USER MOD reduce.3.24.130724 H: found=0, std=0, add=739, rem=0, adj=14 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= 0.00732 USER MOD Single : A 9 THR OG1 : rot 76:sc= 0.0532 USER MOD Single : A 12 THR OG1 : rot 180:sc= -0.149 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= 0 USER MOD Single : A 33 ASN : amide:sc= -0.769 X(o=-0.77,f=-0.37) USER MOD Single : A 36 ASN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 38 THR OG1 : rot 44:sc= 0.168 USER MOD Single : A 43 THR OG1 : rot 13:sc= 0.611 USER MOD Single : A 45 THR OG1 : rot 180:sc= -0.157 USER MOD Single : A 49 GLN : amide:sc= -1.47 K(o=-1.5,f=-2.1) USER MOD Single : B 7 SER OG : rot 180:sc= -1.32 USER MOD Single : B 9 THR OG1 : rot 180:sc= 0 USER MOD Single : B 12 THR OG1 : rot 180:sc= -0.183 USER MOD Single : B 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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= -2.2! USER MOD Single : B 33 ASN : amide:sc= -0.661 X(o=-0.66,f=-0.91) USER MOD Single : B 36 ASN : amide:sc= 0 X(o=0,f=-0.055) USER MOD Single : B 38 THR OG1 : rot 44:sc= 0.0947 USER MOD Single : B 45 THR OG1 : rot -150:sc= -0.579 USER MOD Single : B 49 GLN :FLIP amide:sc= -0.928 F(o=-1.6!,f=-0.93) USER MOD ----------------------------------------------------------------- ATOM 16 N ARG A 3 3.608 -2.133 1.442 1.00 0.00 N ATOM 17 CA ARG A 3 5.029 -2.390 1.642 1.00 0.00 C ATOM 18 C ARG A 3 5.525 -3.473 0.689 1.00 0.00 C ATOM 19 O ARG A 3 4.871 -4.500 0.505 1.00 0.00 O ATOM 20 CB ARG A 3 5.294 -2.809 3.090 1.00 0.00 C ATOM 21 CG ARG A 3 6.731 -3.229 3.348 1.00 0.00 C ATOM 22 CD ARG A 3 6.866 -4.742 3.414 1.00 0.00 C ATOM 23 NE ARG A 3 7.840 -5.162 4.417 1.00 0.00 N ATOM 24 CZ ARG A 3 7.609 -5.131 5.725 1.00 0.00 C ATOM 25 NH1 ARG A 3 6.441 -4.702 6.185 1.00 0.00 N ATOM 26 NH2 ARG A 3 8.546 -5.530 6.576 1.00 0.00 N ATOM 0 HA ARG A 3 5.573 -1.469 1.432 1.00 0.00 H new ATOM 0 HB2 ARG A 3 5.042 -1.980 3.751 1.00 0.00 H new ATOM 0 HB3 ARG A 3 4.631 -3.635 3.348 1.00 0.00 H new ATOM 0 HG2 ARG A 3 7.372 -2.840 2.557 1.00 0.00 H new ATOM 0 HG3 ARG A 3 7.077 -2.791 4.284 1.00 0.00 H new ATOM 0 HD2 ARG A 3 5.896 -5.183 3.644 1.00 0.00 H new ATOM 0 HD3 ARG A 3 7.165 -5.122 2.437 1.00 0.00 H new ATOM 0 HE ARG A 3 8.748 -5.498 4.096 1.00 0.00 H new ATOM 0 HH11 ARG A 3 5.718 -4.395 5.534 1.00 0.00 H new ATOM 0 HH12 ARG A 3 6.266 -4.679 7.190 1.00 0.00 H new ATOM 0 HH21 ARG A 3 9.445 -5.861 6.226 1.00 0.00 H new ATOM 0 HH22 ARG A 3 8.367 -5.506 7.580 1.00 0.00 H new ATOM 40 N VAL A 4 6.685 -3.236 0.085 1.00 0.00 N ATOM 41 CA VAL A 4 7.270 -4.191 -0.849 1.00 0.00 C ATOM 42 C VAL A 4 8.644 -4.653 -0.375 1.00 0.00 C ATOM 43 O VAL A 4 9.510 -3.836 -0.062 1.00 0.00 O ATOM 44 CB VAL A 4 7.402 -3.588 -2.259 1.00 0.00 C ATOM 45 CG1 VAL A 4 7.907 -4.633 -3.242 1.00 0.00 C ATOM 46 CG2 VAL A 4 6.072 -3.011 -2.718 1.00 0.00 C ATOM 0 H VAL A 4 7.238 -2.391 0.226 1.00 0.00 H new ATOM 0 HA VAL A 4 6.596 -5.047 -0.890 1.00 0.00 H new ATOM 0 HB VAL A 4 8.130 -2.778 -2.222 1.00 0.00 H new ATOM 0 HG11 VAL A 4 7.994 -4.188 -4.233 1.00 0.00 H new ATOM 0 HG12 VAL A 4 8.884 -4.994 -2.919 1.00 0.00 H new ATOM 0 HG13 VAL A 4 7.206 -5.467 -3.279 1.00 0.00 H new ATOM 0 HG21 VAL A 4 6.184 -2.589 -3.717 1.00 0.00 H new ATOM 0 HG22 VAL A 4 5.321 -3.801 -2.740 1.00 0.00 H new ATOM 0 HG23 VAL A 4 5.757 -2.229 -2.027 1.00 0.00 H new ATOM 56 N ARG A 5 8.836 -5.967 -0.325 1.00 0.00 N ATOM 57 CA ARG A 5 10.104 -6.538 0.112 1.00 0.00 C ATOM 58 C ARG A 5 10.602 -7.581 -0.884 1.00 0.00 C ATOM 59 O ARG A 5 9.875 -8.507 -1.243 1.00 0.00 O ATOM 60 CB ARG A 5 9.953 -7.170 1.497 1.00 0.00 C ATOM 61 CG ARG A 5 11.166 -7.975 1.934 1.00 0.00 C ATOM 62 CD ARG A 5 11.054 -8.407 3.388 1.00 0.00 C ATOM 63 NE ARG A 5 10.874 -9.851 3.517 1.00 0.00 N ATOM 64 CZ ARG A 5 10.567 -10.453 4.660 1.00 0.00 C ATOM 65 NH1 ARG A 5 10.406 -9.741 5.767 1.00 0.00 N ATOM 66 NH2 ARG A 5 10.420 -11.772 4.698 1.00 0.00 N ATOM 0 H ARG A 5 8.129 -6.656 -0.582 1.00 0.00 H new ATOM 0 HA ARG A 5 10.837 -5.733 0.166 1.00 0.00 H new ATOM 0 HB2 ARG A 5 9.767 -6.383 2.228 1.00 0.00 H new ATOM 0 HB3 ARG A 5 9.077 -7.819 1.498 1.00 0.00 H new ATOM 0 HG2 ARG A 5 11.268 -8.855 1.299 1.00 0.00 H new ATOM 0 HG3 ARG A 5 12.068 -7.378 1.799 1.00 0.00 H new ATOM 0 HD2 ARG A 5 11.952 -8.104 3.927 1.00 0.00 H new ATOM 0 HD3 ARG A 5 10.214 -7.894 3.855 1.00 0.00 H new ATOM 0 HE ARG A 5 10.990 -10.428 2.684 1.00 0.00 H new ATOM 0 HH11 ARG A 5 10.518 -8.727 5.742 1.00 0.00 H new ATOM 0 HH12 ARG A 5 10.170 -10.207 6.643 1.00 0.00 H new ATOM 0 HH21 ARG A 5 10.543 -12.324 3.849 1.00 0.00 H new ATOM 0 HH22 ARG A 5 10.184 -12.234 5.576 1.00 0.00 H new ATOM 80 N ILE A 6 11.846 -7.424 -1.325 1.00 0.00 N ATOM 81 CA ILE A 6 12.440 -8.352 -2.279 1.00 0.00 C ATOM 82 C ILE A 6 13.738 -8.941 -1.736 1.00 0.00 C ATOM 83 O ILE A 6 14.650 -8.210 -1.349 1.00 0.00 O ATOM 84 CB ILE A 6 12.726 -7.667 -3.628 1.00 0.00 C ATOM 85 CG1 ILE A 6 11.427 -7.137 -4.241 1.00 0.00 C ATOM 86 CG2 ILE A 6 13.410 -8.637 -4.580 1.00 0.00 C ATOM 87 CD1 ILE A 6 11.634 -6.382 -5.535 1.00 0.00 C ATOM 0 H ILE A 6 12.461 -6.663 -1.037 1.00 0.00 H new ATOM 0 HA ILE A 6 11.716 -9.152 -2.434 1.00 0.00 H new ATOM 0 HB ILE A 6 13.395 -6.824 -3.456 1.00 0.00 H new ATOM 0 HG12 ILE A 6 10.752 -7.974 -4.422 1.00 0.00 H new ATOM 0 HG13 ILE A 6 10.936 -6.481 -3.522 1.00 0.00 H new ATOM 0 HG21 ILE A 6 13.606 -8.138 -5.529 1.00 0.00 H new ATOM 0 HG22 ILE A 6 14.352 -8.971 -4.145 1.00 0.00 H new ATOM 0 HG23 ILE A 6 12.763 -9.498 -4.749 1.00 0.00 H new ATOM 0 HD11 ILE A 6 10.672 -6.036 -5.912 1.00 0.00 H new ATOM 0 HD12 ILE A 6 12.283 -5.525 -5.356 1.00 0.00 H new ATOM 0 HD13 ILE A 6 12.096 -7.040 -6.270 1.00 0.00 H new ATOM 99 N SER A 7 13.815 -10.268 -1.712 1.00 0.00 N ATOM 100 CA SER A 7 15.000 -10.956 -1.215 1.00 0.00 C ATOM 101 C SER A 7 15.826 -11.518 -2.369 1.00 0.00 C ATOM 102 O SER A 7 15.350 -12.353 -3.138 1.00 0.00 O ATOM 103 CB SER A 7 14.599 -12.085 -0.263 1.00 0.00 C ATOM 104 OG SER A 7 13.201 -12.311 -0.302 1.00 0.00 O ATOM 0 H SER A 7 13.070 -10.888 -2.031 1.00 0.00 H new ATOM 0 HA SER A 7 15.609 -10.233 -0.673 1.00 0.00 H new ATOM 0 HB2 SER A 7 15.126 -12.999 -0.535 1.00 0.00 H new ATOM 0 HB3 SER A 7 14.902 -11.833 0.753 1.00 0.00 H new ATOM 0 HG SER A 7 12.970 -13.038 0.313 1.00 0.00 H new ATOM 110 N ILE A 8 17.065 -11.053 -2.482 1.00 0.00 N ATOM 111 CA ILE A 8 17.958 -11.509 -3.540 1.00 0.00 C ATOM 112 C ILE A 8 19.157 -12.255 -2.965 1.00 0.00 C ATOM 113 O ILE A 8 19.823 -11.771 -2.048 1.00 0.00 O ATOM 114 CB ILE A 8 18.463 -10.332 -4.397 1.00 0.00 C ATOM 115 CG1 ILE A 8 19.296 -9.373 -3.545 1.00 0.00 C ATOM 116 CG2 ILE A 8 17.291 -9.601 -5.035 1.00 0.00 C ATOM 117 CD1 ILE A 8 20.786 -9.506 -3.768 1.00 0.00 C ATOM 0 H ILE A 8 17.474 -10.361 -1.854 1.00 0.00 H new ATOM 0 HA ILE A 8 17.380 -12.186 -4.170 1.00 0.00 H new ATOM 0 HB ILE A 8 19.097 -10.726 -5.192 1.00 0.00 H new ATOM 0 HG12 ILE A 8 18.994 -8.349 -3.764 1.00 0.00 H new ATOM 0 HG13 ILE A 8 19.077 -9.551 -2.492 1.00 0.00 H new ATOM 0 HG21 ILE A 8 17.663 -8.772 -5.637 1.00 0.00 H new ATOM 0 HG22 ILE A 8 16.735 -10.290 -5.670 1.00 0.00 H new ATOM 0 HG23 ILE A 8 16.634 -9.216 -4.255 1.00 0.00 H new ATOM 0 HD11 ILE A 8 21.314 -8.796 -3.131 1.00 0.00 H new ATOM 0 HD12 ILE A 8 21.102 -10.520 -3.521 1.00 0.00 H new ATOM 0 HD13 ILE A 8 21.017 -9.298 -4.813 1.00 0.00 H new ATOM 129 N THR A 9 19.429 -13.436 -3.510 1.00 0.00 N ATOM 130 CA THR A 9 20.548 -14.250 -3.051 1.00 0.00 C ATOM 131 C THR A 9 21.653 -14.306 -4.101 1.00 0.00 C ATOM 132 O THR A 9 21.384 -14.265 -5.301 1.00 0.00 O ATOM 133 CB THR A 9 20.100 -15.685 -2.717 1.00 0.00 C ATOM 134 OG1 THR A 9 18.689 -15.713 -2.472 1.00 0.00 O ATOM 135 CG2 THR A 9 20.842 -16.213 -1.498 1.00 0.00 C ATOM 0 H THR A 9 18.890 -13.851 -4.270 1.00 0.00 H new ATOM 0 HA THR A 9 20.932 -13.778 -2.147 1.00 0.00 H new ATOM 0 HB THR A 9 20.333 -16.323 -3.569 1.00 0.00 H new ATOM 0 HG1 THR A 9 18.208 -15.657 -3.324 1.00 0.00 H new ATOM 0 HG21 THR A 9 20.509 -17.228 -1.281 1.00 0.00 H new ATOM 0 HG22 THR A 9 21.913 -16.217 -1.698 1.00 0.00 H new ATOM 0 HG23 THR A 9 20.636 -15.572 -0.641 1.00 0.00 H new ATOM 143 N ALA A 10 22.896 -14.402 -3.640 1.00 0.00 N ATOM 144 CA ALA A 10 24.041 -14.468 -4.540 1.00 0.00 C ATOM 145 C ALA A 10 25.142 -15.351 -3.963 1.00 0.00 C ATOM 146 O ALA A 10 25.123 -15.691 -2.780 1.00 0.00 O ATOM 147 CB ALA A 10 24.574 -13.070 -4.817 1.00 0.00 C ATOM 0 H ALA A 10 23.136 -14.436 -2.649 1.00 0.00 H new ATOM 0 HA ALA A 10 23.710 -14.912 -5.479 1.00 0.00 H new ATOM 0 HB1 ALA A 10 25.429 -13.133 -5.490 1.00 0.00 H new ATOM 0 HB2 ALA A 10 23.792 -12.467 -5.279 1.00 0.00 H new ATOM 0 HB3 ALA A 10 24.883 -12.606 -3.880 1.00 0.00 H new ATOM 153 N ARG A 11 26.100 -15.721 -4.807 1.00 0.00 N ATOM 154 CA ARG A 11 27.208 -16.568 -4.382 1.00 0.00 C ATOM 155 C ARG A 11 28.054 -15.864 -3.325 1.00 0.00 C ATOM 156 O ARG A 11 28.364 -16.436 -2.279 1.00 0.00 O ATOM 157 CB ARG A 11 28.080 -16.944 -5.581 1.00 0.00 C ATOM 158 CG ARG A 11 29.388 -17.616 -5.196 1.00 0.00 C ATOM 159 CD ARG A 11 29.147 -18.932 -4.475 1.00 0.00 C ATOM 160 NE ARG A 11 29.934 -19.037 -3.249 1.00 0.00 N ATOM 161 CZ ARG A 11 29.826 -20.044 -2.390 1.00 0.00 C ATOM 162 NH1 ARG A 11 28.968 -21.028 -2.621 1.00 0.00 N ATOM 163 NH2 ARG A 11 30.578 -20.069 -1.296 1.00 0.00 N ATOM 0 H ARG A 11 26.131 -15.447 -5.789 1.00 0.00 H new ATOM 0 HA ARG A 11 26.792 -17.476 -3.946 1.00 0.00 H new ATOM 0 HB2 ARG A 11 27.517 -17.611 -6.234 1.00 0.00 H new ATOM 0 HB3 ARG A 11 28.299 -16.045 -6.156 1.00 0.00 H new ATOM 0 HG2 ARG A 11 29.984 -17.794 -6.091 1.00 0.00 H new ATOM 0 HG3 ARG A 11 29.966 -16.950 -4.556 1.00 0.00 H new ATOM 0 HD2 ARG A 11 28.088 -19.025 -4.235 1.00 0.00 H new ATOM 0 HD3 ARG A 11 29.397 -19.760 -5.138 1.00 0.00 H new ATOM 0 HE ARG A 11 30.603 -18.296 -3.041 1.00 0.00 H new ATOM 0 HH11 ARG A 11 28.389 -21.013 -3.460 1.00 0.00 H new ATOM 0 HH12 ARG A 11 28.887 -21.800 -1.959 1.00 0.00 H new ATOM 0 HH21 ARG A 11 31.240 -19.314 -1.115 1.00 0.00 H new ATOM 0 HH22 ARG A 11 30.494 -20.843 -0.637 1.00 0.00 H new ATOM 177 N THR A 12 28.427 -14.619 -3.605 1.00 0.00 N ATOM 178 CA THR A 12 29.238 -13.838 -2.680 1.00 0.00 C ATOM 179 C THR A 12 28.608 -12.477 -2.410 1.00 0.00 C ATOM 180 O THR A 12 27.604 -12.113 -3.023 1.00 0.00 O ATOM 181 CB THR A 12 30.666 -13.632 -3.222 1.00 0.00 C ATOM 182 OG1 THR A 12 31.497 -13.060 -2.206 1.00 0.00 O ATOM 183 CG2 THR A 12 30.655 -12.726 -4.444 1.00 0.00 C ATOM 0 H THR A 12 28.180 -14.130 -4.465 1.00 0.00 H new ATOM 0 HA THR A 12 29.288 -14.403 -1.749 1.00 0.00 H new ATOM 0 HB THR A 12 31.065 -14.604 -3.513 1.00 0.00 H new ATOM 0 HG1 THR A 12 32.403 -12.934 -2.557 1.00 0.00 H new ATOM 0 HG21 THR A 12 31.674 -12.595 -4.809 1.00 0.00 H new ATOM 0 HG22 THR A 12 30.045 -13.177 -5.226 1.00 0.00 H new ATOM 0 HG23 THR A 12 30.239 -11.755 -4.174 1.00 0.00 H new ATOM 191 N LYS A 13 29.203 -11.727 -1.488 1.00 0.00 N ATOM 192 CA LYS A 13 28.701 -10.403 -1.138 1.00 0.00 C ATOM 193 C LYS A 13 28.744 -9.468 -2.342 1.00 0.00 C ATOM 194 O LYS A 13 27.849 -8.645 -2.534 1.00 0.00 O ATOM 195 CB LYS A 13 29.522 -9.812 0.011 1.00 0.00 C ATOM 196 CG LYS A 13 31.011 -9.739 -0.281 1.00 0.00 C ATOM 197 CD LYS A 13 31.821 -9.566 0.993 1.00 0.00 C ATOM 198 CE LYS A 13 33.089 -10.406 0.965 1.00 0.00 C ATOM 199 NZ LYS A 13 32.814 -11.837 1.274 1.00 0.00 N ATOM 0 H LYS A 13 30.033 -12.014 -0.970 1.00 0.00 H new ATOM 0 HA LYS A 13 27.664 -10.507 -0.820 1.00 0.00 H new ATOM 0 HB2 LYS A 13 29.154 -8.810 0.232 1.00 0.00 H new ATOM 0 HB3 LYS A 13 29.365 -10.414 0.906 1.00 0.00 H new ATOM 0 HG2 LYS A 13 31.327 -10.647 -0.794 1.00 0.00 H new ATOM 0 HG3 LYS A 13 31.210 -8.906 -0.956 1.00 0.00 H new ATOM 0 HD2 LYS A 13 32.082 -8.515 1.120 1.00 0.00 H new ATOM 0 HD3 LYS A 13 31.214 -9.850 1.853 1.00 0.00 H new ATOM 0 HE2 LYS A 13 33.553 -10.330 -0.018 1.00 0.00 H new ATOM 0 HE3 LYS A 13 33.803 -10.009 1.687 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 33.703 -12.376 1.245 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 32.394 -11.913 2.222 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 32.152 -12.223 0.571 1.00 0.00 H new ATOM 213 N LYS A 14 29.790 -9.601 -3.151 1.00 0.00 N ATOM 214 CA LYS A 14 29.949 -8.770 -4.338 1.00 0.00 C ATOM 215 C LYS A 14 28.798 -8.990 -5.315 1.00 0.00 C ATOM 216 O LYS A 14 28.310 -8.046 -5.934 1.00 0.00 O ATOM 217 CB LYS A 14 31.281 -9.078 -5.027 1.00 0.00 C ATOM 218 CG LYS A 14 32.230 -7.893 -5.074 1.00 0.00 C ATOM 219 CD LYS A 14 33.017 -7.756 -3.781 1.00 0.00 C ATOM 220 CE LYS A 14 32.552 -6.557 -2.970 1.00 0.00 C ATOM 221 NZ LYS A 14 33.658 -5.973 -2.160 1.00 0.00 N ATOM 0 H LYS A 14 30.540 -10.277 -3.006 1.00 0.00 H new ATOM 0 HA LYS A 14 29.942 -7.726 -4.023 1.00 0.00 H new ATOM 0 HB2 LYS A 14 31.768 -9.902 -4.506 1.00 0.00 H new ATOM 0 HB3 LYS A 14 31.085 -9.416 -6.044 1.00 0.00 H new ATOM 0 HG2 LYS A 14 32.920 -8.011 -5.910 1.00 0.00 H new ATOM 0 HG3 LYS A 14 31.664 -6.979 -5.255 1.00 0.00 H new ATOM 0 HD2 LYS A 14 32.905 -8.663 -3.188 1.00 0.00 H new ATOM 0 HD3 LYS A 14 34.078 -7.653 -4.009 1.00 0.00 H new ATOM 0 HE2 LYS A 14 32.153 -5.797 -3.642 1.00 0.00 H new ATOM 0 HE3 LYS A 14 31.738 -6.858 -2.310 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 33.301 -5.158 -1.622 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 34.022 -6.691 -1.501 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 34.424 -5.662 -2.791 1.00 0.00 H new ATOM 235 N GLU A 15 28.369 -10.241 -5.445 1.00 0.00 N ATOM 236 CA GLU A 15 27.274 -10.583 -6.345 1.00 0.00 C ATOM 237 C GLU A 15 25.959 -9.986 -5.854 1.00 0.00 C ATOM 238 O GLU A 15 25.245 -9.324 -6.607 1.00 0.00 O ATOM 239 CB GLU A 15 27.142 -12.103 -6.470 1.00 0.00 C ATOM 240 CG GLU A 15 28.102 -12.716 -7.476 1.00 0.00 C ATOM 241 CD GLU A 15 27.939 -12.135 -8.867 1.00 0.00 C ATOM 242 OE1 GLU A 15 26.818 -12.209 -9.413 1.00 0.00 O ATOM 243 OE2 GLU A 15 28.932 -11.606 -9.409 1.00 0.00 O ATOM 0 H GLU A 15 28.763 -11.034 -4.939 1.00 0.00 H new ATOM 0 HA GLU A 15 27.500 -10.163 -7.325 1.00 0.00 H new ATOM 0 HB2 GLU A 15 27.314 -12.556 -5.494 1.00 0.00 H new ATOM 0 HB3 GLU A 15 26.120 -12.348 -6.759 1.00 0.00 H new ATOM 0 HG2 GLU A 15 29.126 -12.558 -7.138 1.00 0.00 H new ATOM 0 HG3 GLU A 15 27.942 -13.793 -7.515 1.00 0.00 H new ATOM 250 N ALA A 16 25.644 -10.226 -4.585 1.00 0.00 N ATOM 251 CA ALA A 16 24.416 -9.712 -3.992 1.00 0.00 C ATOM 252 C ALA A 16 24.374 -8.189 -4.050 1.00 0.00 C ATOM 253 O ALA A 16 23.327 -7.598 -4.309 1.00 0.00 O ATOM 254 CB ALA A 16 24.284 -10.191 -2.554 1.00 0.00 C ATOM 0 H ALA A 16 26.223 -10.773 -3.948 1.00 0.00 H new ATOM 0 HA ALA A 16 23.575 -10.095 -4.570 1.00 0.00 H new ATOM 0 HB1 ALA A 16 23.362 -9.800 -2.123 1.00 0.00 H new ATOM 0 HB2 ALA A 16 24.260 -11.281 -2.534 1.00 0.00 H new ATOM 0 HB3 ALA A 16 25.135 -9.836 -1.973 1.00 0.00 H new ATOM 260 N GLU A 17 25.520 -7.560 -3.807 1.00 0.00 N ATOM 261 CA GLU A 17 25.612 -6.105 -3.831 1.00 0.00 C ATOM 262 C GLU A 17 25.216 -5.557 -5.199 1.00 0.00 C ATOM 263 O GLU A 17 24.542 -4.532 -5.298 1.00 0.00 O ATOM 264 CB GLU A 17 27.032 -5.656 -3.481 1.00 0.00 C ATOM 265 CG GLU A 17 27.139 -4.973 -2.128 1.00 0.00 C ATOM 266 CD GLU A 17 27.108 -3.461 -2.234 1.00 0.00 C ATOM 267 OE1 GLU A 17 27.663 -2.924 -3.215 1.00 0.00 O ATOM 268 OE2 GLU A 17 26.530 -2.814 -1.335 1.00 0.00 O ATOM 0 H GLU A 17 26.397 -8.035 -3.592 1.00 0.00 H new ATOM 0 HA GLU A 17 24.920 -5.711 -3.087 1.00 0.00 H new ATOM 0 HB2 GLU A 17 27.692 -6.524 -3.494 1.00 0.00 H new ATOM 0 HB3 GLU A 17 27.388 -4.973 -4.252 1.00 0.00 H new ATOM 0 HG2 GLU A 17 26.319 -5.306 -1.491 1.00 0.00 H new ATOM 0 HG3 GLU A 17 28.065 -5.281 -1.642 1.00 0.00 H new ATOM 275 N LYS A 18 25.641 -6.248 -6.251 1.00 0.00 N ATOM 276 CA LYS A 18 25.331 -5.833 -7.615 1.00 0.00 C ATOM 277 C LYS A 18 23.824 -5.819 -7.850 1.00 0.00 C ATOM 278 O LYS A 18 23.283 -4.871 -8.419 1.00 0.00 O ATOM 279 CB LYS A 18 26.007 -6.768 -8.620 1.00 0.00 C ATOM 280 CG LYS A 18 27.515 -6.847 -8.459 1.00 0.00 C ATOM 281 CD LYS A 18 28.234 -6.060 -9.542 1.00 0.00 C ATOM 282 CE LYS A 18 29.744 -6.157 -9.393 1.00 0.00 C ATOM 283 NZ LYS A 18 30.313 -4.958 -8.717 1.00 0.00 N ATOM 0 H LYS A 18 26.201 -7.098 -6.186 1.00 0.00 H new ATOM 0 HA LYS A 18 25.712 -4.822 -7.756 1.00 0.00 H new ATOM 0 HB2 LYS A 18 25.586 -7.768 -8.513 1.00 0.00 H new ATOM 0 HB3 LYS A 18 25.775 -6.431 -9.630 1.00 0.00 H new ATOM 0 HG2 LYS A 18 27.798 -6.461 -7.479 1.00 0.00 H new ATOM 0 HG3 LYS A 18 27.831 -7.889 -8.495 1.00 0.00 H new ATOM 0 HD2 LYS A 18 27.939 -6.435 -10.522 1.00 0.00 H new ATOM 0 HD3 LYS A 18 27.929 -5.014 -9.496 1.00 0.00 H new ATOM 0 HE2 LYS A 18 29.996 -7.050 -8.821 1.00 0.00 H new ATOM 0 HE3 LYS A 18 30.200 -6.270 -10.377 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 31.344 -5.063 -8.635 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 30.095 -4.108 -9.276 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 29.898 -4.865 -7.768 1.00 0.00 H new ATOM 297 N PHE A 19 23.151 -6.876 -7.409 1.00 0.00 N ATOM 298 CA PHE A 19 21.706 -6.985 -7.571 1.00 0.00 C ATOM 299 C PHE A 19 20.984 -5.930 -6.739 1.00 0.00 C ATOM 300 O PHE A 19 20.078 -5.253 -7.225 1.00 0.00 O ATOM 301 CB PHE A 19 21.230 -8.383 -7.168 1.00 0.00 C ATOM 302 CG PHE A 19 21.439 -9.418 -8.236 1.00 0.00 C ATOM 303 CD1 PHE A 19 20.534 -9.551 -9.277 1.00 0.00 C ATOM 304 CD2 PHE A 19 22.540 -10.259 -8.199 1.00 0.00 C ATOM 305 CE1 PHE A 19 20.723 -10.503 -10.261 1.00 0.00 C ATOM 306 CE2 PHE A 19 22.735 -11.212 -9.180 1.00 0.00 C ATOM 307 CZ PHE A 19 21.825 -11.335 -10.212 1.00 0.00 C ATOM 0 H PHE A 19 23.583 -7.670 -6.936 1.00 0.00 H new ATOM 0 HA PHE A 19 21.470 -6.817 -8.622 1.00 0.00 H new ATOM 0 HB2 PHE A 19 21.758 -8.692 -6.266 1.00 0.00 H new ATOM 0 HB3 PHE A 19 20.170 -8.339 -6.918 1.00 0.00 H new ATOM 0 HD1 PHE A 19 19.671 -8.903 -9.320 1.00 0.00 H new ATOM 0 HD2 PHE A 19 23.254 -10.168 -7.394 1.00 0.00 H new ATOM 0 HE1 PHE A 19 20.010 -10.596 -11.067 1.00 0.00 H new ATOM 0 HE2 PHE A 19 23.598 -11.860 -9.140 1.00 0.00 H new ATOM 0 HZ PHE A 19 21.975 -12.080 -10.979 1.00 0.00 H new ATOM 317 N ALA A 20 21.392 -5.796 -5.481 1.00 0.00 N ATOM 318 CA ALA A 20 20.786 -4.824 -4.581 1.00 0.00 C ATOM 319 C ALA A 20 20.847 -3.418 -5.169 1.00 0.00 C ATOM 320 O ALA A 20 19.872 -2.670 -5.116 1.00 0.00 O ATOM 321 CB ALA A 20 21.473 -4.860 -3.224 1.00 0.00 C ATOM 0 H ALA A 20 22.140 -6.349 -5.063 1.00 0.00 H new ATOM 0 HA ALA A 20 19.737 -5.091 -4.452 1.00 0.00 H new ATOM 0 HB1 ALA A 20 21.010 -4.128 -2.562 1.00 0.00 H new ATOM 0 HB2 ALA A 20 21.373 -5.856 -2.792 1.00 0.00 H new ATOM 0 HB3 ALA A 20 22.530 -4.622 -3.345 1.00 0.00 H new ATOM 327 N ALA A 21 22.000 -3.066 -5.729 1.00 0.00 N ATOM 328 CA ALA A 21 22.187 -1.751 -6.329 1.00 0.00 C ATOM 329 C ALA A 21 21.132 -1.478 -7.395 1.00 0.00 C ATOM 330 O ALA A 21 20.550 -0.394 -7.442 1.00 0.00 O ATOM 331 CB ALA A 21 23.583 -1.636 -6.924 1.00 0.00 C ATOM 0 H ALA A 21 22.818 -3.673 -5.779 1.00 0.00 H new ATOM 0 HA ALA A 21 22.075 -1.002 -5.545 1.00 0.00 H new ATOM 0 HB1 ALA A 21 23.709 -0.649 -7.369 1.00 0.00 H new ATOM 0 HB2 ALA A 21 24.326 -1.778 -6.139 1.00 0.00 H new ATOM 0 HB3 ALA A 21 23.716 -2.399 -7.691 1.00 0.00 H new ATOM 337 N ILE A 22 20.890 -2.467 -8.249 1.00 0.00 N ATOM 338 CA ILE A 22 19.904 -2.332 -9.314 1.00 0.00 C ATOM 339 C ILE A 22 18.501 -2.154 -8.744 1.00 0.00 C ATOM 340 O ILE A 22 17.767 -1.249 -9.144 1.00 0.00 O ATOM 341 CB ILE A 22 19.915 -3.556 -10.248 1.00 0.00 C ATOM 342 CG1 ILE A 22 21.295 -3.726 -10.887 1.00 0.00 C ATOM 343 CG2 ILE A 22 18.843 -3.414 -11.319 1.00 0.00 C ATOM 344 CD1 ILE A 22 21.636 -5.162 -11.218 1.00 0.00 C ATOM 0 H ILE A 22 21.363 -3.370 -8.224 1.00 0.00 H new ATOM 0 HA ILE A 22 20.176 -1.445 -9.887 1.00 0.00 H new ATOM 0 HB ILE A 22 19.697 -4.446 -9.658 1.00 0.00 H new ATOM 0 HG12 ILE A 22 21.340 -3.131 -11.799 1.00 0.00 H new ATOM 0 HG13 ILE A 22 22.051 -3.328 -10.210 1.00 0.00 H new ATOM 0 HG21 ILE A 22 18.863 -4.287 -11.972 1.00 0.00 H new ATOM 0 HG22 ILE A 22 17.864 -3.337 -10.846 1.00 0.00 H new ATOM 0 HG23 ILE A 22 19.033 -2.516 -11.907 1.00 0.00 H new ATOM 0 HD11 ILE A 22 22.628 -5.206 -11.668 1.00 0.00 H new ATOM 0 HD12 ILE A 22 21.624 -5.758 -10.306 1.00 0.00 H new ATOM 0 HD13 ILE A 22 20.902 -5.558 -11.920 1.00 0.00 H new ATOM 356 N LEU A 23 18.134 -3.021 -7.807 1.00 0.00 N ATOM 357 CA LEU A 23 16.818 -2.958 -7.180 1.00 0.00 C ATOM 358 C LEU A 23 16.558 -1.573 -6.597 1.00 0.00 C ATOM 359 O LEU A 23 15.458 -1.034 -6.719 1.00 0.00 O ATOM 360 CB LEU A 23 16.705 -4.016 -6.081 1.00 0.00 C ATOM 361 CG LEU A 23 15.717 -5.154 -6.344 1.00 0.00 C ATOM 362 CD1 LEU A 23 14.312 -4.606 -6.537 1.00 0.00 C ATOM 363 CD2 LEU A 23 16.148 -5.964 -7.558 1.00 0.00 C ATOM 0 H LEU A 23 18.729 -3.776 -7.465 1.00 0.00 H new ATOM 0 HA LEU A 23 16.068 -3.156 -7.946 1.00 0.00 H new ATOM 0 HB2 LEU A 23 17.692 -4.449 -5.918 1.00 0.00 H new ATOM 0 HB3 LEU A 23 16.418 -3.519 -5.154 1.00 0.00 H new ATOM 0 HG LEU A 23 15.711 -5.813 -5.476 1.00 0.00 H new ATOM 0 HD11 LEU A 23 13.623 -5.430 -6.723 1.00 0.00 H new ATOM 0 HD12 LEU A 23 14.004 -4.071 -5.639 1.00 0.00 H new ATOM 0 HD13 LEU A 23 14.301 -3.924 -7.388 1.00 0.00 H new ATOM 0 HD21 LEU A 23 15.434 -6.769 -7.730 1.00 0.00 H new ATOM 0 HD22 LEU A 23 16.183 -5.316 -8.434 1.00 0.00 H new ATOM 0 HD23 LEU A 23 17.136 -6.388 -7.380 1.00 0.00 H new ATOM 375 N ILE A 24 17.578 -1.002 -5.965 1.00 0.00 N ATOM 376 CA ILE A 24 17.460 0.322 -5.367 1.00 0.00 C ATOM 377 C ILE A 24 17.096 1.368 -6.414 1.00 0.00 C ATOM 378 O ILE A 24 16.251 2.232 -6.178 1.00 0.00 O ATOM 379 CB ILE A 24 18.768 0.743 -4.670 1.00 0.00 C ATOM 380 CG1 ILE A 24 19.121 -0.248 -3.559 1.00 0.00 C ATOM 381 CG2 ILE A 24 18.639 2.151 -4.109 1.00 0.00 C ATOM 382 CD1 ILE A 24 20.610 -0.439 -3.371 1.00 0.00 C ATOM 0 H ILE A 24 18.495 -1.435 -5.854 1.00 0.00 H new ATOM 0 HA ILE A 24 16.664 0.263 -4.624 1.00 0.00 H new ATOM 0 HB ILE A 24 19.573 0.738 -5.405 1.00 0.00 H new ATOM 0 HG12 ILE A 24 18.686 0.099 -2.622 1.00 0.00 H new ATOM 0 HG13 ILE A 24 18.665 -1.212 -3.784 1.00 0.00 H new ATOM 0 HG21 ILE A 24 19.571 2.434 -3.620 1.00 0.00 H new ATOM 0 HG22 ILE A 24 18.429 2.848 -4.920 1.00 0.00 H new ATOM 0 HG23 ILE A 24 17.825 2.181 -3.385 1.00 0.00 H new ATOM 0 HD11 ILE A 24 20.787 -1.154 -2.568 1.00 0.00 H new ATOM 0 HD12 ILE A 24 21.048 -0.816 -4.295 1.00 0.00 H new ATOM 0 HD13 ILE A 24 21.070 0.515 -3.114 1.00 0.00 H new ATOM 394 N LYS A 25 17.738 1.284 -7.575 1.00 0.00 N ATOM 395 CA LYS A 25 17.480 2.221 -8.662 1.00 0.00 C ATOM 396 C LYS A 25 16.055 2.072 -9.183 1.00 0.00 C ATOM 397 O LYS A 25 15.373 3.062 -9.449 1.00 0.00 O ATOM 398 CB LYS A 25 18.477 1.999 -9.801 1.00 0.00 C ATOM 399 CG LYS A 25 19.929 2.088 -9.365 1.00 0.00 C ATOM 400 CD LYS A 25 20.509 3.466 -9.634 1.00 0.00 C ATOM 401 CE LYS A 25 19.779 4.541 -8.843 1.00 0.00 C ATOM 402 NZ LYS A 25 20.677 5.677 -8.492 1.00 0.00 N ATOM 0 H LYS A 25 18.441 0.576 -7.787 1.00 0.00 H new ATOM 0 HA LYS A 25 17.601 3.232 -8.273 1.00 0.00 H new ATOM 0 HB2 LYS A 25 18.299 1.019 -10.243 1.00 0.00 H new ATOM 0 HB3 LYS A 25 18.295 2.738 -10.581 1.00 0.00 H new ATOM 0 HG2 LYS A 25 20.005 1.862 -8.301 1.00 0.00 H new ATOM 0 HG3 LYS A 25 20.515 1.336 -9.893 1.00 0.00 H new ATOM 0 HD2 LYS A 25 21.567 3.474 -9.371 1.00 0.00 H new ATOM 0 HD3 LYS A 25 20.443 3.688 -10.699 1.00 0.00 H new ATOM 0 HE2 LYS A 25 18.936 4.911 -9.426 1.00 0.00 H new ATOM 0 HE3 LYS A 25 19.370 4.106 -7.931 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 20.143 6.388 -7.954 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 21.468 5.328 -7.914 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 21.048 6.108 -9.363 1.00 0.00 H new ATOM 416 N VAL A 26 15.609 0.828 -9.325 1.00 0.00 N ATOM 417 CA VAL A 26 14.263 0.549 -9.812 1.00 0.00 C ATOM 418 C VAL A 26 13.209 1.059 -8.835 1.00 0.00 C ATOM 419 O VAL A 26 12.184 1.608 -9.242 1.00 0.00 O ATOM 420 CB VAL A 26 14.049 -0.960 -10.039 1.00 0.00 C ATOM 421 CG1 VAL A 26 12.740 -1.209 -10.771 1.00 0.00 C ATOM 422 CG2 VAL A 26 15.221 -1.553 -10.806 1.00 0.00 C ATOM 0 H VAL A 26 16.160 -0.003 -9.110 1.00 0.00 H new ATOM 0 HA VAL A 26 14.156 1.070 -10.763 1.00 0.00 H new ATOM 0 HB VAL A 26 13.993 -1.453 -9.068 1.00 0.00 H new ATOM 0 HG11 VAL A 26 12.606 -2.280 -10.922 1.00 0.00 H new ATOM 0 HG12 VAL A 26 11.912 -0.820 -10.178 1.00 0.00 H new ATOM 0 HG13 VAL A 26 12.762 -0.706 -11.738 1.00 0.00 H new ATOM 0 HG21 VAL A 26 15.054 -2.619 -10.958 1.00 0.00 H new ATOM 0 HG22 VAL A 26 15.311 -1.058 -11.773 1.00 0.00 H new ATOM 0 HG23 VAL A 26 16.139 -1.407 -10.237 1.00 0.00 H new ATOM 432 N PHE A 27 13.467 0.874 -7.545 1.00 0.00 N ATOM 433 CA PHE A 27 12.540 1.315 -6.509 1.00 0.00 C ATOM 434 C PHE A 27 12.427 2.837 -6.492 1.00 0.00 C ATOM 435 O PHE A 27 11.335 3.388 -6.359 1.00 0.00 O ATOM 436 CB PHE A 27 12.996 0.811 -5.138 1.00 0.00 C ATOM 437 CG PHE A 27 12.457 -0.546 -4.789 1.00 0.00 C ATOM 438 CD1 PHE A 27 11.092 -0.761 -4.694 1.00 0.00 C ATOM 439 CD2 PHE A 27 13.316 -1.608 -4.556 1.00 0.00 C ATOM 440 CE1 PHE A 27 10.593 -2.009 -4.372 1.00 0.00 C ATOM 441 CE2 PHE A 27 12.823 -2.859 -4.234 1.00 0.00 C ATOM 442 CZ PHE A 27 11.460 -3.060 -4.143 1.00 0.00 C ATOM 0 H PHE A 27 14.310 0.422 -7.192 1.00 0.00 H new ATOM 0 HA PHE A 27 11.558 0.898 -6.734 1.00 0.00 H new ATOM 0 HB2 PHE A 27 14.085 0.777 -5.116 1.00 0.00 H new ATOM 0 HB3 PHE A 27 12.684 1.524 -4.375 1.00 0.00 H new ATOM 0 HD1 PHE A 27 10.409 0.056 -4.874 1.00 0.00 H new ATOM 0 HD2 PHE A 27 14.383 -1.457 -4.627 1.00 0.00 H new ATOM 0 HE1 PHE A 27 9.526 -2.162 -4.299 1.00 0.00 H new ATOM 0 HE2 PHE A 27 13.503 -3.678 -4.054 1.00 0.00 H new ATOM 0 HZ PHE A 27 11.072 -4.037 -3.893 1.00 0.00 H new ATOM 452 N ALA A 28 13.565 3.510 -6.628 1.00 0.00 N ATOM 453 CA ALA A 28 13.595 4.967 -6.630 1.00 0.00 C ATOM 454 C ALA A 28 12.803 5.531 -7.805 1.00 0.00 C ATOM 455 O ALA A 28 12.017 6.464 -7.645 1.00 0.00 O ATOM 456 CB ALA A 28 15.032 5.466 -6.672 1.00 0.00 C ATOM 0 H ALA A 28 14.478 3.069 -6.738 1.00 0.00 H new ATOM 0 HA ALA A 28 13.128 5.316 -5.709 1.00 0.00 H new ATOM 0 HB1 ALA A 28 15.039 6.556 -6.673 1.00 0.00 H new ATOM 0 HB2 ALA A 28 15.570 5.101 -5.797 1.00 0.00 H new ATOM 0 HB3 ALA A 28 15.518 5.099 -7.576 1.00 0.00 H new ATOM 462 N GLU A 29 13.017 4.959 -8.986 1.00 0.00 N ATOM 463 CA GLU A 29 12.324 5.407 -10.188 1.00 0.00 C ATOM 464 C GLU A 29 10.839 5.063 -10.119 1.00 0.00 C ATOM 465 O GLU A 29 10.023 5.637 -10.842 1.00 0.00 O ATOM 466 CB GLU A 29 12.949 4.770 -11.431 1.00 0.00 C ATOM 467 CG GLU A 29 12.315 3.445 -11.821 1.00 0.00 C ATOM 468 CD GLU A 29 11.261 3.598 -12.900 1.00 0.00 C ATOM 469 OE1 GLU A 29 11.475 4.407 -13.827 1.00 0.00 O ATOM 470 OE2 GLU A 29 10.223 2.909 -12.818 1.00 0.00 O ATOM 0 H GLU A 29 13.664 4.185 -9.136 1.00 0.00 H new ATOM 0 HA GLU A 29 12.426 6.490 -10.253 1.00 0.00 H new ATOM 0 HB2 GLU A 29 12.863 5.464 -12.267 1.00 0.00 H new ATOM 0 HB3 GLU A 29 14.013 4.615 -11.253 1.00 0.00 H new ATOM 0 HG2 GLU A 29 13.091 2.764 -12.170 1.00 0.00 H new ATOM 0 HG3 GLU A 29 11.864 2.989 -10.940 1.00 0.00 H new ATOM 477 N LEU A 30 10.495 4.123 -9.246 1.00 0.00 N ATOM 478 CA LEU A 30 9.108 3.701 -9.082 1.00 0.00 C ATOM 479 C LEU A 30 8.413 4.523 -8.003 1.00 0.00 C ATOM 480 O LEU A 30 7.223 4.347 -7.743 1.00 0.00 O ATOM 481 CB LEU A 30 9.045 2.214 -8.727 1.00 0.00 C ATOM 482 CG LEU A 30 9.257 1.238 -9.885 1.00 0.00 C ATOM 483 CD1 LEU A 30 9.746 -0.106 -9.367 1.00 0.00 C ATOM 484 CD2 LEU A 30 7.972 1.069 -10.682 1.00 0.00 C ATOM 0 H LEU A 30 11.157 3.638 -8.640 1.00 0.00 H new ATOM 0 HA LEU A 30 8.590 3.865 -10.027 1.00 0.00 H new ATOM 0 HB2 LEU A 30 9.797 2.011 -7.965 1.00 0.00 H new ATOM 0 HB3 LEU A 30 8.073 2.009 -8.279 1.00 0.00 H new ATOM 0 HG LEU A 30 10.020 1.649 -10.547 1.00 0.00 H new ATOM 0 HD11 LEU A 30 9.891 -0.788 -10.205 1.00 0.00 H new ATOM 0 HD12 LEU A 30 10.691 0.029 -8.841 1.00 0.00 H new ATOM 0 HD13 LEU A 30 9.007 -0.523 -8.684 1.00 0.00 H new ATOM 0 HD21 LEU A 30 8.142 0.371 -11.502 1.00 0.00 H new ATOM 0 HD22 LEU A 30 7.189 0.681 -10.031 1.00 0.00 H new ATOM 0 HD23 LEU A 30 7.664 2.034 -11.085 1.00 0.00 H new ATOM 496 N GLY A 31 9.163 5.426 -7.377 1.00 0.00 N ATOM 497 CA GLY A 31 8.601 6.264 -6.334 1.00 0.00 C ATOM 498 C GLY A 31 8.680 5.617 -4.966 1.00 0.00 C ATOM 499 O GLY A 31 8.051 6.082 -4.015 1.00 0.00 O ATOM 0 H GLY A 31 10.150 5.592 -7.574 1.00 0.00 H new ATOM 0 HA2 GLY A 31 9.130 7.217 -6.313 1.00 0.00 H new ATOM 0 HA3 GLY A 31 7.559 6.483 -6.570 1.00 0.00 H new ATOM 503 N TYR A 32 9.453 4.542 -4.865 1.00 0.00 N ATOM 504 CA TYR A 32 9.608 3.827 -3.603 1.00 0.00 C ATOM 505 C TYR A 32 10.838 4.319 -2.846 1.00 0.00 C ATOM 506 O TYR A 32 11.517 3.546 -2.173 1.00 0.00 O ATOM 507 CB TYR A 32 9.719 2.323 -3.855 1.00 0.00 C ATOM 508 CG TYR A 32 8.439 1.698 -4.364 1.00 0.00 C ATOM 509 CD1 TYR A 32 7.925 2.038 -5.609 1.00 0.00 C ATOM 510 CD2 TYR A 32 7.744 0.769 -3.599 1.00 0.00 C ATOM 511 CE1 TYR A 32 6.756 1.470 -6.078 1.00 0.00 C ATOM 512 CE2 TYR A 32 6.576 0.196 -4.061 1.00 0.00 C ATOM 513 CZ TYR A 32 6.085 0.549 -5.300 1.00 0.00 C ATOM 514 OH TYR A 32 4.920 -0.019 -5.763 1.00 0.00 O ATOM 0 H TYR A 32 9.982 4.146 -5.642 1.00 0.00 H new ATOM 0 HA TYR A 32 8.726 4.022 -2.993 1.00 0.00 H new ATOM 0 HB2 TYR A 32 10.514 2.142 -4.578 1.00 0.00 H new ATOM 0 HB3 TYR A 32 10.012 1.829 -2.929 1.00 0.00 H new ATOM 0 HD1 TYR A 32 8.448 2.758 -6.221 1.00 0.00 H new ATOM 0 HD2 TYR A 32 8.124 0.491 -2.627 1.00 0.00 H new ATOM 0 HE1 TYR A 32 6.370 1.745 -7.048 1.00 0.00 H new ATOM 0 HE2 TYR A 32 6.049 -0.526 -3.454 1.00 0.00 H new ATOM 0 HH TYR A 32 4.574 -0.647 -5.095 1.00 0.00 H new ATOM 524 N ASN A 33 11.118 5.614 -2.963 1.00 0.00 N ATOM 525 CA ASN A 33 12.265 6.211 -2.290 1.00 0.00 C ATOM 526 C ASN A 33 12.296 5.819 -0.816 1.00 0.00 C ATOM 527 O ASN A 33 11.289 5.383 -0.258 1.00 0.00 O ATOM 528 CB ASN A 33 12.225 7.735 -2.424 1.00 0.00 C ATOM 529 CG ASN A 33 13.557 8.379 -2.094 1.00 0.00 C ATOM 530 OD1 ASN A 33 14.428 8.508 -2.955 1.00 0.00 O ATOM 531 ND2 ASN A 33 13.722 8.789 -0.841 1.00 0.00 N ATOM 0 H ASN A 33 10.566 6.269 -3.517 1.00 0.00 H new ATOM 0 HA ASN A 33 13.170 5.835 -2.766 1.00 0.00 H new ATOM 0 HB2 ASN A 33 11.938 8.000 -3.442 1.00 0.00 H new ATOM 0 HB3 ASN A 33 11.457 8.135 -1.762 1.00 0.00 H new ATOM 0 HD21 ASN A 33 14.597 9.231 -0.560 1.00 0.00 H new ATOM 0 HD22 ASN A 33 12.973 8.662 -0.160 1.00 0.00 H new ATOM 538 N ASP A 34 13.457 5.979 -0.191 1.00 0.00 N ATOM 539 CA ASP A 34 13.620 5.644 1.219 1.00 0.00 C ATOM 540 C ASP A 34 13.614 4.133 1.423 1.00 0.00 C ATOM 541 O ASP A 34 12.808 3.603 2.188 1.00 0.00 O ATOM 542 CB ASP A 34 12.508 6.288 2.049 1.00 0.00 C ATOM 543 CG ASP A 34 12.976 6.684 3.436 1.00 0.00 C ATOM 544 OD1 ASP A 34 13.736 5.907 4.049 1.00 0.00 O ATOM 545 OD2 ASP A 34 12.581 7.771 3.908 1.00 0.00 O ATOM 0 H ASP A 34 14.300 6.339 -0.639 1.00 0.00 H new ATOM 0 HA ASP A 34 14.583 6.033 1.551 1.00 0.00 H new ATOM 0 HB2 ASP A 34 12.135 7.170 1.529 1.00 0.00 H new ATOM 0 HB3 ASP A 34 11.673 5.592 2.135 1.00 0.00 H new ATOM 550 N ILE A 35 14.516 3.444 0.732 1.00 0.00 N ATOM 551 CA ILE A 35 14.614 1.994 0.837 1.00 0.00 C ATOM 552 C ILE A 35 15.591 1.587 1.935 1.00 0.00 C ATOM 553 O ILE A 35 16.558 2.295 2.213 1.00 0.00 O ATOM 554 CB ILE A 35 15.064 1.362 -0.494 1.00 0.00 C ATOM 555 CG1 ILE A 35 14.001 0.388 -1.005 1.00 0.00 C ATOM 556 CG2 ILE A 35 16.399 0.654 -0.319 1.00 0.00 C ATOM 557 CD1 ILE A 35 12.909 1.054 -1.812 1.00 0.00 C ATOM 0 H ILE A 35 15.189 3.867 0.093 1.00 0.00 H new ATOM 0 HA ILE A 35 13.618 1.628 1.086 1.00 0.00 H new ATOM 0 HB ILE A 35 15.189 2.154 -1.232 1.00 0.00 H new ATOM 0 HG12 ILE A 35 14.482 -0.373 -1.619 1.00 0.00 H new ATOM 0 HG13 ILE A 35 13.552 -0.125 -0.155 1.00 0.00 H new ATOM 0 HG21 ILE A 35 16.704 0.212 -1.268 1.00 0.00 H new ATOM 0 HG22 ILE A 35 17.152 1.372 0.006 1.00 0.00 H new ATOM 0 HG23 ILE A 35 16.299 -0.131 0.431 1.00 0.00 H new ATOM 0 HD11 ILE A 35 12.191 0.303 -2.142 1.00 0.00 H new ATOM 0 HD12 ILE A 35 12.401 1.796 -1.195 1.00 0.00 H new ATOM 0 HD13 ILE A 35 13.347 1.544 -2.682 1.00 0.00 H new ATOM 569 N ASN A 36 15.331 0.441 2.556 1.00 0.00 N ATOM 570 CA ASN A 36 16.188 -0.061 3.624 1.00 0.00 C ATOM 571 C ASN A 36 16.553 -1.523 3.386 1.00 0.00 C ATOM 572 O ASN A 36 15.680 -2.368 3.188 1.00 0.00 O ATOM 573 CB ASN A 36 15.492 0.089 4.978 1.00 0.00 C ATOM 574 CG ASN A 36 15.852 1.388 5.673 1.00 0.00 C ATOM 575 OD1 ASN A 36 15.554 2.474 5.175 1.00 0.00 O ATOM 576 ND2 ASN A 36 16.498 1.282 6.828 1.00 0.00 N ATOM 0 H ASN A 36 14.534 -0.157 2.338 1.00 0.00 H new ATOM 0 HA ASN A 36 17.105 0.528 3.628 1.00 0.00 H new ATOM 0 HB2 ASN A 36 14.412 0.044 4.835 1.00 0.00 H new ATOM 0 HB3 ASN A 36 15.764 -0.750 5.618 1.00 0.00 H new ATOM 0 HD21 ASN A 36 16.768 2.122 7.340 1.00 0.00 H new ATOM 0 HD22 ASN A 36 16.724 0.361 7.203 1.00 0.00 H new ATOM 583 N VAL A 37 17.850 -1.815 3.408 1.00 0.00 N ATOM 584 CA VAL A 37 18.331 -3.175 3.197 1.00 0.00 C ATOM 585 C VAL A 37 18.635 -3.863 4.524 1.00 0.00 C ATOM 586 O VAL A 37 19.224 -3.265 5.425 1.00 0.00 O ATOM 587 CB VAL A 37 19.597 -3.193 2.320 1.00 0.00 C ATOM 588 CG1 VAL A 37 20.745 -2.489 3.026 1.00 0.00 C ATOM 589 CG2 VAL A 37 19.976 -4.622 1.961 1.00 0.00 C ATOM 0 H VAL A 37 18.586 -1.128 3.570 1.00 0.00 H new ATOM 0 HA VAL A 37 17.535 -3.716 2.685 1.00 0.00 H new ATOM 0 HB VAL A 37 19.386 -2.655 1.396 1.00 0.00 H new ATOM 0 HG11 VAL A 37 21.631 -2.512 2.391 1.00 0.00 H new ATOM 0 HG12 VAL A 37 20.469 -1.454 3.227 1.00 0.00 H new ATOM 0 HG13 VAL A 37 20.959 -2.996 3.967 1.00 0.00 H new ATOM 0 HG21 VAL A 37 20.873 -4.616 1.341 1.00 0.00 H new ATOM 0 HG22 VAL A 37 20.169 -5.187 2.873 1.00 0.00 H new ATOM 0 HG23 VAL A 37 19.158 -5.088 1.411 1.00 0.00 H new ATOM 599 N THR A 38 18.230 -5.124 4.637 1.00 0.00 N ATOM 600 CA THR A 38 18.459 -5.894 5.853 1.00 0.00 C ATOM 601 C THR A 38 19.050 -7.262 5.535 1.00 0.00 C ATOM 602 O THR A 38 18.396 -8.103 4.920 1.00 0.00 O ATOM 603 CB THR A 38 17.155 -6.083 6.651 1.00 0.00 C ATOM 604 OG1 THR A 38 16.100 -6.496 5.775 1.00 0.00 O ATOM 605 CG2 THR A 38 16.760 -4.795 7.357 1.00 0.00 C ATOM 0 H THR A 38 17.742 -5.634 3.901 1.00 0.00 H new ATOM 0 HA THR A 38 19.168 -5.328 6.457 1.00 0.00 H new ATOM 0 HB THR A 38 17.324 -6.853 7.404 1.00 0.00 H new ATOM 0 HG1 THR A 38 16.432 -7.189 5.167 1.00 0.00 H new ATOM 0 HG21 THR A 38 15.836 -4.954 7.914 1.00 0.00 H new ATOM 0 HG22 THR A 38 17.552 -4.500 8.045 1.00 0.00 H new ATOM 0 HG23 THR A 38 16.608 -4.007 6.619 1.00 0.00 H new ATOM 613 N TRP A 39 20.290 -7.478 5.959 1.00 0.00 N ATOM 614 CA TRP A 39 20.970 -8.746 5.719 1.00 0.00 C ATOM 615 C TRP A 39 20.951 -9.618 6.969 1.00 0.00 C ATOM 616 O TRP A 39 21.104 -9.123 8.086 1.00 0.00 O ATOM 617 CB TRP A 39 22.413 -8.499 5.276 1.00 0.00 C ATOM 618 CG TRP A 39 23.202 -7.681 6.253 1.00 0.00 C ATOM 619 CD1 TRP A 39 23.285 -6.319 6.303 1.00 0.00 C ATOM 620 CD2 TRP A 39 24.022 -8.174 7.318 1.00 0.00 C ATOM 621 NE1 TRP A 39 24.107 -5.935 7.335 1.00 0.00 N ATOM 622 CE2 TRP A 39 24.571 -7.055 7.974 1.00 0.00 C ATOM 623 CE3 TRP A 39 24.344 -9.452 7.783 1.00 0.00 C ATOM 624 CZ2 TRP A 39 25.424 -7.177 9.068 1.00 0.00 C ATOM 625 CZ3 TRP A 39 25.191 -9.572 8.868 1.00 0.00 C ATOM 626 CH2 TRP A 39 25.722 -8.440 9.502 1.00 0.00 C ATOM 0 H TRP A 39 20.845 -6.792 6.471 1.00 0.00 H new ATOM 0 HA TRP A 39 20.439 -9.270 4.925 1.00 0.00 H new ATOM 0 HB2 TRP A 39 22.910 -9.458 5.131 1.00 0.00 H new ATOM 0 HB3 TRP A 39 22.408 -7.993 4.310 1.00 0.00 H new ATOM 0 HD1 TRP A 39 22.779 -5.643 5.630 1.00 0.00 H new ATOM 0 HE1 TRP A 39 24.335 -4.973 7.585 1.00 0.00 H new ATOM 0 HE3 TRP A 39 23.938 -10.330 7.303 1.00 0.00 H new ATOM 0 HZ2 TRP A 39 25.836 -6.306 9.556 1.00 0.00 H new ATOM 0 HZ3 TRP A 39 25.448 -10.555 9.234 1.00 0.00 H new ATOM 0 HH2 TRP A 39 26.379 -8.567 10.350 1.00 0.00 H new ATOM 668 N THR A 43 21.997 -13.805 3.292 1.00 0.00 N ATOM 669 CA THR A 43 20.947 -13.388 2.372 1.00 0.00 C ATOM 670 C THR A 43 20.575 -11.925 2.588 1.00 0.00 C ATOM 671 O THR A 43 20.360 -11.490 3.719 1.00 0.00 O ATOM 672 CB THR A 43 19.684 -14.255 2.531 1.00 0.00 C ATOM 673 OG1 THR A 43 20.037 -15.546 3.041 1.00 0.00 O ATOM 674 CG2 THR A 43 18.963 -14.410 1.200 1.00 0.00 C ATOM 0 HA THR A 43 21.342 -13.515 1.364 1.00 0.00 H new ATOM 0 HB THR A 43 19.015 -13.758 3.233 1.00 0.00 H new ATOM 0 HG1 THR A 43 20.959 -15.526 3.371 1.00 0.00 H new ATOM 0 HG21 THR A 43 18.074 -15.026 1.337 1.00 0.00 H new ATOM 0 HG22 THR A 43 18.670 -13.428 0.828 1.00 0.00 H new ATOM 0 HG23 THR A 43 19.628 -14.887 0.480 1.00 0.00 H new ATOM 682 N VAL A 44 20.501 -11.170 1.496 1.00 0.00 N ATOM 683 CA VAL A 44 20.154 -9.756 1.567 1.00 0.00 C ATOM 684 C VAL A 44 18.742 -9.510 1.044 1.00 0.00 C ATOM 685 O VAL A 44 18.368 -10.002 -0.021 1.00 0.00 O ATOM 686 CB VAL A 44 21.144 -8.894 0.762 1.00 0.00 C ATOM 687 CG1 VAL A 44 21.353 -9.476 -0.628 1.00 0.00 C ATOM 688 CG2 VAL A 44 20.654 -7.457 0.680 1.00 0.00 C ATOM 0 H VAL A 44 20.677 -11.514 0.552 1.00 0.00 H new ATOM 0 HA VAL A 44 20.205 -9.470 2.618 1.00 0.00 H new ATOM 0 HB VAL A 44 22.104 -8.897 1.278 1.00 0.00 H new ATOM 0 HG11 VAL A 44 22.056 -8.853 -1.181 1.00 0.00 H new ATOM 0 HG12 VAL A 44 21.753 -10.486 -0.543 1.00 0.00 H new ATOM 0 HG13 VAL A 44 20.400 -9.506 -1.157 1.00 0.00 H new ATOM 0 HG21 VAL A 44 21.366 -6.862 0.108 1.00 0.00 H new ATOM 0 HG22 VAL A 44 19.682 -7.432 0.188 1.00 0.00 H new ATOM 0 HG23 VAL A 44 20.563 -7.046 1.685 1.00 0.00 H new ATOM 698 N THR A 45 17.962 -8.746 1.802 1.00 0.00 N ATOM 699 CA THR A 45 16.591 -8.434 1.416 1.00 0.00 C ATOM 700 C THR A 45 16.338 -6.932 1.452 1.00 0.00 C ATOM 701 O THR A 45 16.682 -6.257 2.422 1.00 0.00 O ATOM 702 CB THR A 45 15.576 -9.137 2.337 1.00 0.00 C ATOM 703 OG1 THR A 45 15.943 -10.509 2.515 1.00 0.00 O ATOM 704 CG2 THR A 45 14.172 -9.054 1.756 1.00 0.00 C ATOM 0 H THR A 45 18.256 -8.332 2.687 1.00 0.00 H new ATOM 0 HA THR A 45 16.458 -8.797 0.397 1.00 0.00 H new ATOM 0 HB THR A 45 15.584 -8.632 3.303 1.00 0.00 H new ATOM 0 HG1 THR A 45 15.293 -10.948 3.103 1.00 0.00 H new ATOM 0 HG21 THR A 45 13.472 -9.557 2.423 1.00 0.00 H new ATOM 0 HG22 THR A 45 13.884 -8.008 1.649 1.00 0.00 H new ATOM 0 HG23 THR A 45 14.153 -9.537 0.779 1.00 0.00 H new ATOM 712 N VAL A 46 15.733 -6.413 0.388 1.00 0.00 N ATOM 713 CA VAL A 46 15.432 -4.989 0.298 1.00 0.00 C ATOM 714 C VAL A 46 14.010 -4.698 0.767 1.00 0.00 C ATOM 715 O VAL A 46 13.082 -5.447 0.466 1.00 0.00 O ATOM 716 CB VAL A 46 15.603 -4.468 -1.141 1.00 0.00 C ATOM 717 CG1 VAL A 46 14.472 -4.968 -2.028 1.00 0.00 C ATOM 718 CG2 VAL A 46 15.669 -2.949 -1.153 1.00 0.00 C ATOM 0 H VAL A 46 15.442 -6.958 -0.424 1.00 0.00 H new ATOM 0 HA VAL A 46 16.139 -4.474 0.948 1.00 0.00 H new ATOM 0 HB VAL A 46 16.542 -4.853 -1.539 1.00 0.00 H new ATOM 0 HG11 VAL A 46 14.610 -4.590 -3.041 1.00 0.00 H new ATOM 0 HG12 VAL A 46 14.477 -6.058 -2.044 1.00 0.00 H new ATOM 0 HG13 VAL A 46 13.518 -4.615 -1.635 1.00 0.00 H new ATOM 0 HG21 VAL A 46 15.790 -2.598 -2.178 1.00 0.00 H new ATOM 0 HG22 VAL A 46 14.748 -2.541 -0.736 1.00 0.00 H new ATOM 0 HG23 VAL A 46 16.517 -2.617 -0.553 1.00 0.00 H new ATOM 728 N GLU A 47 13.849 -3.603 1.504 1.00 0.00 N ATOM 729 CA GLU A 47 12.539 -3.213 2.014 1.00 0.00 C ATOM 730 C GLU A 47 12.216 -1.771 1.636 1.00 0.00 C ATOM 731 O GLU A 47 12.978 -0.853 1.936 1.00 0.00 O ATOM 732 CB GLU A 47 12.491 -3.376 3.535 1.00 0.00 C ATOM 733 CG GLU A 47 12.406 -4.824 3.989 1.00 0.00 C ATOM 734 CD GLU A 47 12.447 -4.965 5.499 1.00 0.00 C ATOM 735 OE1 GLU A 47 12.922 -4.025 6.170 1.00 0.00 O ATOM 736 OE2 GLU A 47 12.004 -6.016 6.008 1.00 0.00 O ATOM 0 H GLU A 47 14.608 -2.971 1.761 1.00 0.00 H new ATOM 0 HA GLU A 47 11.792 -3.865 1.562 1.00 0.00 H new ATOM 0 HB2 GLU A 47 13.380 -2.919 3.969 1.00 0.00 H new ATOM 0 HB3 GLU A 47 11.631 -2.831 3.924 1.00 0.00 H new ATOM 0 HG2 GLU A 47 11.484 -5.266 3.611 1.00 0.00 H new ATOM 0 HG3 GLU A 47 13.231 -5.387 3.553 1.00 0.00 H new ATOM 743 N GLY A 48 11.079 -1.580 0.973 1.00 0.00 N ATOM 744 CA GLY A 48 10.674 -0.248 0.564 1.00 0.00 C ATOM 745 C GLY A 48 9.255 0.082 0.985 1.00 0.00 C ATOM 746 O GLY A 48 8.493 -0.806 1.365 1.00 0.00 O ATOM 0 H GLY A 48 10.432 -2.324 0.712 1.00 0.00 H new ATOM 0 HA2 GLY A 48 11.357 0.484 0.995 1.00 0.00 H new ATOM 0 HA3 GLY A 48 10.757 -0.163 -0.519 1.00 0.00 H new ATOM 750 N GLN A 49 8.902 1.362 0.918 1.00 0.00 N ATOM 751 CA GLN A 49 7.567 1.806 1.298 1.00 0.00 C ATOM 752 C GLN A 49 7.007 2.787 0.273 1.00 0.00 C ATOM 753 O GLN A 49 7.689 3.726 -0.140 1.00 0.00 O ATOM 754 CB GLN A 49 7.597 2.458 2.681 1.00 0.00 C ATOM 755 CG GLN A 49 8.567 3.624 2.783 1.00 0.00 C ATOM 756 CD GLN A 49 7.942 4.940 2.365 1.00 0.00 C ATOM 757 OE1 GLN A 49 6.795 5.232 2.706 1.00 0.00 O ATOM 758 NE2 GLN A 49 8.694 5.744 1.623 1.00 0.00 N ATOM 0 H GLN A 49 9.522 2.109 0.604 1.00 0.00 H new ATOM 0 HA GLN A 49 6.917 0.932 1.330 1.00 0.00 H new ATOM 0 HB2 GLN A 49 6.595 2.807 2.931 1.00 0.00 H new ATOM 0 HB3 GLN A 49 7.867 1.706 3.422 1.00 0.00 H new ATOM 0 HG2 GLN A 49 8.925 3.706 3.809 1.00 0.00 H new ATOM 0 HG3 GLN A 49 9.437 3.424 2.157 1.00 0.00 H new ATOM 0 HE21 GLN A 49 9.639 5.462 1.363 1.00 0.00 H new ATOM 0 HE22 GLN A 49 8.326 6.643 1.313 1.00 0.00 H new ATOM 767 N LEU A 50 5.763 2.563 -0.135 1.00 0.00 N ATOM 768 CA LEU A 50 5.111 3.427 -1.113 1.00 0.00 C ATOM 769 C LEU A 50 3.898 4.123 -0.502 1.00 0.00 C ATOM 770 O LEU A 50 2.938 3.471 -0.094 1.00 0.00 O ATOM 771 CB LEU A 50 4.684 2.615 -2.336 1.00 0.00 C ATOM 772 CG LEU A 50 4.687 3.360 -3.672 1.00 0.00 C ATOM 773 CD1 LEU A 50 3.597 4.420 -3.694 1.00 0.00 C ATOM 774 CD2 LEU A 50 6.049 3.988 -3.928 1.00 0.00 C ATOM 0 H LEU A 50 5.185 1.790 0.196 1.00 0.00 H new ATOM 0 HA LEU A 50 5.827 4.189 -1.422 1.00 0.00 H new ATOM 0 HB2 LEU A 50 5.344 1.752 -2.423 1.00 0.00 H new ATOM 0 HB3 LEU A 50 3.679 2.231 -2.159 1.00 0.00 H new ATOM 0 HG LEU A 50 4.484 2.643 -4.467 1.00 0.00 H new ATOM 0 HD11 LEU A 50 3.614 4.940 -4.652 1.00 0.00 H new ATOM 0 HD12 LEU A 50 2.625 3.946 -3.556 1.00 0.00 H new ATOM 0 HD13 LEU A 50 3.769 5.135 -2.890 1.00 0.00 H new ATOM 0 HD21 LEU A 50 6.034 4.514 -4.883 1.00 0.00 H new ATOM 0 HD22 LEU A 50 6.281 4.692 -3.129 1.00 0.00 H new ATOM 0 HD23 LEU A 50 6.810 3.208 -3.956 1.00 0.00 H new ATOM 910 N ARG B 3 24.501 -19.993 -9.223 1.00 0.00 N ATOM 911 CA ARG B 3 23.106 -19.748 -9.570 1.00 0.00 C ATOM 912 C ARG B 3 22.564 -18.534 -8.821 1.00 0.00 C ATOM 913 O ARG B 3 22.961 -18.263 -7.688 1.00 0.00 O ATOM 914 CB ARG B 3 22.255 -20.979 -9.250 1.00 0.00 C ATOM 915 CG ARG B 3 20.761 -20.741 -9.393 1.00 0.00 C ATOM 916 CD ARG B 3 20.131 -20.343 -8.067 1.00 0.00 C ATOM 917 NE ARG B 3 19.350 -21.431 -7.484 1.00 0.00 N ATOM 918 CZ ARG B 3 18.947 -21.449 -6.218 1.00 0.00 C ATOM 919 NH1 ARG B 3 19.249 -20.444 -5.408 1.00 0.00 N ATOM 920 NH2 ARG B 3 18.239 -22.474 -5.761 1.00 0.00 N ATOM 0 HA ARG B 3 23.054 -19.546 -10.640 1.00 0.00 H new ATOM 0 HB2 ARG B 3 22.549 -21.795 -9.910 1.00 0.00 H new ATOM 0 HB3 ARG B 3 22.467 -21.302 -8.231 1.00 0.00 H new ATOM 0 HG2 ARG B 3 20.585 -19.958 -10.130 1.00 0.00 H new ATOM 0 HG3 ARG B 3 20.282 -21.645 -9.768 1.00 0.00 H new ATOM 0 HD2 ARG B 3 20.913 -20.044 -7.369 1.00 0.00 H new ATOM 0 HD3 ARG B 3 19.489 -19.475 -8.217 1.00 0.00 H new ATOM 0 HE ARG B 3 19.101 -22.220 -8.081 1.00 0.00 H new ATOM 0 HH11 ARG B 3 19.792 -19.654 -5.756 1.00 0.00 H new ATOM 0 HH12 ARG B 3 18.938 -20.461 -4.437 1.00 0.00 H new ATOM 0 HH21 ARG B 3 18.004 -23.249 -6.382 1.00 0.00 H new ATOM 0 HH22 ARG B 3 17.930 -22.487 -4.789 1.00 0.00 H new ATOM 934 N VAL B 4 21.655 -17.806 -9.462 1.00 0.00 N ATOM 935 CA VAL B 4 21.059 -16.622 -8.857 1.00 0.00 C ATOM 936 C VAL B 4 19.542 -16.749 -8.780 1.00 0.00 C ATOM 937 O VAL B 4 18.874 -16.963 -9.792 1.00 0.00 O ATOM 938 CB VAL B 4 21.417 -15.348 -9.646 1.00 0.00 C ATOM 939 CG1 VAL B 4 20.880 -14.113 -8.938 1.00 0.00 C ATOM 940 CG2 VAL B 4 22.922 -15.248 -9.842 1.00 0.00 C ATOM 0 H VAL B 4 21.316 -18.016 -10.401 1.00 0.00 H new ATOM 0 HA VAL B 4 21.466 -16.543 -7.849 1.00 0.00 H new ATOM 0 HB VAL B 4 20.949 -15.407 -10.629 1.00 0.00 H new ATOM 0 HG11 VAL B 4 21.142 -13.223 -9.510 1.00 0.00 H new ATOM 0 HG12 VAL B 4 19.796 -14.184 -8.855 1.00 0.00 H new ATOM 0 HG13 VAL B 4 21.317 -14.046 -7.942 1.00 0.00 H new ATOM 0 HG21 VAL B 4 23.157 -14.342 -10.401 1.00 0.00 H new ATOM 0 HG22 VAL B 4 23.414 -15.212 -8.870 1.00 0.00 H new ATOM 0 HG23 VAL B 4 23.275 -16.118 -10.396 1.00 0.00 H new ATOM 950 N ARG B 5 19.003 -16.615 -7.572 1.00 0.00 N ATOM 951 CA ARG B 5 17.564 -16.716 -7.362 1.00 0.00 C ATOM 952 C ARG B 5 17.050 -15.535 -6.544 1.00 0.00 C ATOM 953 O ARG B 5 17.570 -15.238 -5.469 1.00 0.00 O ATOM 954 CB ARG B 5 17.221 -18.028 -6.654 1.00 0.00 C ATOM 955 CG ARG B 5 15.750 -18.161 -6.296 1.00 0.00 C ATOM 956 CD ARG B 5 15.477 -19.442 -5.524 1.00 0.00 C ATOM 957 NE ARG B 5 14.261 -20.109 -5.981 1.00 0.00 N ATOM 958 CZ ARG B 5 13.993 -21.389 -5.747 1.00 0.00 C ATOM 959 NH1 ARG B 5 14.850 -22.135 -5.066 1.00 0.00 N ATOM 960 NH2 ARG B 5 12.865 -21.924 -6.196 1.00 0.00 N ATOM 0 H ARG B 5 19.541 -16.436 -6.724 1.00 0.00 H new ATOM 0 HA ARG B 5 17.078 -16.700 -8.337 1.00 0.00 H new ATOM 0 HB2 ARG B 5 17.507 -18.862 -7.295 1.00 0.00 H new ATOM 0 HB3 ARG B 5 17.816 -18.106 -5.744 1.00 0.00 H new ATOM 0 HG2 ARG B 5 15.441 -17.303 -5.699 1.00 0.00 H new ATOM 0 HG3 ARG B 5 15.151 -18.149 -7.206 1.00 0.00 H new ATOM 0 HD2 ARG B 5 16.324 -20.119 -5.634 1.00 0.00 H new ATOM 0 HD3 ARG B 5 15.387 -19.213 -4.462 1.00 0.00 H new ATOM 0 HE ARG B 5 13.580 -19.562 -6.509 1.00 0.00 H new ATOM 0 HH11 ARG B 5 15.718 -21.727 -4.720 1.00 0.00 H new ATOM 0 HH12 ARG B 5 14.642 -23.117 -4.888 1.00 0.00 H new ATOM 0 HH21 ARG B 5 12.203 -21.353 -6.721 1.00 0.00 H new ATOM 0 HH22 ARG B 5 12.660 -22.907 -6.016 1.00 0.00 H new ATOM 974 N ILE B 6 16.026 -14.864 -7.062 1.00 0.00 N ATOM 975 CA ILE B 6 15.442 -13.716 -6.380 1.00 0.00 C ATOM 976 C ILE B 6 13.942 -13.901 -6.178 1.00 0.00 C ATOM 977 O ILE B 6 13.203 -14.151 -7.131 1.00 0.00 O ATOM 978 CB ILE B 6 15.686 -12.412 -7.163 1.00 0.00 C ATOM 979 CG1 ILE B 6 17.187 -12.139 -7.286 1.00 0.00 C ATOM 980 CG2 ILE B 6 14.985 -11.246 -6.482 1.00 0.00 C ATOM 981 CD1 ILE B 6 17.525 -11.072 -8.304 1.00 0.00 C ATOM 0 H ILE B 6 15.584 -15.096 -7.952 1.00 0.00 H new ATOM 0 HA ILE B 6 15.931 -13.644 -5.408 1.00 0.00 H new ATOM 0 HB ILE B 6 15.272 -12.524 -8.165 1.00 0.00 H new ATOM 0 HG12 ILE B 6 17.574 -11.837 -6.313 1.00 0.00 H new ATOM 0 HG13 ILE B 6 17.695 -13.064 -7.558 1.00 0.00 H new ATOM 0 HG21 ILE B 6 15.167 -10.332 -7.047 1.00 0.00 H new ATOM 0 HG22 ILE B 6 13.913 -11.440 -6.441 1.00 0.00 H new ATOM 0 HG23 ILE B 6 15.372 -11.130 -5.470 1.00 0.00 H new ATOM 0 HD11 ILE B 6 18.605 -10.931 -8.338 1.00 0.00 H new ATOM 0 HD12 ILE B 6 17.168 -11.381 -9.287 1.00 0.00 H new ATOM 0 HD13 ILE B 6 17.045 -10.135 -8.022 1.00 0.00 H new ATOM 993 N SER B 7 13.498 -13.775 -4.932 1.00 0.00 N ATOM 994 CA SER B 7 12.086 -13.931 -4.604 1.00 0.00 C ATOM 995 C SER B 7 11.497 -12.616 -4.102 1.00 0.00 C ATOM 996 O SER B 7 12.055 -11.973 -3.212 1.00 0.00 O ATOM 997 CB SER B 7 11.903 -15.021 -3.546 1.00 0.00 C ATOM 998 OG SER B 7 13.060 -15.834 -3.447 1.00 0.00 O ATOM 0 H SER B 7 14.096 -13.565 -4.133 1.00 0.00 H new ATOM 0 HA SER B 7 11.558 -14.224 -5.512 1.00 0.00 H new ATOM 0 HB2 SER B 7 11.693 -14.563 -2.580 1.00 0.00 H new ATOM 0 HB3 SER B 7 11.041 -15.638 -3.800 1.00 0.00 H new ATOM 0 HG SER B 7 12.919 -16.522 -2.763 1.00 0.00 H new ATOM 1004 N ILE B 8 10.367 -12.223 -4.679 1.00 0.00 N ATOM 1005 CA ILE B 8 9.701 -10.986 -4.290 1.00 0.00 C ATOM 1006 C ILE B 8 8.388 -11.272 -3.567 1.00 0.00 C ATOM 1007 O ILE B 8 7.601 -12.115 -3.997 1.00 0.00 O ATOM 1008 CB ILE B 8 9.417 -10.091 -5.511 1.00 0.00 C ATOM 1009 CG1 ILE B 8 8.397 -10.759 -6.434 1.00 0.00 C ATOM 1010 CG2 ILE B 8 10.707 -9.797 -6.263 1.00 0.00 C ATOM 1011 CD1 ILE B 8 8.190 -10.024 -7.739 1.00 0.00 C ATOM 0 H ILE B 8 9.893 -12.743 -5.418 1.00 0.00 H new ATOM 0 HA ILE B 8 10.378 -10.462 -3.615 1.00 0.00 H new ATOM 0 HB ILE B 8 8.999 -9.147 -5.162 1.00 0.00 H new ATOM 0 HG12 ILE B 8 8.724 -11.777 -6.648 1.00 0.00 H new ATOM 0 HG13 ILE B 8 7.442 -10.834 -5.913 1.00 0.00 H new ATOM 0 HG21 ILE B 8 10.490 -9.164 -7.123 1.00 0.00 H new ATOM 0 HG22 ILE B 8 11.405 -9.284 -5.601 1.00 0.00 H new ATOM 0 HG23 ILE B 8 11.151 -10.732 -6.604 1.00 0.00 H new ATOM 0 HD11 ILE B 8 7.454 -10.555 -8.343 1.00 0.00 H new ATOM 0 HD12 ILE B 8 7.833 -9.015 -7.535 1.00 0.00 H new ATOM 0 HD13 ILE B 8 9.134 -9.972 -8.281 1.00 0.00 H new ATOM 1023 N THR B 9 8.158 -10.562 -2.467 1.00 0.00 N ATOM 1024 CA THR B 9 6.941 -10.738 -1.685 1.00 0.00 C ATOM 1025 C THR B 9 6.026 -9.525 -1.811 1.00 0.00 C ATOM 1026 O THR B 9 6.166 -8.551 -1.072 1.00 0.00 O ATOM 1027 CB THR B 9 7.259 -10.974 -0.196 1.00 0.00 C ATOM 1028 OG1 THR B 9 8.561 -11.554 -0.060 1.00 0.00 O ATOM 1029 CG2 THR B 9 6.222 -11.887 0.440 1.00 0.00 C ATOM 0 H THR B 9 8.799 -9.860 -2.098 1.00 0.00 H new ATOM 0 HA THR B 9 6.433 -11.616 -2.084 1.00 0.00 H new ATOM 0 HB THR B 9 7.235 -10.012 0.316 1.00 0.00 H new ATOM 0 HG1 THR B 9 8.757 -11.699 0.889 1.00 0.00 H new ATOM 0 HG21 THR B 9 6.467 -12.039 1.491 1.00 0.00 H new ATOM 0 HG22 THR B 9 5.236 -11.429 0.360 1.00 0.00 H new ATOM 0 HG23 THR B 9 6.219 -12.848 -0.075 1.00 0.00 H new ATOM 1037 N ALA B 10 5.090 -9.591 -2.751 1.00 0.00 N ATOM 1038 CA ALA B 10 4.150 -8.499 -2.972 1.00 0.00 C ATOM 1039 C ALA B 10 2.764 -8.852 -2.442 1.00 0.00 C ATOM 1040 O ALA B 10 2.497 -10.002 -2.092 1.00 0.00 O ATOM 1041 CB ALA B 10 4.079 -8.154 -4.452 1.00 0.00 C ATOM 0 H ALA B 10 4.962 -10.390 -3.372 1.00 0.00 H new ATOM 0 HA ALA B 10 4.509 -7.628 -2.424 1.00 0.00 H new ATOM 0 HB1 ALA B 10 3.373 -7.337 -4.602 1.00 0.00 H new ATOM 0 HB2 ALA B 10 5.065 -7.850 -4.803 1.00 0.00 H new ATOM 0 HB3 ALA B 10 3.747 -9.027 -5.014 1.00 0.00 H new ATOM 1047 N ARG B 11 1.886 -7.855 -2.385 1.00 0.00 N ATOM 1048 CA ARG B 11 0.529 -8.061 -1.895 1.00 0.00 C ATOM 1049 C ARG B 11 -0.375 -8.590 -3.005 1.00 0.00 C ATOM 1050 O ARG B 11 -1.162 -9.514 -2.794 1.00 0.00 O ATOM 1051 CB ARG B 11 -0.040 -6.753 -1.341 1.00 0.00 C ATOM 1052 CG ARG B 11 -1.320 -6.936 -0.542 1.00 0.00 C ATOM 1053 CD ARG B 11 -1.860 -5.605 -0.044 1.00 0.00 C ATOM 1054 NE ARG B 11 -3.289 -5.671 0.253 1.00 0.00 N ATOM 1055 CZ ARG B 11 -4.002 -4.630 0.669 1.00 0.00 C ATOM 1056 NH1 ARG B 11 -3.422 -3.449 0.835 1.00 0.00 N ATOM 1057 NH2 ARG B 11 -5.298 -4.769 0.918 1.00 0.00 N ATOM 0 H ARG B 11 2.091 -6.898 -2.672 1.00 0.00 H new ATOM 0 HA ARG B 11 0.567 -8.801 -1.096 1.00 0.00 H new ATOM 0 HB2 ARG B 11 0.710 -6.280 -0.707 1.00 0.00 H new ATOM 0 HB3 ARG B 11 -0.233 -6.071 -2.169 1.00 0.00 H new ATOM 0 HG2 ARG B 11 -2.071 -7.425 -1.162 1.00 0.00 H new ATOM 0 HG3 ARG B 11 -1.130 -7.593 0.306 1.00 0.00 H new ATOM 0 HD2 ARG B 11 -1.317 -5.306 0.852 1.00 0.00 H new ATOM 0 HD3 ARG B 11 -1.681 -4.837 -0.796 1.00 0.00 H new ATOM 0 HE ARG B 11 -3.765 -6.565 0.134 1.00 0.00 H new ATOM 0 HH11 ARG B 11 -2.426 -3.338 0.643 1.00 0.00 H new ATOM 0 HH12 ARG B 11 -3.972 -2.651 1.154 1.00 0.00 H new ATOM 0 HH21 ARG B 11 -5.748 -5.676 0.790 1.00 0.00 H new ATOM 0 HH22 ARG B 11 -5.845 -3.969 1.237 1.00 0.00 H new ATOM 1071 N THR B 12 -0.258 -7.998 -4.190 1.00 0.00 N ATOM 1072 CA THR B 12 -1.064 -8.408 -5.332 1.00 0.00 C ATOM 1073 C THR B 12 -0.206 -9.075 -6.400 1.00 0.00 C ATOM 1074 O THR B 12 1.007 -8.870 -6.455 1.00 0.00 O ATOM 1075 CB THR B 12 -1.803 -7.210 -5.958 1.00 0.00 C ATOM 1076 OG1 THR B 12 -2.352 -7.581 -7.227 1.00 0.00 O ATOM 1077 CG2 THR B 12 -0.863 -6.027 -6.133 1.00 0.00 C ATOM 0 H THR B 12 0.388 -7.233 -4.383 1.00 0.00 H new ATOM 0 HA THR B 12 -1.797 -9.124 -4.960 1.00 0.00 H new ATOM 0 HB THR B 12 -2.610 -6.917 -5.286 1.00 0.00 H new ATOM 0 HG1 THR B 12 -2.821 -6.814 -7.617 1.00 0.00 H new ATOM 0 HG21 THR B 12 -1.407 -5.193 -6.577 1.00 0.00 H new ATOM 0 HG22 THR B 12 -0.470 -5.728 -5.161 1.00 0.00 H new ATOM 0 HG23 THR B 12 -0.038 -6.311 -6.787 1.00 0.00 H new ATOM 1085 N LYS B 13 -0.842 -9.875 -7.250 1.00 0.00 N ATOM 1086 CA LYS B 13 -0.137 -10.572 -8.319 1.00 0.00 C ATOM 1087 C LYS B 13 0.413 -9.583 -9.343 1.00 0.00 C ATOM 1088 O LYS B 13 1.500 -9.778 -9.888 1.00 0.00 O ATOM 1089 CB LYS B 13 -1.071 -11.569 -9.009 1.00 0.00 C ATOM 1090 CG LYS B 13 -2.344 -10.939 -9.546 1.00 0.00 C ATOM 1091 CD LYS B 13 -3.501 -11.924 -9.537 1.00 0.00 C ATOM 1092 CE LYS B 13 -3.717 -12.542 -10.910 1.00 0.00 C ATOM 1093 NZ LYS B 13 -3.937 -14.012 -10.829 1.00 0.00 N ATOM 0 H LYS B 13 -1.845 -10.057 -7.219 1.00 0.00 H new ATOM 0 HA LYS B 13 0.699 -11.113 -7.876 1.00 0.00 H new ATOM 0 HB2 LYS B 13 -0.537 -12.045 -9.831 1.00 0.00 H new ATOM 0 HB3 LYS B 13 -1.335 -12.356 -8.302 1.00 0.00 H new ATOM 0 HG2 LYS B 13 -2.602 -10.068 -8.944 1.00 0.00 H new ATOM 0 HG3 LYS B 13 -2.175 -10.585 -10.563 1.00 0.00 H new ATOM 0 HD2 LYS B 13 -3.304 -12.711 -8.809 1.00 0.00 H new ATOM 0 HD3 LYS B 13 -4.411 -11.415 -9.218 1.00 0.00 H new ATOM 0 HE2 LYS B 13 -4.576 -12.072 -11.388 1.00 0.00 H new ATOM 0 HE3 LYS B 13 -2.851 -12.339 -11.540 1.00 0.00 H new ATOM 0 HZ1 LYS B 13 -4.080 -14.395 -11.785 1.00 0.00 H new ATOM 0 HZ2 LYS B 13 -3.107 -14.464 -10.396 1.00 0.00 H new ATOM 0 HZ3 LYS B 13 -4.778 -14.206 -10.249 1.00 0.00 H new ATOM 1107 N LYS B 14 -0.343 -8.521 -9.598 1.00 0.00 N ATOM 1108 CA LYS B 14 0.069 -7.500 -10.554 1.00 0.00 C ATOM 1109 C LYS B 14 1.413 -6.896 -10.159 1.00 0.00 C ATOM 1110 O LYS B 14 2.269 -6.656 -11.009 1.00 0.00 O ATOM 1111 CB LYS B 14 -0.990 -6.399 -10.644 1.00 0.00 C ATOM 1112 CG LYS B 14 -2.030 -6.643 -11.724 1.00 0.00 C ATOM 1113 CD LYS B 14 -2.955 -7.792 -11.359 1.00 0.00 C ATOM 1114 CE LYS B 14 -2.889 -8.908 -12.390 1.00 0.00 C ATOM 1115 NZ LYS B 14 -3.564 -8.528 -13.662 1.00 0.00 N ATOM 0 H LYS B 14 -1.245 -8.345 -9.156 1.00 0.00 H new ATOM 0 HA LYS B 14 0.176 -7.974 -11.530 1.00 0.00 H new ATOM 0 HB2 LYS B 14 -1.492 -6.310 -9.681 1.00 0.00 H new ATOM 0 HB3 LYS B 14 -0.496 -5.446 -10.835 1.00 0.00 H new ATOM 0 HG2 LYS B 14 -2.617 -5.737 -11.877 1.00 0.00 H new ATOM 0 HG3 LYS B 14 -1.531 -6.862 -12.668 1.00 0.00 H new ATOM 0 HD2 LYS B 14 -2.682 -8.184 -10.379 1.00 0.00 H new ATOM 0 HD3 LYS B 14 -3.979 -7.426 -11.282 1.00 0.00 H new ATOM 0 HE2 LYS B 14 -1.847 -9.155 -12.592 1.00 0.00 H new ATOM 0 HE3 LYS B 14 -3.357 -9.805 -11.985 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 -3.497 -9.315 -14.339 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 -4.565 -8.317 -13.474 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 -3.102 -7.687 -14.062 1.00 0.00 H new ATOM 1129 N GLU B 15 1.590 -6.654 -8.863 1.00 0.00 N ATOM 1130 CA GLU B 15 2.831 -6.078 -8.357 1.00 0.00 C ATOM 1131 C GLU B 15 4.010 -7.010 -8.621 1.00 0.00 C ATOM 1132 O GLU B 15 5.128 -6.559 -8.868 1.00 0.00 O ATOM 1133 CB GLU B 15 2.714 -5.798 -6.858 1.00 0.00 C ATOM 1134 CG GLU B 15 2.149 -4.424 -6.538 1.00 0.00 C ATOM 1135 CD GLU B 15 2.003 -4.186 -5.047 1.00 0.00 C ATOM 1136 OE1 GLU B 15 1.639 -5.140 -4.328 1.00 0.00 O ATOM 1137 OE2 GLU B 15 2.251 -3.047 -4.600 1.00 0.00 O ATOM 0 H GLU B 15 0.891 -6.848 -8.146 1.00 0.00 H new ATOM 0 HA GLU B 15 3.007 -5.139 -8.882 1.00 0.00 H new ATOM 0 HB2 GLU B 15 2.078 -6.558 -6.403 1.00 0.00 H new ATOM 0 HB3 GLU B 15 3.699 -5.892 -6.401 1.00 0.00 H new ATOM 0 HG2 GLU B 15 2.800 -3.660 -6.962 1.00 0.00 H new ATOM 0 HG3 GLU B 15 1.176 -4.315 -7.017 1.00 0.00 H new ATOM 1144 N ALA B 16 3.751 -8.312 -8.567 1.00 0.00 N ATOM 1145 CA ALA B 16 4.790 -9.308 -8.801 1.00 0.00 C ATOM 1146 C ALA B 16 5.244 -9.295 -10.257 1.00 0.00 C ATOM 1147 O ALA B 16 6.425 -9.480 -10.549 1.00 0.00 O ATOM 1148 CB ALA B 16 4.291 -10.692 -8.414 1.00 0.00 C ATOM 0 H ALA B 16 2.831 -8.702 -8.363 1.00 0.00 H new ATOM 0 HA ALA B 16 5.648 -9.056 -8.178 1.00 0.00 H new ATOM 0 HB1 ALA B 16 5.077 -11.426 -8.594 1.00 0.00 H new ATOM 0 HB2 ALA B 16 4.022 -10.700 -7.358 1.00 0.00 H new ATOM 0 HB3 ALA B 16 3.416 -10.944 -9.013 1.00 0.00 H new ATOM 1154 N GLU B 17 4.298 -9.077 -11.165 1.00 0.00 N ATOM 1155 CA GLU B 17 4.602 -9.043 -12.591 1.00 0.00 C ATOM 1156 C GLU B 17 5.411 -7.798 -12.945 1.00 0.00 C ATOM 1157 O GLU B 17 6.305 -7.843 -13.790 1.00 0.00 O ATOM 1158 CB GLU B 17 3.311 -9.076 -13.412 1.00 0.00 C ATOM 1159 CG GLU B 17 2.920 -7.725 -13.985 1.00 0.00 C ATOM 1160 CD GLU B 17 1.583 -7.760 -14.700 1.00 0.00 C ATOM 1161 OE1 GLU B 17 0.542 -7.692 -14.014 1.00 0.00 O ATOM 1162 OE2 GLU B 17 1.578 -7.855 -15.945 1.00 0.00 O ATOM 0 H GLU B 17 3.316 -8.921 -10.939 1.00 0.00 H new ATOM 0 HA GLU B 17 5.198 -9.923 -12.830 1.00 0.00 H new ATOM 0 HB2 GLU B 17 3.428 -9.788 -14.229 1.00 0.00 H new ATOM 0 HB3 GLU B 17 2.500 -9.443 -12.783 1.00 0.00 H new ATOM 0 HG2 GLU B 17 2.878 -6.991 -13.180 1.00 0.00 H new ATOM 0 HG3 GLU B 17 3.691 -7.392 -14.680 1.00 0.00 H new ATOM 1169 N LYS B 18 5.090 -6.686 -12.292 1.00 0.00 N ATOM 1170 CA LYS B 18 5.785 -5.427 -12.535 1.00 0.00 C ATOM 1171 C LYS B 18 7.256 -5.535 -12.148 1.00 0.00 C ATOM 1172 O LYS B 18 8.126 -4.968 -12.810 1.00 0.00 O ATOM 1173 CB LYS B 18 5.121 -4.294 -11.750 1.00 0.00 C ATOM 1174 CG LYS B 18 3.640 -4.133 -12.048 1.00 0.00 C ATOM 1175 CD LYS B 18 3.401 -3.105 -13.141 1.00 0.00 C ATOM 1176 CE LYS B 18 2.007 -3.237 -13.736 1.00 0.00 C ATOM 1177 NZ LYS B 18 1.770 -2.244 -14.820 1.00 0.00 N ATOM 0 H LYS B 18 4.352 -6.631 -11.590 1.00 0.00 H new ATOM 0 HA LYS B 18 5.723 -5.206 -13.601 1.00 0.00 H new ATOM 0 HB2 LYS B 18 5.250 -4.478 -10.683 1.00 0.00 H new ATOM 0 HB3 LYS B 18 5.632 -3.358 -11.976 1.00 0.00 H new ATOM 0 HG2 LYS B 18 3.222 -5.093 -12.352 1.00 0.00 H new ATOM 0 HG3 LYS B 18 3.116 -3.830 -11.141 1.00 0.00 H new ATOM 0 HD2 LYS B 18 3.530 -2.102 -12.733 1.00 0.00 H new ATOM 0 HD3 LYS B 18 4.146 -3.228 -13.927 1.00 0.00 H new ATOM 0 HE2 LYS B 18 1.875 -4.244 -14.131 1.00 0.00 H new ATOM 0 HE3 LYS B 18 1.263 -3.102 -12.951 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 0.809 -2.367 -15.199 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 1.871 -1.282 -14.438 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 2.464 -2.389 -15.581 1.00 0.00 H new ATOM 1191 N PHE B 19 7.528 -6.266 -11.073 1.00 0.00 N ATOM 1192 CA PHE B 19 8.895 -6.449 -10.598 1.00 0.00 C ATOM 1193 C PHE B 19 9.635 -7.474 -11.452 1.00 0.00 C ATOM 1194 O PHE B 19 10.786 -7.263 -11.833 1.00 0.00 O ATOM 1195 CB PHE B 19 8.893 -6.894 -9.134 1.00 0.00 C ATOM 1196 CG PHE B 19 8.717 -5.761 -8.163 1.00 0.00 C ATOM 1197 CD1 PHE B 19 9.657 -4.746 -8.085 1.00 0.00 C ATOM 1198 CD2 PHE B 19 7.612 -5.712 -7.329 1.00 0.00 C ATOM 1199 CE1 PHE B 19 9.497 -3.702 -7.193 1.00 0.00 C ATOM 1200 CE2 PHE B 19 7.447 -4.670 -6.435 1.00 0.00 C ATOM 1201 CZ PHE B 19 8.391 -3.665 -6.366 1.00 0.00 C ATOM 0 H PHE B 19 6.820 -6.742 -10.514 1.00 0.00 H new ATOM 0 HA PHE B 19 9.413 -5.493 -10.679 1.00 0.00 H new ATOM 0 HB2 PHE B 19 8.092 -7.618 -8.984 1.00 0.00 H new ATOM 0 HB3 PHE B 19 9.831 -7.406 -8.917 1.00 0.00 H new ATOM 0 HD1 PHE B 19 10.524 -4.771 -8.728 1.00 0.00 H new ATOM 0 HD2 PHE B 19 6.871 -6.496 -7.378 1.00 0.00 H new ATOM 0 HE1 PHE B 19 10.236 -2.916 -7.143 1.00 0.00 H new ATOM 0 HE2 PHE B 19 6.580 -4.642 -5.791 1.00 0.00 H new ATOM 0 HZ PHE B 19 8.265 -2.851 -5.667 1.00 0.00 H new ATOM 1211 N ALA B 20 8.966 -8.583 -11.747 1.00 0.00 N ATOM 1212 CA ALA B 20 9.559 -9.640 -12.556 1.00 0.00 C ATOM 1213 C ALA B 20 10.042 -9.099 -13.898 1.00 0.00 C ATOM 1214 O ALA B 20 11.143 -9.418 -14.346 1.00 0.00 O ATOM 1215 CB ALA B 20 8.559 -10.767 -12.769 1.00 0.00 C ATOM 0 H ALA B 20 8.013 -8.773 -11.438 1.00 0.00 H new ATOM 0 HA ALA B 20 10.423 -10.032 -12.019 1.00 0.00 H new ATOM 0 HB1 ALA B 20 9.016 -11.549 -13.375 1.00 0.00 H new ATOM 0 HB2 ALA B 20 8.266 -11.180 -11.804 1.00 0.00 H new ATOM 0 HB3 ALA B 20 7.678 -10.380 -13.281 1.00 0.00 H new ATOM 1221 N ALA B 21 9.211 -8.280 -14.534 1.00 0.00 N ATOM 1222 CA ALA B 21 9.555 -7.694 -15.824 1.00 0.00 C ATOM 1223 C ALA B 21 10.923 -7.022 -15.774 1.00 0.00 C ATOM 1224 O ALA B 21 11.751 -7.214 -16.665 1.00 0.00 O ATOM 1225 CB ALA B 21 8.489 -6.695 -16.250 1.00 0.00 C ATOM 0 H ALA B 21 8.295 -8.007 -14.177 1.00 0.00 H new ATOM 0 HA ALA B 21 9.600 -8.497 -16.560 1.00 0.00 H new ATOM 0 HB1 ALA B 21 8.758 -6.265 -17.215 1.00 0.00 H new ATOM 0 HB2 ALA B 21 7.528 -7.202 -16.334 1.00 0.00 H new ATOM 0 HB3 ALA B 21 8.416 -5.901 -15.506 1.00 0.00 H new ATOM 1231 N ILE B 22 11.153 -6.234 -14.730 1.00 0.00 N ATOM 1232 CA ILE B 22 12.421 -5.535 -14.565 1.00 0.00 C ATOM 1233 C ILE B 22 13.562 -6.516 -14.318 1.00 0.00 C ATOM 1234 O ILE B 22 14.608 -6.445 -14.965 1.00 0.00 O ATOM 1235 CB ILE B 22 12.363 -4.529 -13.400 1.00 0.00 C ATOM 1236 CG1 ILE B 22 11.265 -3.493 -13.647 1.00 0.00 C ATOM 1237 CG2 ILE B 22 13.711 -3.848 -13.220 1.00 0.00 C ATOM 1238 CD1 ILE B 22 10.618 -2.983 -12.378 1.00 0.00 C ATOM 0 H ILE B 22 10.477 -6.063 -13.985 1.00 0.00 H new ATOM 0 HA ILE B 22 12.605 -4.993 -15.493 1.00 0.00 H new ATOM 0 HB ILE B 22 12.127 -5.070 -12.484 1.00 0.00 H new ATOM 0 HG12 ILE B 22 11.688 -2.650 -14.193 1.00 0.00 H new ATOM 0 HG13 ILE B 22 10.498 -3.933 -14.284 1.00 0.00 H new ATOM 0 HG21 ILE B 22 13.654 -3.140 -12.393 1.00 0.00 H new ATOM 0 HG22 ILE B 22 14.472 -4.598 -13.003 1.00 0.00 H new ATOM 0 HG23 ILE B 22 13.975 -3.317 -14.134 1.00 0.00 H new ATOM 0 HD11 ILE B 22 9.849 -2.252 -12.630 1.00 0.00 H new ATOM 0 HD12 ILE B 22 10.165 -3.816 -11.841 1.00 0.00 H new ATOM 0 HD13 ILE B 22 11.373 -2.513 -11.748 1.00 0.00 H new ATOM 1250 N LEU B 23 13.353 -7.433 -13.380 1.00 0.00 N ATOM 1251 CA LEU B 23 14.364 -8.432 -13.048 1.00 0.00 C ATOM 1252 C LEU B 23 14.810 -9.190 -14.294 1.00 0.00 C ATOM 1253 O LEU B 23 15.991 -9.496 -14.456 1.00 0.00 O ATOM 1254 CB LEU B 23 13.818 -9.412 -12.008 1.00 0.00 C ATOM 1255 CG LEU B 23 14.393 -9.282 -10.597 1.00 0.00 C ATOM 1256 CD1 LEU B 23 15.885 -9.576 -10.599 1.00 0.00 C ATOM 1257 CD2 LEU B 23 14.121 -7.894 -10.036 1.00 0.00 C ATOM 0 H LEU B 23 12.493 -7.506 -12.836 1.00 0.00 H new ATOM 0 HA LEU B 23 15.228 -7.915 -12.632 1.00 0.00 H new ATOM 0 HB2 LEU B 23 12.737 -9.286 -11.951 1.00 0.00 H new ATOM 0 HB3 LEU B 23 14.002 -10.426 -12.362 1.00 0.00 H new ATOM 0 HG LEU B 23 13.901 -10.014 -9.956 1.00 0.00 H new ATOM 0 HD11 LEU B 23 16.276 -9.478 -9.586 1.00 0.00 H new ATOM 0 HD12 LEU B 23 16.055 -10.591 -10.958 1.00 0.00 H new ATOM 0 HD13 LEU B 23 16.394 -8.869 -11.254 1.00 0.00 H new ATOM 0 HD21 LEU B 23 14.537 -7.820 -9.031 1.00 0.00 H new ATOM 0 HD22 LEU B 23 14.585 -7.145 -10.677 1.00 0.00 H new ATOM 0 HD23 LEU B 23 13.045 -7.722 -9.997 1.00 0.00 H new ATOM 1269 N ILE B 24 13.857 -9.489 -15.171 1.00 0.00 N ATOM 1270 CA ILE B 24 14.153 -10.208 -16.404 1.00 0.00 C ATOM 1271 C ILE B 24 15.120 -9.421 -17.281 1.00 0.00 C ATOM 1272 O ILE B 24 16.052 -9.983 -17.857 1.00 0.00 O ATOM 1273 CB ILE B 24 12.871 -10.501 -17.206 1.00 0.00 C ATOM 1274 CG1 ILE B 24 11.921 -11.379 -16.389 1.00 0.00 C ATOM 1275 CG2 ILE B 24 13.215 -11.170 -18.528 1.00 0.00 C ATOM 1276 CD1 ILE B 24 10.459 -11.068 -16.623 1.00 0.00 C ATOM 0 H ILE B 24 12.874 -9.245 -15.050 1.00 0.00 H new ATOM 0 HA ILE B 24 14.615 -11.152 -16.116 1.00 0.00 H new ATOM 0 HB ILE B 24 12.369 -9.557 -17.419 1.00 0.00 H new ATOM 0 HG12 ILE B 24 12.105 -12.425 -16.634 1.00 0.00 H new ATOM 0 HG13 ILE B 24 12.145 -11.255 -15.330 1.00 0.00 H new ATOM 0 HG21 ILE B 24 12.299 -11.371 -19.083 1.00 0.00 H new ATOM 0 HG22 ILE B 24 13.857 -10.511 -19.113 1.00 0.00 H new ATOM 0 HG23 ILE B 24 13.736 -12.108 -18.336 1.00 0.00 H new ATOM 0 HD11 ILE B 24 9.844 -11.728 -16.012 1.00 0.00 H new ATOM 0 HD12 ILE B 24 10.259 -10.032 -16.351 1.00 0.00 H new ATOM 0 HD13 ILE B 24 10.219 -11.220 -17.675 1.00 0.00 H new ATOM 1288 N LYS B 25 14.894 -8.115 -17.378 1.00 0.00 N ATOM 1289 CA LYS B 25 15.746 -7.248 -18.182 1.00 0.00 C ATOM 1290 C LYS B 25 17.153 -7.173 -17.597 1.00 0.00 C ATOM 1291 O LYS B 25 18.143 -7.216 -18.328 1.00 0.00 O ATOM 1292 CB LYS B 25 15.144 -5.844 -18.269 1.00 0.00 C ATOM 1293 CG LYS B 25 13.723 -5.825 -18.807 1.00 0.00 C ATOM 1294 CD LYS B 25 13.695 -5.521 -20.296 1.00 0.00 C ATOM 1295 CE LYS B 25 14.413 -6.597 -21.098 1.00 0.00 C ATOM 1296 NZ LYS B 25 13.913 -6.670 -22.499 1.00 0.00 N ATOM 0 H LYS B 25 14.127 -7.634 -16.909 1.00 0.00 H new ATOM 0 HA LYS B 25 15.810 -7.672 -19.184 1.00 0.00 H new ATOM 0 HB2 LYS B 25 15.155 -5.391 -17.278 1.00 0.00 H new ATOM 0 HB3 LYS B 25 15.774 -5.226 -18.909 1.00 0.00 H new ATOM 0 HG2 LYS B 25 13.250 -6.790 -18.623 1.00 0.00 H new ATOM 0 HG3 LYS B 25 13.140 -5.076 -18.271 1.00 0.00 H new ATOM 0 HD2 LYS B 25 12.661 -5.443 -20.633 1.00 0.00 H new ATOM 0 HD3 LYS B 25 14.164 -4.554 -20.480 1.00 0.00 H new ATOM 0 HE2 LYS B 25 15.483 -6.392 -21.105 1.00 0.00 H new ATOM 0 HE3 LYS B 25 14.277 -7.563 -20.613 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 14.427 -7.414 -23.013 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 12.897 -6.891 -22.494 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 14.066 -5.756 -22.970 1.00 0.00 H new ATOM 1310 N VAL B 26 17.234 -7.063 -16.275 1.00 0.00 N ATOM 1311 CA VAL B 26 18.520 -6.985 -15.592 1.00 0.00 C ATOM 1312 C VAL B 26 19.313 -8.275 -15.764 1.00 0.00 C ATOM 1313 O VAL B 26 20.527 -8.248 -15.971 1.00 0.00 O ATOM 1314 CB VAL B 26 18.340 -6.703 -14.088 1.00 0.00 C ATOM 1315 CG1 VAL B 26 19.678 -6.374 -13.443 1.00 0.00 C ATOM 1316 CG2 VAL B 26 17.343 -5.575 -13.873 1.00 0.00 C ATOM 0 H VAL B 26 16.424 -7.026 -15.656 1.00 0.00 H new ATOM 0 HA VAL B 26 19.070 -6.161 -16.046 1.00 0.00 H new ATOM 0 HB VAL B 26 17.945 -7.601 -13.612 1.00 0.00 H new ATOM 0 HG11 VAL B 26 19.531 -6.178 -12.381 1.00 0.00 H new ATOM 0 HG12 VAL B 26 20.358 -7.217 -13.566 1.00 0.00 H new ATOM 0 HG13 VAL B 26 20.104 -5.491 -13.920 1.00 0.00 H new ATOM 0 HG21 VAL B 26 17.228 -5.389 -12.805 1.00 0.00 H new ATOM 0 HG22 VAL B 26 17.706 -4.671 -14.362 1.00 0.00 H new ATOM 0 HG23 VAL B 26 16.379 -5.855 -14.298 1.00 0.00 H new ATOM 1326 N PHE B 27 18.619 -9.406 -15.679 1.00 0.00 N ATOM 1327 CA PHE B 27 19.259 -10.708 -15.826 1.00 0.00 C ATOM 1328 C PHE B 27 19.747 -10.917 -17.256 1.00 0.00 C ATOM 1329 O PHE B 27 20.849 -11.414 -17.481 1.00 0.00 O ATOM 1330 CB PHE B 27 18.286 -11.824 -15.439 1.00 0.00 C ATOM 1331 CG PHE B 27 18.346 -12.193 -13.984 1.00 0.00 C ATOM 1332 CD1 PHE B 27 19.535 -12.612 -13.410 1.00 0.00 C ATOM 1333 CD2 PHE B 27 17.212 -12.121 -13.190 1.00 0.00 C ATOM 1334 CE1 PHE B 27 19.592 -12.953 -12.072 1.00 0.00 C ATOM 1335 CE2 PHE B 27 17.263 -12.460 -11.851 1.00 0.00 C ATOM 1336 CZ PHE B 27 18.456 -12.876 -11.291 1.00 0.00 C ATOM 0 H PHE B 27 17.614 -9.447 -15.509 1.00 0.00 H new ATOM 0 HA PHE B 27 20.121 -10.738 -15.159 1.00 0.00 H new ATOM 0 HB2 PHE B 27 17.271 -11.512 -15.685 1.00 0.00 H new ATOM 0 HB3 PHE B 27 18.502 -12.708 -16.039 1.00 0.00 H new ATOM 0 HD1 PHE B 27 20.428 -12.673 -14.015 1.00 0.00 H new ATOM 0 HD2 PHE B 27 16.277 -11.796 -13.623 1.00 0.00 H new ATOM 0 HE1 PHE B 27 20.525 -13.280 -11.637 1.00 0.00 H new ATOM 0 HE2 PHE B 27 16.372 -12.400 -11.243 1.00 0.00 H new ATOM 0 HZ PHE B 27 18.500 -13.140 -10.245 1.00 0.00 H new ATOM 1346 N ALA B 28 18.916 -10.533 -18.220 1.00 0.00 N ATOM 1347 CA ALA B 28 19.262 -10.676 -19.629 1.00 0.00 C ATOM 1348 C ALA B 28 20.483 -9.833 -19.983 1.00 0.00 C ATOM 1349 O ALA B 28 21.398 -10.304 -20.658 1.00 0.00 O ATOM 1350 CB ALA B 28 18.080 -10.289 -20.505 1.00 0.00 C ATOM 0 H ALA B 28 17.999 -10.121 -18.051 1.00 0.00 H new ATOM 0 HA ALA B 28 19.509 -11.722 -19.812 1.00 0.00 H new ATOM 0 HB1 ALA B 28 18.353 -10.401 -21.554 1.00 0.00 H new ATOM 0 HB2 ALA B 28 17.233 -10.936 -20.280 1.00 0.00 H new ATOM 0 HB3 ALA B 28 17.806 -9.252 -20.310 1.00 0.00 H new ATOM 1356 N GLU B 29 20.489 -8.586 -19.522 1.00 0.00 N ATOM 1357 CA GLU B 29 21.598 -7.678 -19.792 1.00 0.00 C ATOM 1358 C GLU B 29 22.855 -8.118 -19.047 1.00 0.00 C ATOM 1359 O GLU B 29 23.967 -7.712 -19.388 1.00 0.00 O ATOM 1360 CB GLU B 29 21.226 -6.250 -19.391 1.00 0.00 C ATOM 1361 CG GLU B 29 21.517 -5.932 -17.933 1.00 0.00 C ATOM 1362 CD GLU B 29 22.818 -5.176 -17.749 1.00 0.00 C ATOM 1363 OE1 GLU B 29 23.669 -5.228 -18.662 1.00 0.00 O ATOM 1364 OE2 GLU B 29 22.985 -4.531 -16.692 1.00 0.00 O ATOM 0 H GLU B 29 19.739 -8.182 -18.961 1.00 0.00 H new ATOM 0 HA GLU B 29 21.804 -7.704 -20.862 1.00 0.00 H new ATOM 0 HB2 GLU B 29 21.773 -5.550 -20.023 1.00 0.00 H new ATOM 0 HB3 GLU B 29 20.165 -6.092 -19.584 1.00 0.00 H new ATOM 0 HG2 GLU B 29 20.697 -5.342 -17.523 1.00 0.00 H new ATOM 0 HG3 GLU B 29 21.557 -6.861 -17.364 1.00 0.00 H new ATOM 1371 N LEU B 30 22.670 -8.948 -18.026 1.00 0.00 N ATOM 1372 CA LEU B 30 23.788 -9.443 -17.230 1.00 0.00 C ATOM 1373 C LEU B 30 24.344 -10.736 -17.817 1.00 0.00 C ATOM 1374 O LEU B 30 25.398 -11.215 -17.403 1.00 0.00 O ATOM 1375 CB LEU B 30 23.347 -9.673 -15.784 1.00 0.00 C ATOM 1376 CG LEU B 30 23.214 -8.421 -14.915 1.00 0.00 C ATOM 1377 CD1 LEU B 30 22.352 -8.707 -13.696 1.00 0.00 C ATOM 1378 CD2 LEU B 30 24.586 -7.916 -14.494 1.00 0.00 C ATOM 0 H LEU B 30 21.757 -9.292 -17.730 1.00 0.00 H new ATOM 0 HA LEU B 30 24.576 -8.690 -17.247 1.00 0.00 H new ATOM 0 HB2 LEU B 30 22.386 -10.186 -15.796 1.00 0.00 H new ATOM 0 HB3 LEU B 30 24.062 -10.346 -15.310 1.00 0.00 H new ATOM 0 HG LEU B 30 22.728 -7.643 -15.504 1.00 0.00 H new ATOM 0 HD11 LEU B 30 22.269 -7.805 -13.090 1.00 0.00 H new ATOM 0 HD12 LEU B 30 21.359 -9.021 -14.018 1.00 0.00 H new ATOM 0 HD13 LEU B 30 22.809 -9.500 -13.105 1.00 0.00 H new ATOM 0 HD21 LEU B 30 24.472 -7.025 -13.877 1.00 0.00 H new ATOM 0 HD22 LEU B 30 25.099 -8.690 -13.923 1.00 0.00 H new ATOM 0 HD23 LEU B 30 25.171 -7.671 -15.380 1.00 0.00 H new ATOM 1390 N GLY B 31 23.626 -11.297 -18.786 1.00 0.00 N ATOM 1391 CA GLY B 31 24.064 -12.529 -19.415 1.00 0.00 C ATOM 1392 C GLY B 31 23.423 -13.756 -18.797 1.00 0.00 C ATOM 1393 O GLY B 31 23.846 -14.883 -19.056 1.00 0.00 O ATOM 0 H GLY B 31 22.749 -10.920 -19.146 1.00 0.00 H new ATOM 0 HA2 GLY B 31 23.826 -12.495 -20.478 1.00 0.00 H new ATOM 0 HA3 GLY B 31 25.148 -12.609 -19.334 1.00 0.00 H new ATOM 1397 N TYR B 32 22.401 -13.537 -17.977 1.00 0.00 N ATOM 1398 CA TYR B 32 21.703 -14.634 -17.317 1.00 0.00 C ATOM 1399 C TYR B 32 20.478 -15.061 -18.119 1.00 0.00 C ATOM 1400 O TYR B 32 19.448 -15.427 -17.554 1.00 0.00 O ATOM 1401 CB TYR B 32 21.283 -14.223 -15.905 1.00 0.00 C ATOM 1402 CG TYR B 32 22.449 -13.995 -14.969 1.00 0.00 C ATOM 1403 CD1 TYR B 32 23.309 -12.918 -15.148 1.00 0.00 C ATOM 1404 CD2 TYR B 32 22.690 -14.856 -13.906 1.00 0.00 C ATOM 1405 CE1 TYR B 32 24.376 -12.707 -14.296 1.00 0.00 C ATOM 1406 CE2 TYR B 32 23.753 -14.652 -13.048 1.00 0.00 C ATOM 1407 CZ TYR B 32 24.593 -13.577 -13.247 1.00 0.00 C ATOM 1408 OH TYR B 32 25.654 -13.369 -12.395 1.00 0.00 O ATOM 0 H TYR B 32 22.038 -12.610 -17.754 1.00 0.00 H new ATOM 0 HA TYR B 32 22.387 -15.480 -17.254 1.00 0.00 H new ATOM 0 HB2 TYR B 32 20.690 -13.310 -15.962 1.00 0.00 H new ATOM 0 HB3 TYR B 32 20.638 -14.996 -15.487 1.00 0.00 H new ATOM 0 HD1 TYR B 32 23.140 -12.234 -15.967 1.00 0.00 H new ATOM 0 HD2 TYR B 32 22.035 -15.700 -13.748 1.00 0.00 H new ATOM 0 HE1 TYR B 32 25.036 -11.866 -14.450 1.00 0.00 H new ATOM 0 HE2 TYR B 32 23.925 -15.331 -12.226 1.00 0.00 H new ATOM 0 HH TYR B 32 25.666 -14.070 -11.710 1.00 0.00 H new ATOM 1418 N ASN B 33 20.598 -15.013 -19.442 1.00 0.00 N ATOM 1419 CA ASN B 33 19.501 -15.395 -20.324 1.00 0.00 C ATOM 1420 C ASN B 33 18.926 -16.749 -19.922 1.00 0.00 C ATOM 1421 O ASN B 33 19.570 -17.522 -19.212 1.00 0.00 O ATOM 1422 CB ASN B 33 19.980 -15.442 -21.777 1.00 0.00 C ATOM 1423 CG ASN B 33 18.845 -15.689 -22.752 1.00 0.00 C ATOM 1424 OD1 ASN B 33 18.588 -16.826 -23.148 1.00 0.00 O ATOM 1425 ND2 ASN B 33 18.159 -14.621 -23.144 1.00 0.00 N ATOM 0 H ASN B 33 21.444 -14.713 -19.927 1.00 0.00 H new ATOM 0 HA ASN B 33 18.715 -14.645 -20.232 1.00 0.00 H new ATOM 0 HB2 ASN B 33 20.471 -14.501 -22.026 1.00 0.00 H new ATOM 0 HB3 ASN B 33 20.726 -16.229 -21.885 1.00 0.00 H new ATOM 0 HD21 ASN B 33 17.384 -14.725 -23.799 1.00 0.00 H new ATOM 0 HD22 ASN B 33 18.407 -13.697 -22.790 1.00 0.00 H new ATOM 1432 N ASP B 34 17.712 -17.030 -20.382 1.00 0.00 N ATOM 1433 CA ASP B 34 17.051 -18.293 -20.072 1.00 0.00 C ATOM 1434 C ASP B 34 16.640 -18.345 -18.603 1.00 0.00 C ATOM 1435 O ASP B 34 17.046 -19.244 -17.867 1.00 0.00 O ATOM 1436 CB ASP B 34 17.971 -19.469 -20.399 1.00 0.00 C ATOM 1437 CG ASP B 34 17.203 -20.698 -20.844 1.00 0.00 C ATOM 1438 OD1 ASP B 34 16.829 -20.765 -22.034 1.00 0.00 O ATOM 1439 OD2 ASP B 34 16.976 -21.594 -20.003 1.00 0.00 O ATOM 0 H ASP B 34 17.166 -16.401 -20.970 1.00 0.00 H new ATOM 0 HA ASP B 34 16.153 -18.364 -20.685 1.00 0.00 H new ATOM 0 HB2 ASP B 34 18.667 -19.175 -21.185 1.00 0.00 H new ATOM 0 HB3 ASP B 34 18.568 -19.715 -19.521 1.00 0.00 H new ATOM 1444 N ILE B 35 15.835 -17.374 -18.185 1.00 0.00 N ATOM 1445 CA ILE B 35 15.370 -17.310 -16.804 1.00 0.00 C ATOM 1446 C ILE B 35 14.087 -18.113 -16.619 1.00 0.00 C ATOM 1447 O ILE B 35 13.278 -18.231 -17.538 1.00 0.00 O ATOM 1448 CB ILE B 35 15.121 -15.857 -16.361 1.00 0.00 C ATOM 1449 CG1 ILE B 35 16.009 -15.506 -15.165 1.00 0.00 C ATOM 1450 CG2 ILE B 35 13.654 -15.652 -16.017 1.00 0.00 C ATOM 1451 CD1 ILE B 35 17.408 -15.082 -15.554 1.00 0.00 C ATOM 0 H ILE B 35 15.491 -16.621 -18.782 1.00 0.00 H new ATOM 0 HA ILE B 35 16.158 -17.740 -16.185 1.00 0.00 H new ATOM 0 HB ILE B 35 15.376 -15.192 -17.186 1.00 0.00 H new ATOM 0 HG12 ILE B 35 15.539 -14.703 -14.598 1.00 0.00 H new ATOM 0 HG13 ILE B 35 16.071 -16.370 -14.503 1.00 0.00 H new ATOM 0 HG21 ILE B 35 13.494 -14.620 -15.706 1.00 0.00 H new ATOM 0 HG22 ILE B 35 13.042 -15.866 -16.893 1.00 0.00 H new ATOM 0 HG23 ILE B 35 13.373 -16.323 -15.205 1.00 0.00 H new ATOM 0 HD11 ILE B 35 17.980 -14.849 -14.656 1.00 0.00 H new ATOM 0 HD12 ILE B 35 17.896 -15.892 -16.095 1.00 0.00 H new ATOM 0 HD13 ILE B 35 17.357 -14.199 -16.191 1.00 0.00 H new ATOM 1463 N ASN B 36 13.908 -18.663 -15.422 1.00 0.00 N ATOM 1464 CA ASN B 36 12.722 -19.454 -15.114 1.00 0.00 C ATOM 1465 C ASN B 36 12.055 -18.959 -13.834 1.00 0.00 C ATOM 1466 O ASN B 36 12.683 -18.901 -12.777 1.00 0.00 O ATOM 1467 CB ASN B 36 13.092 -20.932 -14.972 1.00 0.00 C ATOM 1468 CG ASN B 36 12.970 -21.687 -16.281 1.00 0.00 C ATOM 1469 OD1 ASN B 36 13.692 -21.412 -17.239 1.00 0.00 O ATOM 1470 ND2 ASN B 36 12.051 -22.645 -16.327 1.00 0.00 N ATOM 0 H ASN B 36 14.569 -18.575 -14.650 1.00 0.00 H new ATOM 0 HA ASN B 36 12.016 -19.341 -15.937 1.00 0.00 H new ATOM 0 HB2 ASN B 36 14.114 -21.014 -14.602 1.00 0.00 H new ATOM 0 HB3 ASN B 36 12.446 -21.396 -14.227 1.00 0.00 H new ATOM 0 HD21 ASN B 36 11.922 -23.187 -17.181 1.00 0.00 H new ATOM 0 HD22 ASN B 36 11.475 -22.839 -15.508 1.00 0.00 H new ATOM 1477 N VAL B 37 10.778 -18.605 -13.938 1.00 0.00 N ATOM 1478 CA VAL B 37 10.024 -18.117 -12.789 1.00 0.00 C ATOM 1479 C VAL B 37 9.152 -19.218 -12.196 1.00 0.00 C ATOM 1480 O VAL B 37 8.508 -19.974 -12.923 1.00 0.00 O ATOM 1481 CB VAL B 37 9.133 -16.919 -13.169 1.00 0.00 C ATOM 1482 CG1 VAL B 37 8.024 -17.358 -14.112 1.00 0.00 C ATOM 1483 CG2 VAL B 37 8.557 -16.267 -11.921 1.00 0.00 C ATOM 0 H VAL B 37 10.244 -18.647 -14.806 1.00 0.00 H new ATOM 0 HA VAL B 37 10.753 -17.795 -12.046 1.00 0.00 H new ATOM 0 HB VAL B 37 9.746 -16.181 -13.686 1.00 0.00 H new ATOM 0 HG11 VAL B 37 7.404 -16.499 -14.370 1.00 0.00 H new ATOM 0 HG12 VAL B 37 8.462 -17.775 -15.019 1.00 0.00 H new ATOM 0 HG13 VAL B 37 7.410 -18.115 -13.624 1.00 0.00 H new ATOM 0 HG21 VAL B 37 7.930 -15.423 -12.208 1.00 0.00 H new ATOM 0 HG22 VAL B 37 7.957 -16.995 -11.374 1.00 0.00 H new ATOM 0 HG23 VAL B 37 9.370 -15.916 -11.286 1.00 0.00 H new ATOM 1493 N THR B 38 9.135 -19.302 -10.869 1.00 0.00 N ATOM 1494 CA THR B 38 8.342 -20.310 -10.178 1.00 0.00 C ATOM 1495 C THR B 38 7.525 -19.690 -9.050 1.00 0.00 C ATOM 1496 O THR B 38 8.080 -19.200 -8.066 1.00 0.00 O ATOM 1497 CB THR B 38 9.233 -21.425 -9.597 1.00 0.00 C ATOM 1498 OG1 THR B 38 10.378 -20.852 -8.955 1.00 0.00 O ATOM 1499 CG2 THR B 38 9.684 -22.381 -10.691 1.00 0.00 C ATOM 0 H THR B 38 9.662 -18.684 -10.252 1.00 0.00 H new ATOM 0 HA THR B 38 7.667 -20.741 -10.917 1.00 0.00 H new ATOM 0 HB THR B 38 8.649 -21.984 -8.866 1.00 0.00 H new ATOM 0 HG1 THR B 38 10.099 -20.087 -8.410 1.00 0.00 H new ATOM 0 HG21 THR B 38 10.312 -23.160 -10.258 1.00 0.00 H new ATOM 0 HG22 THR B 38 8.811 -22.837 -11.158 1.00 0.00 H new ATOM 0 HG23 THR B 38 10.253 -21.832 -11.442 1.00 0.00 H new ATOM 1576 N VAL B 44 6.377 -15.193 -5.836 1.00 0.00 N ATOM 1577 CA VAL B 44 7.070 -15.471 -7.089 1.00 0.00 C ATOM 1578 C VAL B 44 8.581 -15.370 -6.915 1.00 0.00 C ATOM 1579 O VAL B 44 9.086 -14.429 -6.301 1.00 0.00 O ATOM 1580 CB VAL B 44 6.626 -14.504 -8.202 1.00 0.00 C ATOM 1581 CG1 VAL B 44 5.255 -14.894 -8.733 1.00 0.00 C ATOM 1582 CG2 VAL B 44 6.621 -13.071 -7.692 1.00 0.00 C ATOM 0 HA VAL B 44 6.808 -16.489 -7.377 1.00 0.00 H new ATOM 0 HB VAL B 44 7.340 -14.571 -9.023 1.00 0.00 H new ATOM 0 HG11 VAL B 44 4.958 -14.199 -9.519 1.00 0.00 H new ATOM 0 HG12 VAL B 44 5.296 -15.905 -9.139 1.00 0.00 H new ATOM 0 HG13 VAL B 44 4.527 -14.858 -7.922 1.00 0.00 H new ATOM 0 HG21 VAL B 44 6.305 -12.401 -8.492 1.00 0.00 H new ATOM 0 HG22 VAL B 44 5.930 -12.986 -6.853 1.00 0.00 H new ATOM 0 HG23 VAL B 44 7.624 -12.798 -7.365 1.00 0.00 H new ATOM 1592 N THR B 45 9.301 -16.345 -7.461 1.00 0.00 N ATOM 1593 CA THR B 45 10.755 -16.367 -7.367 1.00 0.00 C ATOM 1594 C THR B 45 11.391 -16.628 -8.727 1.00 0.00 C ATOM 1595 O THR B 45 11.073 -17.614 -9.393 1.00 0.00 O ATOM 1596 CB THR B 45 11.238 -17.440 -6.372 1.00 0.00 C ATOM 1597 OG1 THR B 45 10.444 -17.396 -5.181 1.00 0.00 O ATOM 1598 CG2 THR B 45 12.703 -17.231 -6.019 1.00 0.00 C ATOM 0 H THR B 45 8.900 -17.131 -7.973 1.00 0.00 H new ATOM 0 HA THR B 45 11.063 -15.385 -7.008 1.00 0.00 H new ATOM 0 HB THR B 45 11.131 -18.417 -6.844 1.00 0.00 H new ATOM 0 HG1 THR B 45 10.985 -17.685 -4.417 1.00 0.00 H new ATOM 0 HG21 THR B 45 13.021 -18.000 -5.315 1.00 0.00 H new ATOM 0 HG22 THR B 45 13.308 -17.294 -6.924 1.00 0.00 H new ATOM 0 HG23 THR B 45 12.831 -16.249 -5.565 1.00 0.00 H new ATOM 1606 N VAL B 46 12.291 -15.740 -9.135 1.00 0.00 N ATOM 1607 CA VAL B 46 12.973 -15.876 -10.417 1.00 0.00 C ATOM 1608 C VAL B 46 14.264 -16.673 -10.270 1.00 0.00 C ATOM 1609 O VAL B 46 15.025 -16.472 -9.324 1.00 0.00 O ATOM 1610 CB VAL B 46 13.299 -14.500 -11.028 1.00 0.00 C ATOM 1611 CG1 VAL B 46 14.401 -13.812 -10.238 1.00 0.00 C ATOM 1612 CG2 VAL B 46 13.692 -14.647 -12.490 1.00 0.00 C ATOM 0 H VAL B 46 12.565 -14.918 -8.597 1.00 0.00 H new ATOM 0 HA VAL B 46 12.294 -16.409 -11.082 1.00 0.00 H new ATOM 0 HB VAL B 46 12.406 -13.878 -10.976 1.00 0.00 H new ATOM 0 HG11 VAL B 46 14.617 -12.842 -10.685 1.00 0.00 H new ATOM 0 HG12 VAL B 46 14.077 -13.673 -9.207 1.00 0.00 H new ATOM 0 HG13 VAL B 46 15.300 -14.428 -10.255 1.00 0.00 H new ATOM 0 HG21 VAL B 46 13.919 -13.665 -12.906 1.00 0.00 H new ATOM 0 HG22 VAL B 46 14.571 -15.286 -12.568 1.00 0.00 H new ATOM 0 HG23 VAL B 46 12.868 -15.095 -13.045 1.00 0.00 H new ATOM 1622 N GLU B 47 14.504 -17.579 -11.213 1.00 0.00 N ATOM 1623 CA GLU B 47 15.704 -18.407 -11.188 1.00 0.00 C ATOM 1624 C GLU B 47 16.529 -18.209 -12.456 1.00 0.00 C ATOM 1625 O GLU B 47 16.053 -18.454 -13.564 1.00 0.00 O ATOM 1626 CB GLU B 47 15.329 -19.883 -11.036 1.00 0.00 C ATOM 1627 CG GLU B 47 15.497 -20.411 -9.621 1.00 0.00 C ATOM 1628 CD GLU B 47 15.551 -21.926 -9.567 1.00 0.00 C ATOM 1629 OE1 GLU B 47 16.281 -22.524 -10.385 1.00 0.00 O ATOM 1630 OE2 GLU B 47 14.863 -22.513 -8.705 1.00 0.00 O ATOM 0 H GLU B 47 13.884 -17.758 -12.003 1.00 0.00 H new ATOM 0 HA GLU B 47 16.306 -18.102 -10.332 1.00 0.00 H new ATOM 0 HB2 GLU B 47 14.293 -20.020 -11.345 1.00 0.00 H new ATOM 0 HB3 GLU B 47 15.944 -20.477 -11.712 1.00 0.00 H new ATOM 0 HG2 GLU B 47 16.412 -20.003 -9.191 1.00 0.00 H new ATOM 0 HG3 GLU B 47 14.670 -20.058 -9.005 1.00 0.00 H new ATOM 1637 N GLY B 48 17.770 -17.762 -12.285 1.00 0.00 N ATOM 1638 CA GLY B 48 18.641 -17.538 -13.423 1.00 0.00 C ATOM 1639 C GLY B 48 19.989 -18.212 -13.263 1.00 0.00 C ATOM 1640 O GLY B 48 20.471 -18.392 -12.145 1.00 0.00 O ATOM 0 H GLY B 48 18.187 -17.551 -11.378 1.00 0.00 H new ATOM 0 HA2 GLY B 48 18.157 -17.910 -14.326 1.00 0.00 H new ATOM 0 HA3 GLY B 48 18.788 -16.467 -13.559 1.00 0.00 H new ATOM 1644 N GLN B 49 20.597 -18.588 -14.384 1.00 0.00 N ATOM 1645 CA GLN B 49 21.897 -19.250 -14.362 1.00 0.00 C ATOM 1646 C GLN B 49 22.897 -18.513 -15.246 1.00 0.00 C ATOM 1647 O GLN B 49 22.537 -17.969 -16.291 1.00 0.00 O ATOM 1648 CB GLN B 49 21.762 -20.701 -14.825 1.00 0.00 C ATOM 1649 CG GLN B 49 21.379 -20.839 -16.290 1.00 0.00 C ATOM 1650 CD GLN B 49 19.926 -20.490 -16.549 1.00 0.00 C ATOM 1651 OE1 GLN B 49 19.695 -19.329 -17.150 1.00 0.00 O flip ATOM 1652 NE2 GLN B 49 19.022 -21.255 -16.212 1.00 0.00 N flip ATOM 0 H GLN B 49 20.211 -18.446 -15.317 1.00 0.00 H new ATOM 0 HA GLN B 49 22.266 -19.236 -13.337 1.00 0.00 H new ATOM 0 HB2 GLN B 49 22.707 -21.217 -14.655 1.00 0.00 H new ATOM 0 HB3 GLN B 49 21.011 -21.201 -14.213 1.00 0.00 H new ATOM 0 HG2 GLN B 49 22.017 -20.191 -16.891 1.00 0.00 H new ATOM 0 HG3 GLN B 49 21.567 -21.862 -16.616 1.00 0.00 H new ATOM 0 HE21 GLN B 49 19.246 -22.138 -15.752 1.00 0.00 H new ATOM 0 HE22 GLN B 49 18.049 -21.006 -16.392 1.00 0.00 H new ATOM 1661 N LEU B 50 24.156 -18.497 -14.820 1.00 0.00 N ATOM 1662 CA LEU B 50 25.210 -17.826 -15.573 1.00 0.00 C ATOM 1663 C LEU B 50 26.138 -18.841 -16.233 1.00 0.00 C ATOM 1664 O LEU B 50 26.487 -19.857 -15.634 1.00 0.00 O ATOM 1665 CB LEU B 50 26.013 -16.905 -14.654 1.00 0.00 C ATOM 1666 CG LEU B 50 26.363 -15.529 -15.221 1.00 0.00 C ATOM 1667 CD1 LEU B 50 27.340 -14.806 -14.306 1.00 0.00 C ATOM 1668 CD2 LEU B 50 26.940 -15.661 -16.623 1.00 0.00 C ATOM 0 H LEU B 50 24.471 -18.941 -13.957 1.00 0.00 H new ATOM 0 HA LEU B 50 24.741 -17.229 -16.355 1.00 0.00 H new ATOM 0 HB2 LEU B 50 25.449 -16.763 -13.732 1.00 0.00 H new ATOM 0 HB3 LEU B 50 26.940 -17.411 -14.385 1.00 0.00 H new ATOM 0 HG LEU B 50 25.449 -14.939 -15.280 1.00 0.00 H new ATOM 0 HD11 LEU B 50 27.577 -13.829 -14.726 1.00 0.00 H new ATOM 0 HD12 LEU B 50 26.890 -14.678 -13.322 1.00 0.00 H new ATOM 0 HD13 LEU B 50 28.254 -15.393 -14.214 1.00 0.00 H new ATOM 0 HD21 LEU B 50 27.183 -14.672 -17.011 1.00 0.00 H new ATOM 0 HD22 LEU B 50 27.844 -16.270 -16.589 1.00 0.00 H new ATOM 0 HD23 LEU B 50 26.207 -16.136 -17.275 1.00 0.00 H new