1053 CD ARG B 11 -1.915 -5.034 -1.037 1.00 0.00 C ATOM 1054 NE ARG B 11 -3.356 -5.275 -1.035 1.00 0.00 N ATOM 1055 CZ ARG B 11 -4.255 -4.349 -0.724 1.00 0.00 C ATOM 1056 NH1 ARG B 11 -3.865 -3.126 -0.392 1.00 0.00 N ATOM 1057 NH2 ARG B 11 -5.548 -4.644 -0.745 1.00 0.00 N ATOM 0 H ARG B 11 2.117 -6.675 -3.095 1.00 0.00 H new ATOM 0 HA ARG B 11 0.541 -8.266 -1.352 1.00 0.00 H new ATOM 0 HB2 ARG B 11 0.592 -5.652 -2.101 1.00 0.00 H new ATOM 0 HB3 ARG B 11 -0.725 -6.214 -3.112 1.00 0.00 H new ATOM 0 HG2 ARG B 11 -1.805 -7.179 -1.028 1.00 0.00 H new ATOM 0 HG3 ARG B 11 -0.552 -6.395 -0.086 1.00 0.00 H new ATOM 0 HD2 ARG B 11 -1.647 -4.429 -0.170 1.00 0.00 H new ATOM 0 HD3 ARG B 11 -1.645 -4.459 -1.923 1.00 0.00 H new ATOM 0 HE ARG B 11 -3.690 -6.206 -1.286 1.00 0.00 H new ATOM 0 HH11 ARG B 11 -2.872 -2.894 -0.375 1.00 0.00 H new ATOM 0 HH12 ARG B 11 -4.558 -2.417 -0.154 1.00 0.00 H new ATOM 0 HH21 ARG B 11 -5.853 -5.583 -1.000 1.00 0.00 H new ATOM 0 HH22 ARG B 11 -6.238 -3.932 -0.506 1.00 0.00 H new ATOM 1071 N THR B 12 -0.341 -8.274 -4.549 1.00 0.00 N ATOM 1072 CA THR B 12 -1.070 -9.032 -5.558 1.00 0.00 C ATOM 1073 C THR B 12 -0.143 -9.490 -6.678 1.00 0.00 C ATOM 1074 O THR B 12 0.995 -9.033 -6.782 1.00 0.00 O ATOM 1075 CB THR B 12 -2.218 -8.203 -6.164 1.00 0.00 C ATOM 1076 OG1 THR B 12 -2.975 -9.006 -7.076 1.00 0.00 O ATOM 1077 CG2 THR B 12 -1.677 -6.978 -6.887 1.00 0.00 C ATOM 0 H THR B 12 0.109 -7.429 -4.900 1.00 0.00 H new ATOM 0 HA THR B 12 -1.488 -9.905 -5.056 1.00 0.00 H new ATOM 0 HB THR B 12 -2.864 -7.871 -5.352 1.00 0.00 H new ATOM 0 HG1 THR B 12 -3.704 -8.472 -7.455 1.00 0.00 H new ATOM 0 HG21 THR B 12 -2.506 -6.408 -7.307 1.00 0.00 H new ATOM 0 HG22 THR B 12 -1.127 -6.354 -6.183 1.00 0.00 H new ATOM 0 HG23 THR B 12 -1.011 -7.294 -7.690 1.00 0.00 H new ATOM 1085 N LYS B 13 -0.637 -10.395 -7.516 1.00 0.00 N ATOM 1086 CA LYS B 13 0.146 -10.914 -8.631 1.00 0.00 C ATOM 1087 C LYS B 13 0.561 -9.790 -9.574 1.00 0.00 C ATOM 1088 O LYS B 13 1.689 -9.764 -10.068 1.00 0.00 O ATOM 1089 CB LYS B 13 -0.656 -11.968 -9.398 1.00 0.00 C ATOM 1090 CG LYS B 13 -2.009 -11.472 -9.876 1.00 0.00 C ATOM 1091 CD LYS B 13 -2.876 -12.615 -10.379 1.00 0.00 C ATOM 1092 CE LYS B 13 -4.248 -12.604 -9.722 1.00 0.00 C ATOM 1093 NZ LYS B 13 -4.801 -13.979 -9.572 1.00 0.00 N ATOM 0 H LYS B 13 -1.577 -10.785 -7.444 1.00 0.00 H new ATOM 0 HA LYS B 13 1.046 -11.376 -8.226 1.00 0.00 H new ATOM 0 HB2 LYS B 13 -0.075 -12.300 -10.259 1.00 0.00 H new ATOM 0 HB3 LYS B 13 -0.803 -12.838 -8.758 1.00 0.00 H new ATOM 0 HG2 LYS B 13 -2.519 -10.959 -9.060 1.00 0.00 H new ATOM 0 HG3 LYS B 13 -1.869 -10.742 -10.673 1.00 0.00 H new ATOM 0 HD2 LYS B 13 -2.989 -12.539 -11.461 1.00 0.00 H new ATOM 0 HD3 LYS B 13 -2.382 -13.565 -10.176 1.00 0.00 H new ATOM 0 HE2 LYS B 13 -4.178 -12.132 -8.742 1.00 0.00 H new ATOM 0 HE3 LYS B 13 -4.932 -12.000 -10.319 1.00 0.00 H new ATOM 0 HZ1 LYS B 13 -5.737 -13.930 -9.120 1.00 0.00 H new ATOM 0 HZ2 LYS B 13 -4.892 -14.421 -10.509 1.00 0.00 H new ATOM 0 HZ3 LYS B 13 -4.161 -14.548 -8.981 1.00 0.00 H new ATOM 1107 N LYS B 14 -0.356 -8.861 -9.819 1.00 0.00 N ATOM 1108 CA LYS B 14 -0.085 -7.732 -10.701 1.00 0.00 C ATOM 1109 C LYS B 14 1.111 -6.927 -10.204 1.00 0.00 C ATOM 1110 O LYS B 14 1.919 -6.445 -10.997 1.00 0.00 O ATOM 1111 CB LYS B 14 -1.316 -6.828 -10.799 1.00 0.00 C ATOM 1112 CG LYS B 14 -2.076 -6.973 -12.106 1.00 0.00 C ATOM 1113 CD LYS B 14 -2.980 -8.194 -12.093 1.00 0.00 C ATOM 1114 CE LYS B 14 -2.467 -9.278 -13.029 1.00 0.00 C ATOM 1115 NZ LYS B 14 -3.470 -10.361 -13.226 1.00 0.00 N ATOM 0 H LYS B 14 -1.294 -8.867 -9.419 1.00 0.00 H new ATOM 0 HA LYS B 14 0.150 -8.125 -11.690 1.00 0.00 H new ATOM 0 HB2 LYS B 14 -1.988 -7.053 -9.971 1.00 0.00 H new ATOM 0 HB3 LYS B 14 -1.004 -5.790 -10.683 1.00 0.00 H new ATOM 0 HG2 LYS B 14 -2.674 -6.079 -12.281 1.00 0.00 H new ATOM 0 HG3 LYS B 14 -1.369 -7.051 -12.932 1.00 0.00 H new ATOM 0 HD2 LYS B 14 -3.046 -8.589 -11.079 1.00 0.00 H new ATOM 0 HD3 LYS B 14 -3.989 -7.904 -12.388 1.00 0.00 H new ATOM 0 HE2 LYS B 14 -2.216 -8.836 -13.993 1.00 0.00 H new ATOM 0 HE3 LYS B 14 -1.549 -9.703 -12.624 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 -3.037 -11.143 -13.757 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 -3.792 -10.708 -12.300 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 -4.282 -9.989 -13.758 1.00 0.00 H new ATOM 1129 N GLU B 15 1.218 -6.788 -8.886 1.00 0.00 N ATOM 1130 CA GLU B 15 2.317 -6.042 -8.284 1.00 0.00 C ATOM 1131 C GLU B 15 3.648 -6.753 -8.514 1.00 0.00 C ATOM 1132 O GLU B 15 4.609 -6.154 -8.994 1.00 0.00 O ATOM 1133 CB GLU B 15 2.077 -5.859 -6.784 1.00 0.00 C ATOM 1134 CG GLU B 15 1.545 -4.484 -6.416 1.00 0.00 C ATOM 1135 CD GLU B 15 0.472 -3.999 -7.371 1.00 0.00 C ATOM 1136 OE1 GLU B 15 0.826 -3.383 -8.398 1.00 0.00 O ATOM 1137 OE2 GLU B 15 -0.722 -4.236 -7.091 1.00 0.00 O ATOM 0 H GLU B 15 0.558 -7.182 -8.216 1.00 0.00 H new ATOM 0 HA GLU B 15 2.361 -5.062 -8.760 1.00 0.00 H new ATOM 0 HB2 GLU B 15 1.371 -6.616 -6.443 1.00 0.00 H new ATOM 0 HB3 GLU B 15 3.012 -6.032 -6.251 1.00 0.00 H new ATOM 0 HG2 GLU B 15 1.139 -4.514 -5.405 1.00 0.00 H new ATOM 0 HG3 GLU B 15 2.369 -3.770 -6.408 1.00 0.00 H new ATOM 1144 N ALA B 16 3.695 -8.035 -8.167 1.00 0.00 N ATOM 1145 CA ALA B 16 4.905 -8.829 -8.336 1.00 0.00 C ATOM 1146 C ALA B 16 5.299 -8.922 -9.807 1.00 0.00 C ATOM 1147 O ALA B 16 6.481 -8.885 -10.145 1.00 0.00 O ATOM 1148 CB ALA B 16 4.712 -10.219 -7.750 1.00 0.00 C ATOM 0 H ALA B 16 2.908 -8.546 -7.767 1.00 0.00 H new ATOM 0 HA ALA B 16 5.714 -8.332 -7.801 1.00 0.00 H new ATOM 0 HB1 ALA B 16 5.624 -10.800 -7.884 1.00 0.00 H new ATOM 0 HB2 ALA B 16 4.486 -10.137 -6.687 1.00 0.00 H new ATOM 0 HB3 ALA B 16 3.887 -10.717 -8.259 1.00 0.00 H new ATOM 1154 N GLU B 17 4.300 -9.045 -10.675 1.00 0.00 N ATOM 1155 CA GLU B 17 4.544 -9.146 -12.109 1.00 0.00 C ATOM 1156 C GLU B 17 5.315 -7.931 -12.617 1.00 0.00 C ATOM 1157 O GLU B 17 6.209 -8.055 -13.455 1.00 0.00 O ATOM 1158 CB GLU B 17 3.220 -9.276 -12.866 1.00 0.00 C ATOM 1159 CG GLU B 17 2.814 -10.714 -13.141 1.00 0.00 C ATOM 1160 CD GLU B 17 2.760 -11.032 -14.622 1.00 0.00 C ATOM 1161 OE1 GLU B 17 3.781 -10.829 -15.311 1.00 0.00 O ATOM 1162 OE2 GLU B 17 1.695 -11.485 -15.093 1.00 0.00 O ATOM 0 H GLU B 17 3.315 -9.077 -10.411 1.00 0.00 H new ATOM 0 HA GLU B 17 5.146 -10.037 -12.287 1.00 0.00 H new ATOM 0 HB2 GLU B 17 2.433 -8.789 -12.290 1.00 0.00 H new ATOM 0 HB3 GLU B 17 3.299 -8.742 -13.813 1.00 0.00 H new ATOM 0 HG2 GLU B 17 3.521 -11.386 -12.654 1.00 0.00 H new ATOM 0 HG3 GLU B 17 1.837 -10.903 -12.697 1.00 0.00 H new ATOM 1169 N LYS B 18 4.964 -6.758 -12.103 1.00 0.00 N ATOM 1170 CA LYS B 18 5.622 -5.519 -12.502 1.00 0.00 C ATOM 1171 C LYS B 18 7.110 -5.563 -12.170 1.00 0.00 C ATOM 1172 O LYS B 18 7.935 -5.007 -12.896 1.00 0.00 O ATOM 1173 CB LYS B 18 4.968 -4.323 -11.806 1.00 0.00 C ATOM 1174 CG LYS B 18 3.482 -4.192 -12.090 1.00 0.00 C ATOM 1175 CD LYS B 18 3.205 -3.113 -13.123 1.00 0.00 C ATOM 1176 CE LYS B 18 1.737 -3.087 -13.521 1.00 0.00 C ATOM 1177 NZ LYS B 18 1.397 -1.869 -14.308 1.00 0.00 N ATOM 0 H LYS B 18 4.227 -6.639 -11.408 1.00 0.00 H new ATOM 0 HA LYS B 18 5.511 -5.408 -13.581 1.00 0.00 H new ATOM 0 HB2 LYS B 18 5.117 -4.413 -10.730 1.00 0.00 H new ATOM 0 HB3 LYS B 18 5.472 -3.409 -12.122 1.00 0.00 H new ATOM 0 HG2 LYS B 18 3.093 -5.146 -12.446 1.00 0.00 H new ATOM 0 HG3 LYS B 18 2.953 -3.957 -11.166 1.00 0.00 H new ATOM 0 HD2 LYS B 18 3.492 -2.141 -12.721 1.00 0.00 H new ATOM 0 HD3 LYS B 18 3.820 -3.287 -14.006 1.00 0.00 H new ATOM 0 HE2 LYS B 18 1.504 -3.975 -14.108 1.00 0.00 H new ATOM 0 HE3 LYS B 18 1.117 -3.125 -12.625 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 0.388 -1.889 -14.560 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 1.595 -1.021 -13.739 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 1.970 -1.845 -15.176 1.00 0.00 H new ATOM 1191 N PHE B 19 7.447 -6.228 -11.070 1.00 0.00 N ATOM 1192 CA PHE B 19 8.837 -6.345 -10.643 1.00 0.00 C ATOM 1193 C PHE B 19 9.580 -7.377 -11.485 1.00 0.00 C ATOM 1194 O PHE B 19 10.725 -7.163 -11.880 1.00 0.00 O ATOM 1195 CB PHE B 19 8.907 -6.731 -9.164 1.00 0.00 C ATOM 1196 CG PHE B 19 8.740 -5.565 -8.231 1.00 0.00 C ATOM 1197 CD1 PHE B 19 9.826 -4.778 -7.883 1.00 0.00 C ATOM 1198 CD2 PHE B 19 7.497 -5.256 -7.702 1.00 0.00 C ATOM 1199 CE1 PHE B 19 9.676 -3.704 -7.026 1.00 0.00 C ATOM 1200 CE2 PHE B 19 7.341 -4.183 -6.845 1.00 0.00 C ATOM 1201 CZ PHE B 19 8.432 -3.407 -6.505 1.00 0.00 C ATOM 0 H PHE B 19 6.777 -6.694 -10.458 1.00 0.00 H new ATOM 0 HA PHE B 19 9.316 -5.376 -10.782 1.00 0.00 H new ATOM 0 HB2 PHE B 19 8.133 -7.469 -8.952 1.00 0.00 H new ATOM 0 HB3 PHE B 19 9.866 -7.209 -8.967 1.00 0.00 H new ATOM 0 HD1 PHE B 19 10.801 -5.007 -8.286 1.00 0.00 H new ATOM 0 HD2 PHE B 19 6.641 -5.860 -7.962 1.00 0.00 H new ATOM 0 HE1 PHE B 19 10.531 -3.098 -6.764 1.00 0.00 H new ATOM 0 HE2 PHE B 19 6.366 -3.951 -6.441 1.00 0.00 H new ATOM 0 HZ PHE B 19 8.312 -2.570 -5.833 1.00 0.00 H new ATOM 1211 N ALA B 20 8.919 -8.498 -11.755 1.00 0.00 N ATOM 1212 CA ALA B 20 9.516 -9.563 -12.551 1.00 0.00 C ATOM 1213 C ALA B 20 9.979 -9.042 -13.907 1.00 0.00 C ATOM 1214 O ALA B 20 11.074 -9.365 -14.366 1.00 0.00 O ATOM 1215 CB ALA B 20 8.525 -10.704 -12.732 1.00 0.00 C ATOM 0 H ALA B 20 7.970 -8.692 -11.434 1.00 0.00 H new ATOM 0 HA ALA B 20 10.390 -9.936 -12.017 1.00 0.00 H new ATOM 0 HB1 ALA B 20 8.983 -11.493 -13.328 1.00 0.00 H new ATOM 0 HB2 ALA B 20 8.246 -11.102 -11.756 1.00 0.00 H new ATOM 0 HB3 ALA B 20 7.635 -10.335 -13.241 1.00 0.00 H new ATOM 1221 N ALA B 21 9.137 -8.235 -14.544 1.00 0.00 N ATOM 1222 CA ALA B 21 9.460 -7.668 -15.848 1.00 0.00 C ATOM 1223 C ALA B 21 10.831 -6.998 -15.830 1.00 0.00 C ATOM 1224 O ALA B 21 11.652 -7.221 -16.720 1.00 0.00 O ATOM 1225 CB ALA B 21 8.390 -6.673 -16.271 1.00 0.00 C ATOM 0 H ALA B 21 8.226 -7.959 -14.178 1.00 0.00 H new ATOM 0 HA ALA B 21 9.491 -8.481 -16.573 1.00 0.00 H new ATOM 0 HB1 ALA B 21 8.644 -6.258 -17.246 1.00 0.00 H new ATOM 0 HB2 ALA B 21 7.426 -7.179 -16.332 1.00 0.00 H new ATOM 0 HB3 ALA B 21 8.331 -5.868 -15.538 1.00 0.00 H new ATOM 1231 N ILE B 22 11.070 -6.178 -14.813 1.00 0.00 N ATOM 1232 CA ILE B 22 12.341 -5.477 -14.680 1.00 0.00 C ATOM 1233 C ILE B 22 13.483 -6.453 -14.418 1.00 0.00 C ATOM 1234 O ILE B 22 14.523 -6.401 -15.076 1.00 0.00 O ATOM 1235 CB ILE B 22 12.296 -4.440 -13.542 1.00 0.00 C ATOM 1236 CG1 ILE B 22 11.193 -3.412 -13.803 1.00 0.00 C ATOM 1237 CG2 ILE B 22 13.646 -3.752 -13.399 1.00 0.00 C ATOM 1238 CD1 ILE B 22 10.534 -2.900 -12.541 1.00 0.00 C ATOM 0 H ILE B 22 10.400 -5.982 -14.069 1.00 0.00 H new ATOM 0 HA ILE B 22 12.516 -4.961 -15.624 1.00 0.00 H new ATOM 0 HB ILE B 22 12.072 -4.956 -12.608 1.00 0.00 H new ATOM 0 HG12 ILE B 22 11.615 -2.569 -14.351 1.00 0.00 H new ATOM 0 HG13 ILE B 22 10.434 -3.860 -14.444 1.00 0.00 H new ATOM 0 HG21 ILE B 22 13.599 -3.022 -12.591 1.00 0.00 H new ATOM 0 HG22 ILE B 22 14.411 -4.495 -13.172 1.00 0.00 H new ATOM 0 HG23 ILE B 22 13.897 -3.246 -14.331 1.00 0.00 H new ATOM 0 HD11 ILE B 22 9.763 -2.175 -12.802 1.00 0.00 H new ATOM 0 HD12 ILE B 22 10.082 -3.733 -12.003 1.00 0.00 H new ATOM 0 HD13 ILE B 22 11.282 -2.422 -11.908 1.00 0.00 H new ATOM 1250 N LEU B 23 13.281 -7.345 -13.454 1.00 0.00 N ATOM 1251 CA LEU B 23 14.293 -8.336 -13.105 1.00 0.00 C ATOM 1252 C LEU B 23 14.750 -9.106 -14.340 1.00 0.00 C ATOM 1253 O LEU B 23 15.933 -9.415 -14.489 1.00 0.00 O ATOM 1254 CB LEU B 23 13.745 -9.308 -12.059 1.00 0.00 C ATOM 1255 CG LEU B 23 14.335 -9.185 -10.654 1.00 0.00 C ATOM 1256 CD1 LEU B 23 15.824 -9.495 -10.672 1.00 0.00 C ATOM 1257 CD2 LEU B 23 14.085 -7.794 -10.089 1.00 0.00 C ATOM 0 H LEU B 23 12.426 -7.402 -12.901 1.00 0.00 H new ATOM 0 HA LEU B 23 15.152 -7.810 -12.688 1.00 0.00 H new ATOM 0 HB2 LEU B 23 12.666 -9.168 -11.992 1.00 0.00 H new ATOM 0 HB3 LEU B 23 13.913 -10.325 -12.414 1.00 0.00 H new ATOM 0 HG LEU B 23 13.841 -9.911 -10.009 1.00 0.00 H new ATOM 0 HD11 LEU B 23 16.227 -9.402 -9.664 1.00 0.00 H new ATOM 0 HD12 LEU B 23 15.980 -10.512 -11.033 1.00 0.00 H new ATOM 0 HD13 LEU B 23 16.334 -8.793 -11.332 1.00 0.00 H new ATOM 0 HD21 LEU B 23 14.512 -7.726 -9.088 1.00 0.00 H new ATOM 0 HD22 LEU B 23 14.552 -7.050 -10.734 1.00 0.00 H new ATOM 0 HD23 LEU B 23 13.012 -7.609 -10.039 1.00 0.00 H new ATOM 1269 N ILE B 24 13.806 -9.409 -15.225 1.00 0.00 N ATOM 1270 CA ILE B 24 14.113 -10.140 -16.448 1.00 0.00 C ATOM 1271 C ILE B 24 15.153 -9.401 -17.283 1.00 0.00 C ATOM 1272 O ILE B 24 16.117 -9.996 -17.763 1.00 0.00 O ATOM 1273 CB ILE B 24 12.850 -10.363 -17.302 1.00 0.00 C ATOM 1274 CG1 ILE B 24 11.846 -11.237 -16.547 1.00 0.00 C ATOM 1275 CG2 ILE B 24 13.217 -10.999 -18.634 1.00 0.00 C ATOM 1276 CD1 ILE B 24 10.403 -10.879 -16.827 1.00 0.00 C ATOM 0 H ILE B 24 12.823 -9.160 -15.118 1.00 0.00 H new ATOM 0 HA ILE B 24 14.513 -11.108 -16.146 1.00 0.00 H new ATOM 0 HB ILE B 24 12.387 -9.396 -17.499 1.00 0.00 H new ATOM 0 HG12 ILE B 24 12.012 -12.281 -16.815 1.00 0.00 H new ATOM 0 HG13 ILE B 24 12.033 -11.149 -15.477 1.00 0.00 H new ATOM 0 HG21 ILE B 24 12.314 -11.150 -19.226 1.00 0.00 H new ATOM 0 HG22 ILE B 24 13.900 -10.343 -19.174 1.00 0.00 H new ATOM 0 HG23 ILE B 24 13.700 -11.960 -18.457 1.00 0.00 H new ATOM 0 HD11 ILE B 24 9.748 -11.539 -16.259 1.00 0.00 H new ATOM 0 HD12 ILE B 24 10.221 -9.845 -16.533 1.00 0.00 H new ATOM 0 HD13 ILE B 24 10.199 -10.994 -17.892 1.00 0.00 H new ATOM 1288 N LYS B 25 14.951 -8.098 -17.453 1.00 0.00 N ATOM 1289 CA LYS B 25 15.872 -7.275 -18.227 1.00 0.00 C ATOM 1290 C LYS B 25 17.243 -7.220 -17.561 1.00 0.00 C ATOM 1291 O LYS B 25 18.270 -7.405 -18.215 1.00 0.00 O ATOM 1292 CB LYS B 25 15.313 -5.859 -18.386 1.00 0.00 C ATOM 1293 CG LYS B 25 14.517 -5.660 -19.664 1.00 0.00 C ATOM 1294 CD LYS B 25 13.415 -4.629 -19.479 1.00 0.00 C ATOM 1295 CE LYS B 25 12.236 -5.205 -18.710 1.00 0.00 C ATOM 1296 NZ LYS B 25 10.934 -4.821 -19.323 1.00 0.00 N ATOM 0 H LYS B 25 14.157 -7.590 -17.064 1.00 0.00 H new ATOM 0 HA LYS B 25 15.984 -7.727 -19.212 1.00 0.00 H new ATOM 0 HB2 LYS B 25 14.676 -5.631 -17.532 1.00 0.00 H new ATOM 0 HB3 LYS B 25 16.138 -5.147 -18.367 1.00 0.00 H new ATOM 0 HG2 LYS B 25 15.185 -5.341 -20.464 1.00 0.00 H new ATOM 0 HG3 LYS B 25 14.080 -6.609 -19.973 1.00 0.00 H new ATOM 0 HD2 LYS B 25 13.810 -3.764 -18.947 1.00 0.00 H new ATOM 0 HD3 LYS B 25 13.078 -4.277 -20.454 1.00 0.00 H new ATOM 0 HE2 LYS B 25 12.317 -6.292 -18.681 1.00 0.00 H new ATOM 0 HE3 LYS B 25 12.269 -4.855 -17.678 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 10.155 -5.233 -18.770 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 10.845 -3.785 -19.328 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 10.892 -5.177 -20.299 1.00 0.00 H new ATOM 1310 N VAL B 26 17.253 -6.965 -16.257 1.00 0.00 N ATOM 1311 CA VAL B 26 18.498 -6.888 -15.502 1.00 0.00 C ATOM 1312 C VAL B 26 19.300 -8.178 -15.632 1.00 0.00 C ATOM 1313 O VAL B 26 20.524 -8.151 -15.762 1.00 0.00 O ATOM 1314 CB VAL B 26 18.235 -6.608 -14.011 1.00 0.00 C ATOM 1315 CG1 VAL B 26 19.538 -6.318 -13.283 1.00 0.00 C ATOM 1316 CG2 VAL B 26 17.256 -5.454 -13.851 1.00 0.00 C ATOM 0 H VAL B 26 16.412 -6.808 -15.701 1.00 0.00 H new ATOM 0 HA VAL B 26 19.072 -6.062 -15.923 1.00 0.00 H new ATOM 0 HB VAL B 26 17.789 -7.497 -13.565 1.00 0.00 H new ATOM 0 HG11 VAL B 26 19.331 -6.123 -12.231 1.00 0.00 H new ATOM 0 HG12 VAL B 26 20.202 -7.178 -13.369 1.00 0.00 H new ATOM 0 HG13 VAL B 26 20.016 -5.445 -13.727 1.00 0.00 H new ATOM 0 HG21 VAL B 26 17.081 -5.269 -12.791 1.00 0.00 H new ATOM 0 HG22 VAL B 26 17.672 -4.558 -14.312 1.00 0.00 H new ATOM 0 HG23 VAL B 26 16.313 -5.707 -14.335 1.00 0.00 H new ATOM 1326 N PHE B 27 18.602 -9.308 -15.596 1.00 0.00 N ATOM 1327 CA PHE B 27 19.248 -10.611 -15.709 1.00 0.00 C ATOM 1328 C PHE B 27 19.740 -10.852 -17.134 1.00 0.00 C ATOM 1329 O PHE B 27 20.844 -11.352 -17.344 1.00 0.00 O ATOM 1330 CB PHE B 27 18.281 -11.722 -15.297 1.00 0.00 C ATOM 1331 CG PHE B 27 18.366 -12.080 -13.840 1.00 0.00 C ATOM 1332 CD1 PHE B 27 19.567 -12.483 -13.281 1.00 0.00 C ATOM 1333 CD2 PHE B 27 17.243 -12.014 -13.031 1.00 0.00 C ATOM 1334 CE1 PHE B 27 19.649 -12.813 -11.941 1.00 0.00 C ATOM 1335 CE2 PHE B 27 17.319 -12.343 -11.691 1.00 0.00 C ATOM 1336 CZ PHE B 27 18.523 -12.744 -11.146 1.00 0.00 C ATOM 0 H PHE B 27 17.588 -9.348 -15.489 1.00 0.00 H new ATOM 0 HA PHE B 27 20.108 -10.621 -15.039 1.00 0.00 H new ATOM 0 HB2 PHE B 27 17.262 -11.410 -15.528 1.00 0.00 H new ATOM 0 HB3 PHE B 27 18.485 -12.611 -15.894 1.00 0.00 H new ATOM 0 HD1 PHE B 27 20.451 -12.540 -13.899 1.00 0.00 H new ATOM 0 HD2 PHE B 27 16.299 -11.702 -13.452 1.00 0.00 H new ATOM 0 HE1 PHE B 27 20.592 -13.124 -11.517 1.00 0.00 H new ATOM 0 HE2 PHE B 27 16.437 -12.287 -11.070 1.00 0.00 H new ATOM 0 HZ PHE B 27 18.583 -13.003 -10.099 1.00 0.00 H new ATOM 1346 N ALA B 28 18.911 -10.492 -18.108 1.00 0.00 N ATOM 1347 CA ALA B 28 19.261 -10.668 -19.512 1.00 0.00 C ATOM 1348 C ALA B 28 20.488 -9.840 -19.880 1.00 0.00 C ATOM 1349 O ALA B 28 21.399 -10.329 -20.547 1.00 0.00 O ATOM 1350 CB ALA B 28 18.084 -10.293 -20.400 1.00 0.00 C ATOM 0 H ALA B 28 17.993 -10.077 -17.951 1.00 0.00 H new ATOM 0 HA ALA B 28 19.503 -11.719 -19.672 1.00 0.00 H new ATOM 0 HB1 ALA B 28 18.359 -10.429 -21.446 1.00 0.00 H new ATOM 0 HB2 ALA B 28 17.232 -10.930 -20.163 1.00 0.00 H new ATOM 0 HB3 ALA B 28 17.816 -9.250 -20.228 1.00 0.00 H new ATOM 1356 N GLU B 29 20.503 -8.586 -19.441 1.00 0.00 N ATOM 1357 CA GLU B 29 21.619 -7.691 -19.726 1.00 0.00 C ATOM 1358 C GLU B 29 22.873 -8.129 -18.976 1.00 0.00 C ATOM 1359 O GLU B 29 23.987 -7.734 -19.322 1.00 0.00 O ATOM 1360 CB GLU B 29 21.259 -6.254 -19.344 1.00 0.00 C ATOM 1361 CG GLU B 29 21.430 -5.956 -17.864 1.00 0.00 C ATOM 1362 CD GLU B 29 22.652 -5.104 -17.578 1.00 0.00 C ATOM 1363 OE1 GLU B 29 22.933 -4.185 -18.375 1.00 0.00 O ATOM 1364 OE2 GLU B 29 23.326 -5.357 -16.557 1.00 0.00 O ATOM 0 H GLU B 29 19.756 -8.167 -18.887 1.00 0.00 H new ATOM 0 HA GLU B 29 21.823 -7.735 -20.796 1.00 0.00 H new ATOM 0 HB2 GLU B 29 21.881 -5.568 -19.918 1.00 0.00 H new ATOM 0 HB3 GLU B 29 20.225 -6.060 -19.628 1.00 0.00 H new ATOM 0 HG2 GLU B 29 20.541 -5.445 -17.495 1.00 0.00 H new ATOM 0 HG3 GLU B 29 21.509 -6.894 -17.315 1.00 0.00 H new ATOM 1371 N LEU B 30 22.684 -8.947 -17.947 1.00 0.00 N ATOM 1372 CA LEU B 30 23.800 -9.440 -17.146 1.00 0.00 C ATOM 1373 C LEU B 30 24.318 -10.767 -17.692 1.00 0.00 C ATOM 1374 O LEU B 30 25.271 -11.337 -17.164 1.00 0.00 O ATOM 1375 CB LEU B 30 23.372 -9.608 -15.687 1.00 0.00 C ATOM 1376 CG LEU B 30 23.270 -8.323 -14.865 1.00 0.00 C ATOM 1377 CD1 LEU B 30 22.459 -8.561 -13.601 1.00 0.00 C ATOM 1378 CD2 LEU B 30 24.657 -7.799 -14.521 1.00 0.00 C ATOM 0 H LEU B 30 21.769 -9.283 -17.647 1.00 0.00 H new ATOM 0 HA LEU B 30 24.605 -8.707 -17.200 1.00 0.00 H new ATOM 0 HB2 LEU B 30 22.402 -10.105 -15.669 1.00 0.00 H new ATOM 0 HB3 LEU B 30 24.081 -10.274 -15.196 1.00 0.00 H new ATOM 0 HG LEU B 30 22.757 -7.570 -15.464 1.00 0.00 H new ATOM 0 HD11 LEU B 30 22.397 -7.635 -13.029 1.00 0.00 H new ATOM 0 HD12 LEU B 30 21.455 -8.889 -13.869 1.00 0.00 H new ATOM 0 HD13 LEU B 30 22.943 -9.329 -12.998 1.00 0.00 H new ATOM 0 HD21 LEU B 30 24.565 -6.884 -13.936 1.00 0.00 H new ATOM 0 HD22 LEU B 30 25.196 -8.548 -13.941 1.00 0.00 H new ATOM 0 HD23 LEU B 30 25.205 -7.589 -15.440 1.00 0.00 H new ATOM 1390 N GLY B 31 23.683 -11.252 -18.755 1.00 0.00 N ATOM 1391 CA GLY B 31 24.096 -12.507 -19.356 1.00 0.00 C ATOM 1392 C GLY B 31 23.414 -13.704 -18.724 1.00 0.00 C ATOM 1393 O GLY B 31 23.802 -14.847 -18.966 1.00 0.00 O ATOM 0 H GLY B 31 22.891 -10.799 -19.210 1.00 0.00 H new ATOM 0 HA2 GLY B 31 23.872 -12.487 -20.423 1.00 0.00 H new ATOM 0 HA3 GLY B 31 25.176 -12.615 -19.259 1.00 0.00 H new ATOM 1397 N TYR B 32 22.397 -13.442 -17.911 1.00 0.00 N ATOM 1398 CA TYR B 32 21.663 -14.507 -17.238 1.00 0.00 C ATOM 1399 C TYR B 32 20.421 -14.899 -18.033 1.00 0.00 C ATOM 1400 O TYR B 32 19.388 -15.245 -17.462 1.00 0.00 O ATOM 1401 CB TYR B 32 21.262 -14.068 -15.829 1.00 0.00 C ATOM 1402 CG TYR B 32 22.437 -13.887 -14.894 1.00 0.00 C ATOM 1403 CD1 TYR B 32 23.349 -12.857 -15.083 1.00 0.00 C ATOM 1404 CD2 TYR B 32 22.634 -14.748 -13.821 1.00 0.00 C ATOM 1405 CE1 TYR B 32 24.424 -12.688 -14.232 1.00 0.00 C ATOM 1406 CE2 TYR B 32 23.705 -14.586 -12.963 1.00 0.00 C ATOM 1407 CZ TYR B 32 24.597 -13.556 -13.174 1.00 0.00 C ATOM 1408 OH TYR B 32 25.666 -13.390 -12.322 1.00 0.00 O ATOM 0 H TYR B 32 22.062 -12.502 -17.702 1.00 0.00 H new ATOM 0 HA TYR B 32 22.317 -15.376 -17.168 1.00 0.00 H new ATOM 0 HB2 TYR B 32 20.711 -13.130 -15.893 1.00 0.00 H new ATOM 0 HB3 TYR B 32 20.583 -14.808 -15.406 1.00 0.00 H new ATOM 0 HD1 TYR B 32 23.215 -12.176 -15.910 1.00 0.00 H new ATOM 0 HD2 TYR B 32 21.938 -15.557 -13.655 1.00 0.00 H new ATOM 0 HE1 TYR B 32 25.124 -11.882 -14.394 1.00 0.00 H new ATOM 0 HE2 TYR B 32 23.843 -15.262 -12.132 1.00 0.00 H new ATOM 0 HH TYR B 32 25.643 -14.083 -11.629 1.00 0.00 H new ATOM 1418 N ASN B 33 20.531 -14.842 -19.357 1.00 0.00 N ATOM 1419 CA ASN B 33 19.418 -15.190 -20.232 1.00 0.00 C ATOM 1420 C ASN B 33 18.832 -16.547 -19.854 1.00 0.00 C ATOM 1421 O ASN B 33 19.475 -17.343 -19.168 1.00 0.00 O ATOM 1422 CB ASN B 33 19.877 -15.209 -21.692 1.00 0.00 C ATOM 1423 CG ASN B 33 18.746 -14.912 -22.657 1.00 0.00 C ATOM 1424 OD1 ASN B 33 18.397 -13.753 -22.884 1.00 0.00 O ATOM 1425 ND2 ASN B 33 18.166 -15.960 -23.230 1.00 0.00 N ATOM 0 H ASN B 33 21.380 -14.558 -19.847 1.00 0.00 H new ATOM 0 HA ASN B 33 18.643 -14.433 -20.111 1.00 0.00 H new ATOM 0 HB2 ASN B 33 20.671 -14.475 -21.830 1.00 0.00 H new ATOM 0 HB3 ASN B 33 20.302 -16.186 -21.924 1.00 0.00 H new ATOM 0 HD21 ASN B 33 17.399 -15.822 -23.888 1.00 0.00 H new ATOM 0 HD22 ASN B 33 18.488 -16.903 -23.012 1.00 0.00 H new ATOM 1432 N ASP B 34 17.610 -16.804 -20.305 1.00 0.00 N ATOM 1433 CA ASP B 34 16.938 -18.066 -20.016 1.00 0.00 C ATOM 1434 C ASP B 34 16.541 -18.145 -18.546 1.00 0.00 C ATOM 1435 O ASP B 34 16.950 -19.060 -17.830 1.00 0.00 O ATOM 1436 CB ASP B 34 17.842 -19.245 -20.377 1.00 0.00 C ATOM 1437 CG ASP B 34 17.057 -20.457 -20.839 1.00 0.00 C ATOM 1438 OD1 ASP B 34 16.491 -20.409 -21.951 1.00 0.00 O ATOM 1439 OD2 ASP B 34 17.010 -21.454 -20.088 1.00 0.00 O ATOM 0 H ASP B 34 17.064 -16.156 -20.872 1.00 0.00 H new ATOM 0 HA ASP B 34 16.033 -18.114 -20.622 1.00 0.00 H new ATOM 0 HB2 ASP B 34 18.533 -18.942 -21.164 1.00 0.00 H new ATOM 0 HB3 ASP B 34 18.445 -19.515 -19.510 1.00 0.00 H new ATOM 1444 N ILE B 35 15.742 -17.180 -18.101 1.00 0.00 N ATOM 1445 CA ILE B 35 15.290 -17.142 -16.716 1.00 0.00 C ATOM 1446 C ILE B 35 14.006 -17.944 -16.534 1.00 0.00 C ATOM 1447 O ILE B 35 13.186 -18.037 -17.446 1.00 0.00 O ATOM 1448 CB ILE B 35 15.050 -15.696 -16.242 1.00 0.00 C ATOM 1449 CG1 ILE B 35 15.952 -15.370 -15.050 1.00 0.00 C ATOM 1450 CG2 ILE B 35 13.587 -15.494 -15.877 1.00 0.00 C ATOM 1451 CD1 ILE B 35 17.345 -14.936 -15.447 1.00 0.00 C ATOM 0 H ILE B 35 15.395 -16.415 -18.679 1.00 0.00 H new ATOM 0 HA ILE B 35 16.082 -17.587 -16.114 1.00 0.00 H new ATOM 0 HB ILE B 35 15.298 -15.016 -17.057 1.00 0.00 H new ATOM 0 HG12 ILE B 35 15.489 -14.580 -14.460 1.00 0.00 H new ATOM 0 HG13 ILE B 35 16.023 -16.248 -14.408 1.00 0.00 H new ATOM 0 HG21 ILE B 35 13.433 -14.468 -15.544 1.00 0.00 H new ATOM 0 HG22 ILE B 35 12.964 -15.689 -16.750 1.00 0.00 H new ATOM 0 HG23 ILE B 35 13.314 -16.180 -15.075 1.00 0.00 H new ATOM 0 HD11 ILE B 35 17.928 -14.721 -14.552 1.00 0.00 H new ATOM 0 HD12 ILE B 35 17.828 -15.734 -16.012 1.00 0.00 H new ATOM 0 HD13 ILE B 35 17.285 -14.040 -16.064 1.00 0.00 H new ATOM 1463 N ASN B 36 13.839 -18.521 -15.348 1.00 0.00 N ATOM 1464 CA ASN B 36 12.653 -19.315 -15.045 1.00 0.00 C ATOM 1465 C ASN B 36 11.970 -18.810 -13.778 1.00 0.00 C ATOM 1466 O ASN B 36 12.589 -18.725 -12.717 1.00 0.00 O ATOM 1467 CB ASN B 36 13.029 -20.789 -14.883 1.00 0.00 C ATOM 1468 CG ASN B 36 12.986 -21.544 -16.197 1.00 0.00 C ATOM 1469 OD1 ASN B 36 13.742 -21.247 -17.122 1.00 0.00 O ATOM 1470 ND2 ASN B 36 12.099 -22.528 -16.285 1.00 0.00 N ATOM 0 H ASN B 36 14.509 -18.454 -14.582 1.00 0.00 H new ATOM 0 HA ASN B 36 11.956 -19.214 -15.877 1.00 0.00 H new ATOM 0 HB2 ASN B 36 14.030 -20.861 -14.458 1.00 0.00 H new ATOM 0 HB3 ASN B 36 12.347 -21.259 -14.174 1.00 0.00 H new ATOM 0 HD21 ASN B 36 12.025 -23.072 -17.145 1.00 0.00 H new ATOM 0 HD22 ASN B 36 11.492 -22.740 -15.493 1.00 0.00 H new ATOM 1477 N VAL B 37 10.688 -18.477 -13.895 1.00 0.00 N ATOM 1478 CA VAL B 37 9.920 -17.982 -12.759 1.00 0.00 C ATOM 1479 C VAL B 37 9.045 -19.082 -12.167 1.00 0.00 C ATOM 1480 O VAL B 37 8.389 -19.829 -12.894 1.00 0.00 O ATOM 1481 CB VAL B 37 9.028 -16.793 -13.161 1.00 0.00 C ATOM 1482 CG1 VAL B 37 7.940 -17.242 -14.124 1.00 0.00 C ATOM 1483 CG2 VAL B 37 8.422 -16.141 -11.927 1.00 0.00 C ATOM 0 H VAL B 37 10.160 -18.541 -14.765 1.00 0.00 H new ATOM 0 HA VAL B 37 10.639 -17.651 -12.010 1.00 0.00 H new ATOM 0 HB VAL B 37 9.647 -16.053 -13.669 1.00 0.00 H new ATOM 0 HG11 VAL B 37 7.320 -16.388 -14.396 1.00 0.00 H new ATOM 0 HG12 VAL B 37 8.398 -17.659 -15.021 1.00 0.00 H new ATOM 0 HG13 VAL B 37 7.321 -18.001 -13.646 1.00 0.00 H new ATOM 0 HG21 VAL B 37 7.795 -15.303 -12.229 1.00 0.00 H new ATOM 0 HG22 VAL B 37 7.817 -16.871 -11.389 1.00 0.00 H new ATOM 0 HG23 VAL B 37 9.219 -15.781 -11.277 1.00 0.00 H new ATOM 1493 N THR B 38 9.040 -19.176 -10.841 1.00 0.00 N ATOM 1494 CA THR B 38 8.246 -20.185 -10.150 1.00 0.00 C ATOM 1495 C THR B 38 7.453 -19.570 -9.003 1.00 0.00 C ATOM 1496 O THR B 38 8.028 -19.096 -8.023 1.00 0.00 O ATOM 1497 CB THR B 38 9.134 -21.316 -9.597 1.00 0.00 C ATOM 1498 OG1 THR B 38 10.251 -20.762 -8.893 1.00 0.00 O ATOM 1499 CG2 THR B 38 9.631 -22.213 -10.720 1.00 0.00 C ATOM 0 H THR B 38 9.577 -18.566 -10.224 1.00 0.00 H new ATOM 0 HA THR B 38 7.555 -20.601 -10.883 1.00 0.00 H new ATOM 0 HB THR B 38 8.535 -21.916 -8.913 1.00 0.00 H new ATOM 0 HG1 THR B 38 9.950 -20.008 -8.344 1.00 0.00 H new ATOM 0 HG21 THR B 38 10.256 -23.004 -10.305 1.00 0.00 H new ATOM 0 HG22 THR B 38 8.779 -22.657 -11.235 1.00 0.00 H new ATOM 0 HG23 THR B 38 10.215 -21.622 -11.426 1.00 0.00 H new ATOM 1576 N VAL B 44 6.369 -15.067 -5.803 1.00 0.00 N ATOM 1577 CA VAL B 44 7.051 -15.357 -7.059 1.00 0.00 C ATOM 1578 C VAL B 44 8.564 -15.271 -6.896 1.00 0.00 C ATOM 1579 O VAL B 44 9.085 -14.314 -6.323 1.00 0.00 O ATOM 1580 CB VAL B 44 6.610 -14.390 -8.174 1.00 0.00 C ATOM 1581 CG1 VAL B 44 5.227 -14.761 -8.687 1.00 0.00 C ATOM 1582 CG2 VAL B 44 6.634 -12.954 -7.673 1.00 0.00 C ATOM 0 HA VAL B 44 6.776 -16.374 -7.340 1.00 0.00 H new ATOM 0 HB VAL B 44 7.313 -14.474 -9.003 1.00 0.00 H new ATOM 0 HG11 VAL B 44 4.933 -14.067 -9.474 1.00 0.00 H new ATOM 0 HG12 VAL B 44 5.247 -15.775 -9.086 1.00 0.00 H new ATOM 0 HG13 VAL B 44 4.509 -14.707 -7.869 1.00 0.00 H new ATOM 0 HG21 VAL B 44 6.320 -12.284 -8.473 1.00 0.00 H new ATOM 0 HG22 VAL B 44 5.954 -12.852 -6.827 1.00 0.00 H new ATOM 0 HG23 VAL B 44 7.645 -12.695 -7.359 1.00 0.00 H new ATOM 1592 N THR B 45 9.267 -16.279 -7.404 1.00 0.00 N ATOM 1593 CA THR B 45 10.721 -16.319 -7.315 1.00 0.00 C ATOM 1594 C THR B 45 11.349 -16.561 -8.682 1.00 0.00 C ATOM 1595 O THR B 45 11.022 -17.532 -9.364 1.00 0.00 O ATOM 1596 CB THR B 45 11.194 -17.416 -6.343 1.00 0.00 C ATOM 1597 OG1 THR B 45 10.500 -17.300 -5.096 1.00 0.00 O ATOM 1598 CG2 THR B 45 12.693 -17.319 -6.106 1.00 0.00 C ATOM 0 H THR B 45 8.852 -17.079 -7.882 1.00 0.00 H new ATOM 0 HA THR B 45 11.042 -15.348 -6.938 1.00 0.00 H new ATOM 0 HB THR B 45 10.975 -18.385 -6.790 1.00 0.00 H new ATOM 0 HG1 THR B 45 10.806 -18.002 -4.485 1.00 0.00 H new ATOM 0 HG21 THR B 45 13.004 -18.104 -5.416 1.00 0.00 H new ATOM 0 HG22 THR B 45 13.220 -17.438 -7.053 1.00 0.00 H new ATOM 0 HG23 THR B 45 12.932 -16.345 -5.679 1.00 0.00 H new ATOM 1606 N VAL B 46 12.255 -15.671 -9.078 1.00 0.00 N ATOM 1607 CA VAL B 46 12.931 -15.790 -10.364 1.00 0.00 C ATOM 1608 C VAL B 46 14.227 -16.581 -10.232 1.00 0.00 C ATOM 1609 O VAL B 46 14.977 -16.407 -9.273 1.00 0.00 O ATOM 1610 CB VAL B 46 13.246 -14.406 -10.962 1.00 0.00 C ATOM 1611 CG1 VAL B 46 14.358 -13.726 -10.178 1.00 0.00 C ATOM 1612 CG2 VAL B 46 13.618 -14.533 -12.431 1.00 0.00 C ATOM 0 H VAL B 46 12.537 -14.861 -8.526 1.00 0.00 H new ATOM 0 HA VAL B 46 12.251 -16.320 -11.031 1.00 0.00 H new ATOM 0 HB VAL B 46 12.352 -13.786 -10.890 1.00 0.00 H new ATOM 0 HG11 VAL B 46 14.567 -12.750 -10.615 1.00 0.00 H new ATOM 0 HG12 VAL B 46 14.048 -13.600 -9.141 1.00 0.00 H new ATOM 0 HG13 VAL B 46 15.258 -14.340 -10.216 1.00 0.00 H new ATOM 0 HG21 VAL B 46 13.837 -13.546 -12.837 1.00 0.00 H new ATOM 0 HG22 VAL B 46 14.497 -15.170 -12.530 1.00 0.00 H new ATOM 0 HG23 VAL B 46 12.786 -14.975 -12.980 1.00 0.00 H new ATOM 1622 N GLU B 47 14.485 -17.451 -11.204 1.00 0.00 N ATOM 1623 CA GLU B 47 15.691 -18.270 -11.196 1.00 0.00 C ATOM 1624 C GLU B 47 16.474 -18.099 -12.495 1.00 0.00 C ATOM 1625 O GLU B 47 15.966 -18.381 -13.579 1.00 0.00 O ATOM 1626 CB GLU B 47 15.333 -19.744 -10.994 1.00 0.00 C ATOM 1627 CG GLU B 47 14.883 -20.073 -9.580 1.00 0.00 C ATOM 1628 CD GLU B 47 14.561 -21.543 -9.398 1.00 0.00 C ATOM 1629 OE1 GLU B 47 15.470 -22.378 -9.583 1.00 0.00 O ATOM 1630 OE2 GLU B 47 13.398 -21.858 -9.070 1.00 0.00 O ATOM 0 H GLU B 47 13.875 -17.606 -12.007 1.00 0.00 H new ATOM 0 HA GLU B 47 16.318 -17.939 -10.368 1.00 0.00 H new ATOM 0 HB2 GLU B 47 14.540 -20.015 -11.691 1.00 0.00 H new ATOM 0 HB3 GLU B 47 16.199 -20.357 -11.242 1.00 0.00 H new ATOM 0 HG2 GLU B 47 15.666 -19.787 -8.878 1.00 0.00 H new ATOM 0 HG3 GLU B 47 14.002 -19.479 -9.335 1.00 0.00 H new ATOM 1637 N GLY B 48 17.713 -17.633 -12.375 1.00 0.00 N ATOM 1638 CA GLY B 48 18.546 -17.431 -13.546 1.00 0.00 C ATOM 1639 C GLY B 48 19.908 -18.082 -13.409 1.00 0.00 C ATOM 1640 O GLY B 48 20.369 -18.341 -12.297 1.00 0.00 O ATOM 0 H GLY B 48 18.155 -17.392 -11.488 1.00 0.00 H new ATOM 0 HA2 GLY B 48 18.040 -17.836 -14.422 1.00 0.00 H new ATOM 0 HA3 GLY B 48 18.673 -16.362 -13.717 1.00 0.00 H new ATOM 1644 N GLN B 49 20.552 -18.348 -14.540 1.00 0.00 N ATOM 1645 CA GLN B 49 21.869 -18.975 -14.540 1.00 0.00 C ATOM 1646 C GLN B 49 22.805 -18.276 -15.519 1.00 0.00 C ATOM 1647 O GLN B 49 22.394 -17.875 -16.609 1.00 0.00 O ATOM 1648 CB GLN B 49 21.751 -20.457 -14.899 1.00 0.00 C ATOM 1649 CG GLN B 49 21.318 -20.703 -16.336 1.00 0.00 C ATOM 1650 CD GLN B 49 19.858 -20.366 -16.571 1.00 0.00 C ATOM 1651 OE1 GLN B 49 19.606 -19.197 -17.147 1.00 0.00 O flip ATOM 1652 NE2 GLN B 49 18.967 -21.148 -16.238 1.00 0.00 N flip ATOM 0 H GLN B 49 20.184 -18.139 -15.468 1.00 0.00 H new ATOM 0 HA GLN B 49 22.287 -18.883 -13.538 1.00 0.00 H new ATOM 0 HB2 GLN B 49 22.713 -20.941 -14.730 1.00 0.00 H new ATOM 0 HB3 GLN B 49 21.035 -20.929 -14.227 1.00 0.00 H new ATOM 0 HG2 GLN B 49 21.937 -20.106 -17.005 1.00 0.00 H new ATOM 0 HG3 GLN B 49 21.491 -21.749 -16.590 1.00 0.00 H new ATOM 0 HE21 GLN B 49 19.206 -22.036 -15.798 1.00 0.00 H new ATOM 0 HE22 GLN B 49 17.990 -20.907 -16.402 1.00 0.00 H new ATOM 1661 N LEU B 50 24.065 -18.131 -15.124 1.00 0.00 N ATOM 1662 CA LEU B 50 25.061 -17.479 -15.967 1.00 0.00 C ATOM 1663 C LEU B 50 26.023 -18.501 -16.564 1.00 0.00 C ATOM 1664 O LEU B 50 26.446 -19.438 -15.887 1.00 0.00 O ATOM 1665 CB LEU B 50 25.840 -16.439 -15.159 1.00 0.00 C ATOM 1666 CG LEU B 50 26.099 -15.103 -15.857 1.00 0.00 C ATOM 1667 CD1 LEU B 50 27.081 -14.264 -15.055 1.00 0.00 C ATOM 1668 CD2 LEU B 50 26.618 -15.331 -17.269 1.00 0.00 C ATOM 0 H LEU B 50 24.421 -18.456 -14.225 1.00 0.00 H new ATOM 0 HA LEU B 50 24.539 -16.979 -16.783 1.00 0.00 H new ATOM 0 HB2 LEU B 50 25.296 -16.244 -14.235 1.00 0.00 H new ATOM 0 HB3 LEU B 50 26.800 -16.871 -14.878 1.00 0.00 H new ATOM 0 HG LEU B 50 25.156 -14.559 -15.921 1.00 0.00 H new ATOM 0 HD11 LEU B 50 27.253 -13.317 -15.567 1.00 0.00 H new ATOM 0 HD12 LEU B 50 26.670 -14.071 -14.064 1.00 0.00 H new ATOM 0 HD13 LEU B 50 28.025 -14.801 -14.959 1.00 0.00 H new ATOM 0 HD21 LEU B 50 26.797 -14.370 -17.751 1.00 0.00 H new ATOM 0 HD22 LEU B 50 27.550 -15.895 -17.227 1.00 0.00 H new ATOM 0 HD23 LEU B 50 25.880 -15.892 -17.842 1.00 0.00 H new