USER MOD reduce.3.24.130724 H: found=0, std=0, add=993, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 990 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 125 ASN : amide:sc= -0.266 K(o=0.97,f=-0.26) USER MOD Set 1.2: A 129 LYS NZ :NH3+ -177:sc= 1.23 (180deg=1.18) USER MOD Set 2.1: A 11 ASN : amide:sc= 0.993 K(o=0.35,f=-2.9!) USER MOD Set 2.2: A 60 GLN : amide:sc= -0.646 X(o=0.35,f=-0.038) USER MOD Set 3.1: A 16 GLN : amide:sc= 0.482 K(o=1,f=-6.6!) USER MOD Set 3.2: A 43 HIS : no HE2:sc= 0.544 K(o=1,f=-8!) USER MOD Set 4.1: A 33 THR OG1 : rot 164:sc= 0.963 USER MOD Set 4.2: A 73 TYR OH : rot 30:sc= 0.843 USER MOD Set 5.1: A 5 MET CE :methyl -177:sc= -0.727 (180deg=-0.766) USER MOD Set 5.2: A 35 SER OG : rot -126:sc= 1.42 USER MOD Single : A 1 MET CE :methyl 162:sc= 0 (180deg=-0.248) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ -154:sc= 1.28 (180deg=1.18) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 SER OG : rot 180:sc= 0.118 USER MOD Single : A 13 SER OG : rot -140:sc= 0.708 USER MOD Single : A 15 SER OG : rot -90:sc= 0.0299 USER MOD Single : A 17 MET CE :methyl -167:sc= -1.1 (180deg=-1.47) USER MOD Single : A 23 LYS NZ :NH3+ -109:sc= 1.93 (180deg=0.43!) USER MOD Single : A 24 THR OG1 : rot -139:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 SER OG : rot 180:sc= 0.589 USER MOD Single : A 39 SER OG : rot -130:sc= 0.602 USER MOD Single : A 40 SER OG : rot 26:sc= 0.435 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 50 MET CE :methyl -113:sc= -0.207 (180deg=-1.75) USER MOD Single : A 58 SER OG : rot 180:sc= 0.152 USER MOD Single : A 61 THR OG1 : rot 180:sc= 0.112 USER MOD Single : A 62 SER OG : rot 180:sc= 0.0116 USER MOD Single : A 67 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 69 ASN : amide:sc= 0.362 K(o=0.36,f=-8.1!) USER MOD Single : A 78 SER OG : rot -150:sc= 0.112 USER MOD Single : A 82 SER OG : rot -69:sc= 0.118 USER MOD Single : A 85 ASN : amide:sc= 0.398 X(o=0.4,f=0) USER MOD Single : A 92 THR OG1 : rot 180:sc= -0.0575 USER MOD Single : A 93 GLN : amide:sc= 0.457 K(o=0.46,f=-0.77) USER MOD Single : A 100 GLN : amide:sc= 0 X(o=0,f=-0.46) USER MOD Single : A 107 GLN : amide:sc= 0.11 K(o=0.11,f=-0.53) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot 85:sc= 0.442 USER MOD Single : A 118 GLN : amide:sc= 1.19 K(o=1.2,f=-0.48) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.804 -0.107 0.419 1.00 0.00 N ATOM 2 CA MET A 1 2.576 -0.055 -0.861 1.00 0.00 C ATOM 3 C MET A 1 2.714 -1.469 -1.458 1.00 0.00 C ATOM 4 O MET A 1 3.010 -2.413 -0.728 1.00 0.00 O ATOM 5 CB MET A 1 3.980 0.592 -0.656 1.00 0.00 C ATOM 6 CG MET A 1 4.255 1.789 -1.573 1.00 0.00 C ATOM 7 SD MET A 1 5.579 2.878 -0.982 1.00 0.00 S ATOM 8 CE MET A 1 5.935 3.772 -2.516 1.00 0.00 C ATOM 0 H1 MET A 1 1.718 0.852 0.812 1.00 0.00 H new ATOM 0 H2 MET A 1 0.856 -0.493 0.237 1.00 0.00 H new ATOM 0 H3 MET A 1 2.301 -0.716 1.100 1.00 0.00 H new ATOM 0 HA MET A 1 2.023 0.572 -1.561 1.00 0.00 H new ATOM 0 HB2 MET A 1 4.073 0.913 0.381 1.00 0.00 H new ATOM 0 HB3 MET A 1 4.746 -0.165 -0.825 1.00 0.00 H new ATOM 0 HG2 MET A 1 4.516 1.422 -2.565 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.339 2.371 -1.679 1.00 0.00 H new ATOM 0 HE1 MET A 1 6.482 4.686 -2.286 1.00 0.00 H new ATOM 0 HE2 MET A 1 6.538 3.144 -3.172 1.00 0.00 H new ATOM 0 HE3 MET A 1 5.000 4.025 -3.015 1.00 0.00 H new ATOM 18 N LYS A 2 2.567 -1.637 -2.783 1.00 0.00 N ATOM 19 CA LYS A 2 2.849 -2.927 -3.444 1.00 0.00 C ATOM 20 C LYS A 2 4.361 -3.031 -3.532 1.00 0.00 C ATOM 21 O LYS A 2 4.965 -2.161 -4.152 1.00 0.00 O ATOM 22 CB LYS A 2 2.168 -3.041 -4.830 1.00 0.00 C ATOM 23 CG LYS A 2 0.698 -2.584 -4.816 1.00 0.00 C ATOM 24 CD LYS A 2 0.066 -2.650 -6.214 1.00 0.00 C ATOM 25 CE LYS A 2 -1.151 -1.714 -6.331 1.00 0.00 C ATOM 26 NZ LYS A 2 -2.361 -2.224 -5.622 1.00 0.00 N ATOM 0 H LYS A 2 2.256 -0.901 -3.417 1.00 0.00 H new ATOM 0 HA LYS A 2 2.435 -3.756 -2.871 1.00 0.00 H new ATOM 0 HB2 LYS A 2 2.723 -2.441 -5.552 1.00 0.00 H new ATOM 0 HB3 LYS A 2 2.218 -4.076 -5.170 1.00 0.00 H new ATOM 0 HG2 LYS A 2 0.129 -3.212 -4.130 1.00 0.00 H new ATOM 0 HG3 LYS A 2 0.638 -1.563 -4.438 1.00 0.00 H new ATOM 0 HD2 LYS A 2 0.809 -2.377 -6.963 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -0.240 -3.674 -6.427 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -0.888 -0.736 -5.928 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -1.390 -1.571 -7.385 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -3.143 -1.548 -5.740 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -2.635 -3.144 -6.022 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -2.149 -2.335 -4.610 1.00 0.00 H new ATOM 40 N LYS A 3 4.997 -4.010 -2.891 1.00 0.00 N ATOM 41 CA LYS A 3 6.453 -4.127 -2.978 1.00 0.00 C ATOM 42 C LYS A 3 6.778 -4.906 -4.236 1.00 0.00 C ATOM 43 O LYS A 3 6.142 -5.930 -4.489 1.00 0.00 O ATOM 44 CB LYS A 3 7.078 -4.715 -1.714 1.00 0.00 C ATOM 45 CG LYS A 3 6.645 -3.971 -0.450 1.00 0.00 C ATOM 46 CD LYS A 3 7.414 -4.495 0.760 1.00 0.00 C ATOM 47 CE LYS A 3 6.944 -3.717 1.989 1.00 0.00 C ATOM 48 NZ LYS A 3 7.608 -4.204 3.225 1.00 0.00 N ATOM 0 H LYS A 3 4.541 -4.719 -2.318 1.00 0.00 H new ATOM 0 HA LYS A 3 6.902 -3.136 -3.046 1.00 0.00 H new ATOM 0 HB2 LYS A 3 6.798 -5.765 -1.628 1.00 0.00 H new ATOM 0 HB3 LYS A 3 8.164 -4.680 -1.799 1.00 0.00 H new ATOM 0 HG2 LYS A 3 6.824 -2.902 -0.569 1.00 0.00 H new ATOM 0 HG3 LYS A 3 5.574 -4.099 -0.293 1.00 0.00 H new ATOM 0 HD2 LYS A 3 7.235 -5.562 0.893 1.00 0.00 H new ATOM 0 HD3 LYS A 3 8.487 -4.367 0.615 1.00 0.00 H new ATOM 0 HE2 LYS A 3 7.157 -2.657 1.854 1.00 0.00 H new ATOM 0 HE3 LYS A 3 5.863 -3.815 2.092 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 7.001 -4.007 4.046 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 7.769 -5.229 3.152 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 8.519 -3.718 3.344 1.00 0.00 H new ATOM 62 N VAL A 4 7.758 -4.421 -4.986 1.00 0.00 N ATOM 63 CA VAL A 4 8.090 -4.848 -6.335 1.00 0.00 C ATOM 64 C VAL A 4 9.532 -5.359 -6.369 1.00 0.00 C ATOM 65 O VAL A 4 10.414 -4.857 -5.666 1.00 0.00 O ATOM 66 CB VAL A 4 7.912 -3.669 -7.325 1.00 0.00 C ATOM 67 CG1 VAL A 4 7.621 -4.142 -8.757 1.00 0.00 C ATOM 68 CG2 VAL A 4 6.818 -2.660 -6.956 1.00 0.00 C ATOM 0 H VAL A 4 8.374 -3.680 -4.651 1.00 0.00 H new ATOM 0 HA VAL A 4 7.420 -5.654 -6.634 1.00 0.00 H new ATOM 0 HB VAL A 4 8.877 -3.166 -7.260 1.00 0.00 H new ATOM 0 HG11 VAL A 4 7.505 -3.277 -9.410 1.00 0.00 H new ATOM 0 HG12 VAL A 4 8.448 -4.756 -9.112 1.00 0.00 H new ATOM 0 HG13 VAL A 4 6.703 -4.729 -8.767 1.00 0.00 H new ATOM 0 HG21 VAL A 4 6.776 -1.876 -7.712 1.00 0.00 H new ATOM 0 HG22 VAL A 4 5.855 -3.169 -6.907 1.00 0.00 H new ATOM 0 HG23 VAL A 4 7.044 -2.217 -5.986 1.00 0.00 H new ATOM 78 N MET A 5 9.788 -6.308 -7.256 1.00 0.00 N ATOM 79 CA MET A 5 11.124 -6.772 -7.607 1.00 0.00 C ATOM 80 C MET A 5 11.193 -7.000 -9.106 1.00 0.00 C ATOM 81 O MET A 5 10.213 -7.439 -9.696 1.00 0.00 O ATOM 82 CB MET A 5 11.464 -8.074 -6.878 1.00 0.00 C ATOM 83 CG MET A 5 11.565 -7.906 -5.364 1.00 0.00 C ATOM 84 SD MET A 5 12.642 -9.145 -4.607 1.00 0.00 S ATOM 85 CE MET A 5 12.434 -8.687 -2.871 1.00 0.00 C ATOM 0 H MET A 5 9.050 -6.792 -7.768 1.00 0.00 H new ATOM 0 HA MET A 5 11.846 -6.013 -7.306 1.00 0.00 H new ATOM 0 HB2 MET A 5 10.702 -8.819 -7.104 1.00 0.00 H new ATOM 0 HB3 MET A 5 12.410 -8.460 -7.258 1.00 0.00 H new ATOM 0 HG2 MET A 5 11.944 -6.910 -5.136 1.00 0.00 H new ATOM 0 HG3 MET A 5 10.570 -7.976 -4.926 1.00 0.00 H new ATOM 0 HE1 MET A 5 13.072 -9.315 -2.250 1.00 0.00 H new ATOM 0 HE2 MET A 5 12.711 -7.642 -2.735 1.00 0.00 H new ATOM 0 HE3 MET A 5 11.393 -8.827 -2.580 1.00 0.00 H new ATOM 95 N PHE A 6 12.362 -6.772 -9.698 1.00 0.00 N ATOM 96 CA PHE A 6 12.688 -7.079 -11.081 1.00 0.00 C ATOM 97 C PHE A 6 14.037 -7.768 -11.005 1.00 0.00 C ATOM 98 O PHE A 6 15.002 -7.142 -10.573 1.00 0.00 O ATOM 99 CB PHE A 6 12.781 -5.799 -11.926 1.00 0.00 C ATOM 100 CG PHE A 6 11.529 -4.956 -11.984 1.00 0.00 C ATOM 101 CD1 PHE A 6 11.241 -4.073 -10.929 1.00 0.00 C ATOM 102 CD2 PHE A 6 10.673 -5.020 -13.099 1.00 0.00 C ATOM 103 CE1 PHE A 6 10.076 -3.295 -10.960 1.00 0.00 C ATOM 104 CE2 PHE A 6 9.525 -4.206 -13.145 1.00 0.00 C ATOM 105 CZ PHE A 6 9.217 -3.358 -12.069 1.00 0.00 C ATOM 0 H PHE A 6 13.144 -6.347 -9.199 1.00 0.00 H new ATOM 0 HA PHE A 6 11.926 -7.698 -11.555 1.00 0.00 H new ATOM 0 HB2 PHE A 6 13.592 -5.185 -11.533 1.00 0.00 H new ATOM 0 HB3 PHE A 6 13.056 -6.077 -12.943 1.00 0.00 H new ATOM 0 HD1 PHE A 6 11.919 -3.994 -10.092 1.00 0.00 H new ATOM 0 HD2 PHE A 6 10.896 -5.691 -13.916 1.00 0.00 H new ATOM 0 HE1 PHE A 6 9.838 -2.646 -10.130 1.00 0.00 H new ATOM 0 HE2 PHE A 6 8.879 -4.234 -14.010 1.00 0.00 H new ATOM 0 HZ PHE A 6 8.321 -2.755 -12.094 1.00 0.00 H new ATOM 115 N VAL A 7 14.118 -9.046 -11.357 1.00 0.00 N ATOM 116 CA VAL A 7 15.323 -9.824 -11.091 1.00 0.00 C ATOM 117 C VAL A 7 15.467 -10.926 -12.137 1.00 0.00 C ATOM 118 O VAL A 7 14.488 -11.548 -12.531 1.00 0.00 O ATOM 119 CB VAL A 7 15.270 -10.299 -9.610 1.00 0.00 C ATOM 120 CG1 VAL A 7 13.923 -10.928 -9.199 1.00 0.00 C ATOM 121 CG2 VAL A 7 16.431 -11.228 -9.231 1.00 0.00 C ATOM 0 H VAL A 7 13.372 -9.562 -11.823 1.00 0.00 H new ATOM 0 HA VAL A 7 16.235 -9.236 -11.191 1.00 0.00 H new ATOM 0 HB VAL A 7 15.378 -9.377 -9.039 1.00 0.00 H new ATOM 0 HG11 VAL A 7 13.968 -11.233 -8.153 1.00 0.00 H new ATOM 0 HG12 VAL A 7 13.125 -10.197 -9.330 1.00 0.00 H new ATOM 0 HG13 VAL A 7 13.723 -11.799 -9.823 1.00 0.00 H new ATOM 0 HG21 VAL A 7 16.335 -11.523 -8.186 1.00 0.00 H new ATOM 0 HG22 VAL A 7 16.407 -12.116 -9.862 1.00 0.00 H new ATOM 0 HG23 VAL A 7 17.377 -10.706 -9.375 1.00 0.00 H new ATOM 131 N CYS A 8 16.684 -11.126 -12.632 1.00 0.00 N ATOM 132 CA CYS A 8 17.101 -12.246 -13.471 1.00 0.00 C ATOM 133 C CYS A 8 18.177 -13.009 -12.672 1.00 0.00 C ATOM 134 O CYS A 8 18.534 -12.595 -11.568 1.00 0.00 O ATOM 135 CB CYS A 8 17.562 -11.660 -14.823 1.00 0.00 C ATOM 136 SG CYS A 8 18.375 -12.770 -16.026 1.00 0.00 S ATOM 0 H CYS A 8 17.448 -10.476 -12.449 1.00 0.00 H new ATOM 0 HA CYS A 8 16.317 -12.965 -13.710 1.00 0.00 H new ATOM 0 HB2 CYS A 8 16.689 -11.226 -15.311 1.00 0.00 H new ATOM 0 HB3 CYS A 8 18.249 -10.841 -14.612 1.00 0.00 H new ATOM 141 N LYS A 9 18.716 -14.118 -13.206 1.00 0.00 N ATOM 142 CA LYS A 9 19.756 -14.910 -12.522 1.00 0.00 C ATOM 143 C LYS A 9 20.965 -14.041 -12.140 1.00 0.00 C ATOM 144 O LYS A 9 21.557 -14.237 -11.080 1.00 0.00 O ATOM 145 CB LYS A 9 20.149 -16.107 -13.418 1.00 0.00 C ATOM 146 CG LYS A 9 21.114 -17.077 -12.710 1.00 0.00 C ATOM 147 CD LYS A 9 21.336 -18.395 -13.472 1.00 0.00 C ATOM 148 CE LYS A 9 22.063 -18.185 -14.815 1.00 0.00 C ATOM 149 NZ LYS A 9 22.362 -19.474 -15.499 1.00 0.00 N ATOM 0 H LYS A 9 18.447 -14.490 -14.117 1.00 0.00 H new ATOM 0 HA LYS A 9 19.359 -15.297 -11.583 1.00 0.00 H new ATOM 0 HB2 LYS A 9 19.249 -16.646 -13.715 1.00 0.00 H new ATOM 0 HB3 LYS A 9 20.615 -15.737 -14.331 1.00 0.00 H new ATOM 0 HG2 LYS A 9 22.075 -16.582 -12.570 1.00 0.00 H new ATOM 0 HG3 LYS A 9 20.725 -17.303 -11.717 1.00 0.00 H new ATOM 0 HD2 LYS A 9 21.917 -19.077 -12.851 1.00 0.00 H new ATOM 0 HD3 LYS A 9 20.373 -18.872 -13.654 1.00 0.00 H new ATOM 0 HE2 LYS A 9 21.448 -17.564 -15.466 1.00 0.00 H new ATOM 0 HE3 LYS A 9 22.993 -17.643 -14.642 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 22.851 -19.285 -16.397 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 22.970 -20.057 -14.890 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 21.474 -19.981 -15.688 1.00 0.00 H new ATOM 163 N ARG A 10 21.297 -13.058 -12.983 1.00 0.00 N ATOM 164 CA ARG A 10 22.267 -12.001 -12.695 1.00 0.00 C ATOM 165 C ARG A 10 21.572 -10.650 -12.873 1.00 0.00 C ATOM 166 O ARG A 10 20.571 -10.576 -13.579 1.00 0.00 O ATOM 167 CB ARG A 10 23.523 -12.182 -13.579 1.00 0.00 C ATOM 168 CG ARG A 10 23.290 -11.871 -15.070 1.00 0.00 C ATOM 169 CD ARG A 10 24.542 -12.175 -15.897 1.00 0.00 C ATOM 170 NE ARG A 10 24.465 -11.583 -17.249 1.00 0.00 N ATOM 171 CZ ARG A 10 25.294 -11.863 -18.268 1.00 0.00 C ATOM 172 NH1 ARG A 10 26.199 -12.835 -18.159 1.00 0.00 N ATOM 173 NH2 ARG A 10 25.227 -11.168 -19.396 1.00 0.00 N ATOM 0 H ARG A 10 20.885 -12.975 -13.912 1.00 0.00 H new ATOM 0 HA ARG A 10 22.622 -12.052 -11.666 1.00 0.00 H new ATOM 0 HB2 ARG A 10 24.316 -11.535 -13.203 1.00 0.00 H new ATOM 0 HB3 ARG A 10 23.877 -13.208 -13.484 1.00 0.00 H new ATOM 0 HG2 ARG A 10 22.452 -12.461 -15.442 1.00 0.00 H new ATOM 0 HG3 ARG A 10 23.018 -10.822 -15.188 1.00 0.00 H new ATOM 0 HD2 ARG A 10 25.421 -11.789 -15.381 1.00 0.00 H new ATOM 0 HD3 ARG A 10 24.670 -13.254 -15.980 1.00 0.00 H new ATOM 0 HE ARG A 10 23.722 -10.907 -17.422 1.00 0.00 H new ATOM 0 HH11 ARG A 10 26.267 -13.374 -17.296 1.00 0.00 H new ATOM 0 HH12 ARG A 10 26.824 -13.040 -18.939 1.00 0.00 H new ATOM 0 HH21 ARG A 10 24.544 -10.417 -19.492 1.00 0.00 H new ATOM 0 HH22 ARG A 10 25.859 -11.385 -20.167 1.00 0.00 H new ATOM 187 N ASN A 11 22.123 -9.583 -12.289 1.00 0.00 N ATOM 188 CA ASN A 11 21.646 -8.219 -12.562 1.00 0.00 C ATOM 189 C ASN A 11 22.064 -7.812 -13.971 1.00 0.00 C ATOM 190 O ASN A 11 21.287 -7.217 -14.717 1.00 0.00 O ATOM 191 CB ASN A 11 22.236 -7.229 -11.537 1.00 0.00 C ATOM 192 CG ASN A 11 21.727 -5.792 -11.701 1.00 0.00 C ATOM 193 OD1 ASN A 11 20.801 -5.491 -12.441 1.00 0.00 O ATOM 194 ND2 ASN A 11 22.341 -4.865 -10.987 1.00 0.00 N ATOM 0 H ASN A 11 22.897 -9.633 -11.626 1.00 0.00 H new ATOM 0 HA ASN A 11 20.559 -8.198 -12.480 1.00 0.00 H new ATOM 0 HB2 ASN A 11 21.998 -7.576 -10.532 1.00 0.00 H new ATOM 0 HB3 ASN A 11 23.322 -7.232 -11.626 1.00 0.00 H new ATOM 0 HD21 ASN A 11 22.043 -3.892 -11.051 1.00 0.00 H new ATOM 0 HD22 ASN A 11 23.113 -5.123 -10.372 1.00 0.00 H new ATOM 201 N SER A 12 23.310 -8.146 -14.313 1.00 0.00 N ATOM 202 CA SER A 12 24.001 -7.721 -15.518 1.00 0.00 C ATOM 203 C SER A 12 23.154 -8.013 -16.755 1.00 0.00 C ATOM 204 O SER A 12 22.491 -9.050 -16.842 1.00 0.00 O ATOM 205 CB SER A 12 25.375 -8.409 -15.571 1.00 0.00 C ATOM 206 OG SER A 12 25.908 -8.572 -14.257 1.00 0.00 O ATOM 0 H SER A 12 23.886 -8.749 -13.725 1.00 0.00 H new ATOM 0 HA SER A 12 24.159 -6.643 -15.501 1.00 0.00 H new ATOM 0 HB2 SER A 12 25.282 -9.381 -16.054 1.00 0.00 H new ATOM 0 HB3 SER A 12 26.061 -7.816 -16.176 1.00 0.00 H new ATOM 0 HG SER A 12 26.782 -9.013 -14.311 1.00 0.00 H new ATOM 212 N SER A 13 23.186 -7.094 -17.712 1.00 0.00 N ATOM 213 CA SER A 13 22.372 -7.076 -18.915 1.00 0.00 C ATOM 214 C SER A 13 20.874 -6.858 -18.667 1.00 0.00 C ATOM 215 O SER A 13 20.345 -5.805 -19.023 1.00 0.00 O ATOM 216 CB SER A 13 22.648 -8.328 -19.774 1.00 0.00 C ATOM 217 OG SER A 13 24.038 -8.618 -19.864 1.00 0.00 O ATOM 0 H SER A 13 23.819 -6.296 -17.664 1.00 0.00 H new ATOM 0 HA SER A 13 22.679 -6.193 -19.476 1.00 0.00 H new ATOM 0 HB2 SER A 13 22.126 -9.184 -19.345 1.00 0.00 H new ATOM 0 HB3 SER A 13 22.244 -8.177 -20.775 1.00 0.00 H new ATOM 0 HG SER A 13 24.254 -8.906 -20.775 1.00 0.00 H new ATOM 223 N ARG A 14 20.176 -7.803 -18.026 1.00 0.00 N ATOM 224 CA ARG A 14 18.706 -7.790 -17.989 1.00 0.00 C ATOM 225 C ARG A 14 18.059 -6.896 -16.931 1.00 0.00 C ATOM 226 O ARG A 14 17.125 -6.175 -17.266 1.00 0.00 O ATOM 227 CB ARG A 14 18.192 -9.247 -17.919 1.00 0.00 C ATOM 228 CG ARG A 14 16.964 -9.499 -18.814 1.00 0.00 C ATOM 229 CD ARG A 14 17.280 -9.592 -20.317 1.00 0.00 C ATOM 230 NE ARG A 14 18.175 -10.723 -20.646 1.00 0.00 N ATOM 231 CZ ARG A 14 18.765 -10.939 -21.833 1.00 0.00 C ATOM 232 NH1 ARG A 14 18.527 -10.137 -22.867 1.00 0.00 N ATOM 233 NH2 ARG A 14 19.599 -11.963 -21.977 1.00 0.00 N ATOM 0 H ARG A 14 20.602 -8.584 -17.527 1.00 0.00 H new ATOM 0 HA ARG A 14 18.388 -7.313 -18.916 1.00 0.00 H new ATOM 0 HB2 ARG A 14 18.994 -9.923 -18.214 1.00 0.00 H new ATOM 0 HB3 ARG A 14 17.937 -9.487 -16.887 1.00 0.00 H new ATOM 0 HG2 ARG A 14 16.484 -10.425 -18.498 1.00 0.00 H new ATOM 0 HG3 ARG A 14 16.244 -8.696 -18.656 1.00 0.00 H new ATOM 0 HD2 ARG A 14 16.349 -9.698 -20.873 1.00 0.00 H new ATOM 0 HD3 ARG A 14 17.743 -8.661 -20.645 1.00 0.00 H new ATOM 0 HE ARG A 14 18.361 -11.399 -19.905 1.00 0.00 H new ATOM 0 HH11 ARG A 14 17.890 -9.347 -22.764 1.00 0.00 H new ATOM 0 HH12 ARG A 14 18.981 -10.312 -23.763 1.00 0.00 H new ATOM 0 HH21 ARG A 14 19.789 -12.581 -21.188 1.00 0.00 H new ATOM 0 HH22 ARG A 14 20.050 -12.131 -22.877 1.00 0.00 H new ATOM 247 N SER A 15 18.501 -6.928 -15.674 1.00 0.00 N ATOM 248 CA SER A 15 17.774 -6.276 -14.574 1.00 0.00 C ATOM 249 C SER A 15 18.167 -4.821 -14.319 1.00 0.00 C ATOM 250 O SER A 15 17.672 -4.210 -13.373 1.00 0.00 O ATOM 251 CB SER A 15 17.854 -7.147 -13.313 1.00 0.00 C ATOM 252 OG SER A 15 17.645 -8.516 -13.647 1.00 0.00 O ATOM 0 H SER A 15 19.360 -7.398 -15.387 1.00 0.00 H new ATOM 0 HA SER A 15 16.732 -6.200 -14.886 1.00 0.00 H new ATOM 0 HB2 SER A 15 18.828 -7.025 -12.839 1.00 0.00 H new ATOM 0 HB3 SER A 15 17.105 -6.823 -12.590 1.00 0.00 H new ATOM 0 HG SER A 15 16.689 -8.724 -13.591 1.00 0.00 H new ATOM 258 N GLN A 16 19.040 -4.227 -15.141 1.00 0.00 N ATOM 259 CA GLN A 16 19.587 -2.913 -14.824 1.00 0.00 C ATOM 260 C GLN A 16 18.553 -1.790 -14.906 1.00 0.00 C ATOM 261 O GLN A 16 18.465 -0.994 -13.981 1.00 0.00 O ATOM 262 CB GLN A 16 20.861 -2.642 -15.638 1.00 0.00 C ATOM 263 CG GLN A 16 20.758 -2.624 -17.181 1.00 0.00 C ATOM 264 CD GLN A 16 22.159 -2.557 -17.809 1.00 0.00 C ATOM 265 OE1 GLN A 16 23.087 -2.043 -17.189 1.00 0.00 O ATOM 266 NE2 GLN A 16 22.370 -3.083 -19.006 1.00 0.00 N ATOM 0 H GLN A 16 19.375 -4.631 -16.015 1.00 0.00 H new ATOM 0 HA GLN A 16 19.878 -2.926 -13.774 1.00 0.00 H new ATOM 0 HB2 GLN A 16 21.259 -1.678 -15.321 1.00 0.00 H new ATOM 0 HB3 GLN A 16 21.597 -3.397 -15.363 1.00 0.00 H new ATOM 0 HG2 GLN A 16 20.239 -3.518 -17.528 1.00 0.00 H new ATOM 0 HG3 GLN A 16 20.167 -1.767 -17.503 1.00 0.00 H new ATOM 0 HE21 GLN A 16 21.598 -3.509 -19.519 1.00 0.00 H new ATOM 0 HE22 GLN A 16 23.304 -3.062 -19.415 1.00 0.00 H new ATOM 275 N MET A 17 17.763 -1.726 -15.982 1.00 0.00 N ATOM 276 CA MET A 17 16.898 -0.576 -16.280 1.00 0.00 C ATOM 277 C MET A 17 15.512 -0.667 -15.637 1.00 0.00 C ATOM 278 O MET A 17 14.945 0.352 -15.256 1.00 0.00 O ATOM 279 CB MET A 17 16.812 -0.459 -17.810 1.00 0.00 C ATOM 280 CG MET A 17 15.950 0.676 -18.386 1.00 0.00 C ATOM 281 SD MET A 17 16.468 2.411 -18.251 1.00 0.00 S ATOM 282 CE MET A 17 16.211 2.918 -16.529 1.00 0.00 C ATOM 0 H MET A 17 17.704 -2.472 -16.675 1.00 0.00 H new ATOM 0 HA MET A 17 17.335 0.322 -15.843 1.00 0.00 H new ATOM 0 HB2 MET A 17 17.825 -0.342 -18.196 1.00 0.00 H new ATOM 0 HB3 MET A 17 16.430 -1.403 -18.199 1.00 0.00 H new ATOM 0 HG2 MET A 17 15.814 0.466 -19.447 1.00 0.00 H new ATOM 0 HG3 MET A 17 14.969 0.599 -17.918 1.00 0.00 H new ATOM 0 HE1 MET A 17 16.288 4.003 -16.454 1.00 0.00 H new ATOM 0 HE2 MET A 17 15.221 2.601 -16.200 1.00 0.00 H new ATOM 0 HE3 MET A 17 16.969 2.456 -15.897 1.00 0.00 H new ATOM 292 N ALA A 18 14.961 -1.875 -15.529 1.00 0.00 N ATOM 293 CA ALA A 18 13.556 -2.094 -15.152 1.00 0.00 C ATOM 294 C ALA A 18 13.222 -1.551 -13.764 1.00 0.00 C ATOM 295 O ALA A 18 12.245 -0.823 -13.611 1.00 0.00 O ATOM 296 CB ALA A 18 13.238 -3.587 -15.302 1.00 0.00 C ATOM 0 H ALA A 18 15.476 -2.738 -15.701 1.00 0.00 H new ATOM 0 HA ALA A 18 12.914 -1.525 -15.825 1.00 0.00 H new ATOM 0 HB1 ALA A 18 12.199 -3.767 -15.026 1.00 0.00 H new ATOM 0 HB2 ALA A 18 13.397 -3.891 -16.337 1.00 0.00 H new ATOM 0 HB3 ALA A 18 13.892 -4.166 -14.650 1.00 0.00 H new ATOM 302 N GLU A 19 14.079 -1.803 -12.770 1.00 0.00 N ATOM 303 CA GLU A 19 13.861 -1.250 -11.432 1.00 0.00 C ATOM 304 C GLU A 19 13.963 0.276 -11.478 1.00 0.00 C ATOM 305 O GLU A 19 13.187 0.962 -10.815 1.00 0.00 O ATOM 306 CB GLU A 19 14.821 -1.905 -10.427 1.00 0.00 C ATOM 307 CG GLU A 19 16.256 -1.362 -10.389 1.00 0.00 C ATOM 308 CD GLU A 19 16.447 -0.049 -9.612 1.00 0.00 C ATOM 309 OE1 GLU A 19 15.668 0.292 -8.694 1.00 0.00 O ATOM 310 OE2 GLU A 19 17.418 0.677 -9.905 1.00 0.00 O ATOM 0 H GLU A 19 14.917 -2.377 -12.864 1.00 0.00 H new ATOM 0 HA GLU A 19 12.854 -1.482 -11.085 1.00 0.00 H new ATOM 0 HB2 GLU A 19 14.392 -1.802 -9.430 1.00 0.00 H new ATOM 0 HB3 GLU A 19 14.867 -2.972 -10.646 1.00 0.00 H new ATOM 0 HG2 GLU A 19 16.902 -2.122 -9.948 1.00 0.00 H new ATOM 0 HG3 GLU A 19 16.596 -1.210 -11.414 1.00 0.00 H new ATOM 317 N GLY A 20 14.850 0.787 -12.342 1.00 0.00 N ATOM 318 CA GLY A 20 15.039 2.204 -12.609 1.00 0.00 C ATOM 319 C GLY A 20 13.714 2.866 -12.949 1.00 0.00 C ATOM 320 O GLY A 20 13.283 3.788 -12.261 1.00 0.00 O ATOM 0 H GLY A 20 15.475 0.196 -12.890 1.00 0.00 H new ATOM 0 HA2 GLY A 20 15.480 2.688 -11.738 1.00 0.00 H new ATOM 0 HA3 GLY A 20 15.739 2.334 -13.434 1.00 0.00 H new ATOM 324 N PHE A 21 13.011 2.368 -13.967 1.00 0.00 N ATOM 325 CA PHE A 21 11.732 2.973 -14.330 1.00 0.00 C ATOM 326 C PHE A 21 10.670 2.750 -13.283 1.00 0.00 C ATOM 327 O PHE A 21 9.801 3.605 -13.146 1.00 0.00 O ATOM 328 CB PHE A 21 11.232 2.492 -15.686 1.00 0.00 C ATOM 329 CG PHE A 21 11.796 3.335 -16.794 1.00 0.00 C ATOM 330 CD1 PHE A 21 11.500 4.712 -16.853 1.00 0.00 C ATOM 331 CD2 PHE A 21 12.668 2.746 -17.716 1.00 0.00 C ATOM 332 CE1 PHE A 21 12.081 5.494 -17.868 1.00 0.00 C ATOM 333 CE2 PHE A 21 13.251 3.531 -18.719 1.00 0.00 C ATOM 334 CZ PHE A 21 12.948 4.902 -18.805 1.00 0.00 C ATOM 0 H PHE A 21 13.295 1.572 -14.538 1.00 0.00 H new ATOM 0 HA PHE A 21 11.923 4.044 -14.394 1.00 0.00 H new ATOM 0 HB2 PHE A 21 11.517 1.450 -15.835 1.00 0.00 H new ATOM 0 HB3 PHE A 21 10.143 2.531 -15.712 1.00 0.00 H new ATOM 0 HD1 PHE A 21 10.836 5.161 -16.129 1.00 0.00 H new ATOM 0 HD2 PHE A 21 12.891 1.691 -17.655 1.00 0.00 H new ATOM 0 HE1 PHE A 21 11.861 6.550 -17.928 1.00 0.00 H new ATOM 0 HE2 PHE A 21 13.933 3.084 -19.427 1.00 0.00 H new ATOM 0 HZ PHE A 21 13.382 5.501 -19.592 1.00 0.00 H new ATOM 344 N ALA A 22 10.710 1.654 -12.533 1.00 0.00 N ATOM 345 CA ALA A 22 9.628 1.380 -11.604 1.00 0.00 C ATOM 346 C ALA A 22 9.629 2.363 -10.433 1.00 0.00 C ATOM 347 O ALA A 22 8.551 2.757 -9.999 1.00 0.00 O ATOM 348 CB ALA A 22 9.699 -0.080 -11.176 1.00 0.00 C ATOM 0 H ALA A 22 11.458 0.961 -12.549 1.00 0.00 H new ATOM 0 HA ALA A 22 8.668 1.534 -12.097 1.00 0.00 H new ATOM 0 HB1 ALA A 22 8.890 -0.294 -10.478 1.00 0.00 H new ATOM 0 HB2 ALA A 22 9.602 -0.721 -12.052 1.00 0.00 H new ATOM 0 HB3 ALA A 22 10.656 -0.271 -10.691 1.00 0.00 H new ATOM 354 N LYS A 23 10.794 2.863 -9.989 1.00 0.00 N ATOM 355 CA LYS A 23 10.806 3.932 -8.974 1.00 0.00 C ATOM 356 C LYS A 23 10.255 5.251 -9.534 1.00 0.00 C ATOM 357 O LYS A 23 9.753 6.068 -8.772 1.00 0.00 O ATOM 358 CB LYS A 23 12.199 4.082 -8.320 1.00 0.00 C ATOM 359 CG LYS A 23 13.266 4.842 -9.142 1.00 0.00 C ATOM 360 CD LYS A 23 14.488 3.999 -9.526 1.00 0.00 C ATOM 361 CE LYS A 23 15.300 3.558 -8.299 1.00 0.00 C ATOM 362 NZ LYS A 23 16.620 3.002 -8.658 1.00 0.00 N ATOM 0 H LYS A 23 11.714 2.557 -10.304 1.00 0.00 H new ATOM 0 HA LYS A 23 10.128 3.638 -8.173 1.00 0.00 H new ATOM 0 HB2 LYS A 23 12.075 4.593 -7.365 1.00 0.00 H new ATOM 0 HB3 LYS A 23 12.583 3.086 -8.101 1.00 0.00 H new ATOM 0 HG2 LYS A 23 12.803 5.224 -10.052 1.00 0.00 H new ATOM 0 HG3 LYS A 23 13.601 5.706 -8.569 1.00 0.00 H new ATOM 0 HD2 LYS A 23 14.160 3.118 -10.078 1.00 0.00 H new ATOM 0 HD3 LYS A 23 15.128 4.574 -10.195 1.00 0.00 H new ATOM 0 HE2 LYS A 23 15.438 4.411 -7.634 1.00 0.00 H new ATOM 0 HE3 LYS A 23 14.734 2.810 -7.744 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 16.621 1.975 -8.491 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 16.814 3.190 -9.662 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 17.355 3.448 -8.074 1.00 0.00 H new ATOM 376 N THR A 24 10.338 5.456 -10.853 1.00 0.00 N ATOM 377 CA THR A 24 9.913 6.662 -11.534 1.00 0.00 C ATOM 378 C THR A 24 8.402 6.622 -11.784 1.00 0.00 C ATOM 379 O THR A 24 7.662 7.498 -11.339 1.00 0.00 O ATOM 380 CB THR A 24 10.797 6.803 -12.781 1.00 0.00 C ATOM 381 OG1 THR A 24 12.062 7.286 -12.383 1.00 0.00 O ATOM 382 CG2 THR A 24 10.222 7.716 -13.851 1.00 0.00 C ATOM 0 H THR A 24 10.718 4.755 -11.489 1.00 0.00 H new ATOM 0 HA THR A 24 10.051 7.565 -10.939 1.00 0.00 H new ATOM 0 HB THR A 24 10.864 5.814 -13.234 1.00 0.00 H new ATOM 0 HG1 THR A 24 12.375 7.953 -13.029 1.00 0.00 H new ATOM 0 HG21 THR A 24 10.907 7.761 -14.697 1.00 0.00 H new ATOM 0 HG22 THR A 24 9.260 7.326 -14.183 1.00 0.00 H new ATOM 0 HG23 THR A 24 10.086 8.717 -13.441 1.00 0.00 H new ATOM 390 N LEU A 25 7.938 5.578 -12.467 1.00 0.00 N ATOM 391 CA LEU A 25 6.553 5.434 -12.911 1.00 0.00 C ATOM 392 C LEU A 25 5.660 5.064 -11.729 1.00 0.00 C ATOM 393 O LEU A 25 4.518 5.506 -11.646 1.00 0.00 O ATOM 394 CB LEU A 25 6.485 4.332 -13.983 1.00 0.00 C ATOM 395 CG LEU A 25 7.280 4.602 -15.271 1.00 0.00 C ATOM 396 CD1 LEU A 25 7.347 3.299 -16.069 1.00 0.00 C ATOM 397 CD2 LEU A 25 6.662 5.721 -16.113 1.00 0.00 C ATOM 0 H LEU A 25 8.528 4.790 -12.733 1.00 0.00 H new ATOM 0 HA LEU A 25 6.203 6.378 -13.329 1.00 0.00 H new ATOM 0 HB2 LEU A 25 6.846 3.402 -13.544 1.00 0.00 H new ATOM 0 HB3 LEU A 25 5.440 4.175 -14.250 1.00 0.00 H new ATOM 0 HG LEU A 25 8.281 4.940 -15.004 1.00 0.00 H new ATOM 0 HD11 LEU A 25 7.907 3.464 -16.989 1.00 0.00 H new ATOM 0 HD12 LEU A 25 7.845 2.533 -15.474 1.00 0.00 H new ATOM 0 HD13 LEU A 25 6.337 2.970 -16.313 1.00 0.00 H new ATOM 0 HD21 LEU A 25 7.260 5.873 -17.011 1.00 0.00 H new ATOM 0 HD22 LEU A 25 5.646 5.445 -16.396 1.00 0.00 H new ATOM 0 HD23 LEU A 25 6.639 6.643 -15.532 1.00 0.00 H new ATOM 409 N GLY A 26 6.190 4.245 -10.812 1.00 0.00 N ATOM 410 CA GLY A 26 5.483 3.729 -9.651 1.00 0.00 C ATOM 411 C GLY A 26 5.610 4.626 -8.424 1.00 0.00 C ATOM 412 O GLY A 26 5.180 4.213 -7.347 1.00 0.00 O ATOM 0 H GLY A 26 7.154 3.917 -10.867 1.00 0.00 H new ATOM 0 HA2 GLY A 26 4.428 3.610 -9.899 1.00 0.00 H new ATOM 0 HA3 GLY A 26 5.867 2.738 -9.410 1.00 0.00 H new ATOM 416 N ALA A 27 6.221 5.809 -8.562 1.00 0.00 N ATOM 417 CA ALA A 27 6.499 6.733 -7.469 1.00 0.00 C ATOM 418 C ALA A 27 5.229 6.982 -6.646 1.00 0.00 C ATOM 419 O ALA A 27 4.190 7.355 -7.195 1.00 0.00 O ATOM 420 CB ALA A 27 7.050 8.050 -8.037 1.00 0.00 C ATOM 0 H ALA A 27 6.543 6.155 -9.466 1.00 0.00 H new ATOM 0 HA ALA A 27 7.247 6.296 -6.808 1.00 0.00 H new ATOM 0 HB1 ALA A 27 7.258 8.740 -7.219 1.00 0.00 H new ATOM 0 HB2 ALA A 27 7.970 7.852 -8.587 1.00 0.00 H new ATOM 0 HB3 ALA A 27 6.314 8.493 -8.708 1.00 0.00 H new ATOM 426 N GLY A 28 5.312 6.752 -5.331 1.00 0.00 N ATOM 427 CA GLY A 28 4.207 6.947 -4.392 1.00 0.00 C ATOM 428 C GLY A 28 3.141 5.845 -4.429 1.00 0.00 C ATOM 429 O GLY A 28 2.243 5.859 -3.584 1.00 0.00 O ATOM 0 H GLY A 28 6.166 6.419 -4.883 1.00 0.00 H new ATOM 0 HA2 GLY A 28 4.612 7.010 -3.382 1.00 0.00 H new ATOM 0 HA3 GLY A 28 3.730 7.904 -4.605 1.00 0.00 H new ATOM 433 N LYS A 29 3.227 4.879 -5.355 1.00 0.00 N ATOM 434 CA LYS A 29 2.265 3.776 -5.492 1.00 0.00 C ATOM 435 C LYS A 29 2.889 2.471 -5.016 1.00 0.00 C ATOM 436 O LYS A 29 2.304 1.768 -4.194 1.00 0.00 O ATOM 437 CB LYS A 29 1.758 3.654 -6.950 1.00 0.00 C ATOM 438 CG LYS A 29 1.111 4.953 -7.462 1.00 0.00 C ATOM 439 CD LYS A 29 0.605 4.797 -8.906 1.00 0.00 C ATOM 440 CE LYS A 29 0.123 6.133 -9.498 1.00 0.00 C ATOM 441 NZ LYS A 29 -1.153 6.619 -8.905 1.00 0.00 N ATOM 0 H LYS A 29 3.980 4.842 -6.042 1.00 0.00 H new ATOM 0 HA LYS A 29 1.401 3.993 -4.864 1.00 0.00 H new ATOM 0 HB2 LYS A 29 2.592 3.387 -7.600 1.00 0.00 H new ATOM 0 HB3 LYS A 29 1.033 2.842 -7.012 1.00 0.00 H new ATOM 0 HG2 LYS A 29 0.281 5.228 -6.812 1.00 0.00 H new ATOM 0 HG3 LYS A 29 1.836 5.766 -7.415 1.00 0.00 H new ATOM 0 HD2 LYS A 29 1.404 4.393 -9.528 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -0.212 4.076 -8.927 1.00 0.00 H new ATOM 0 HE2 LYS A 29 0.895 6.888 -9.348 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -0.006 6.019 -10.574 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -1.420 7.521 -9.348 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -1.902 5.917 -9.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -1.029 6.759 -7.882 1.00 0.00 H new ATOM 455 N ILE A 30 4.075 2.132 -5.530 1.00 0.00 N ATOM 456 CA ILE A 30 4.697 0.819 -5.352 1.00 0.00 C ATOM 457 C ILE A 30 6.187 0.982 -5.032 1.00 0.00 C ATOM 458 O ILE A 30 6.815 1.944 -5.471 1.00 0.00 O ATOM 459 CB ILE A 30 4.384 -0.060 -6.593 1.00 0.00 C ATOM 460 CG1 ILE A 30 5.062 0.439 -7.887 1.00 0.00 C ATOM 461 CG2 ILE A 30 2.863 -0.137 -6.830 1.00 0.00 C ATOM 462 CD1 ILE A 30 4.783 -0.436 -9.120 1.00 0.00 C ATOM 0 H ILE A 30 4.638 2.773 -6.090 1.00 0.00 H new ATOM 0 HA ILE A 30 4.280 0.292 -4.494 1.00 0.00 H new ATOM 0 HB ILE A 30 4.790 -1.046 -6.367 1.00 0.00 H new ATOM 0 HG12 ILE A 30 4.725 1.455 -8.092 1.00 0.00 H new ATOM 0 HG13 ILE A 30 6.139 0.487 -7.725 1.00 0.00 H new ATOM 0 HG21 ILE A 30 2.662 -0.757 -7.704 1.00 0.00 H new ATOM 0 HG22 ILE A 30 2.380 -0.574 -5.956 1.00 0.00 H new ATOM 0 HG23 ILE A 30 2.470 0.866 -6.998 1.00 0.00 H new ATOM 0 HD11 ILE A 30 5.295 -0.017 -9.987 1.00 0.00 H new ATOM 0 HD12 ILE A 30 5.146 -1.448 -8.938 1.00 0.00 H new ATOM 0 HD13 ILE A 30 3.710 -0.464 -9.311 1.00 0.00 H new ATOM 474 N ALA A 31 6.733 0.063 -4.231 1.00 0.00 N ATOM 475 CA ALA A 31 8.068 0.150 -3.639 1.00 0.00 C ATOM 476 C ALA A 31 8.968 -0.885 -4.299 1.00 0.00 C ATOM 477 O ALA A 31 8.822 -2.069 -4.014 1.00 0.00 O ATOM 478 CB ALA A 31 7.958 -0.114 -2.129 1.00 0.00 C ATOM 0 H ALA A 31 6.240 -0.791 -3.969 1.00 0.00 H new ATOM 0 HA ALA A 31 8.495 1.141 -3.796 1.00 0.00 H new ATOM 0 HB1 ALA A 31 8.947 -0.052 -1.676 1.00 0.00 H new ATOM 0 HB2 ALA A 31 7.304 0.631 -1.676 1.00 0.00 H new ATOM 0 HB3 ALA A 31 7.545 -1.109 -1.963 1.00 0.00 H new ATOM 484 N VAL A 32 9.867 -0.494 -5.195 1.00 0.00 N ATOM 485 CA VAL A 32 10.795 -1.446 -5.805 1.00 0.00 C ATOM 486 C VAL A 32 11.964 -1.696 -4.845 1.00 0.00 C ATOM 487 O VAL A 32 12.443 -0.765 -4.193 1.00 0.00 O ATOM 488 CB VAL A 32 11.190 -0.977 -7.220 1.00 0.00 C ATOM 489 CG1 VAL A 32 11.951 0.352 -7.273 1.00 0.00 C ATOM 490 CG2 VAL A 32 11.978 -2.067 -7.947 1.00 0.00 C ATOM 0 H VAL A 32 9.975 0.468 -5.515 1.00 0.00 H new ATOM 0 HA VAL A 32 10.324 -2.417 -5.959 1.00 0.00 H new ATOM 0 HB VAL A 32 10.245 -0.790 -7.730 1.00 0.00 H new ATOM 0 HG11 VAL A 32 12.184 0.597 -8.309 1.00 0.00 H new ATOM 0 HG12 VAL A 32 11.334 1.142 -6.844 1.00 0.00 H new ATOM 0 HG13 VAL A 32 12.877 0.264 -6.704 1.00 0.00 H new ATOM 0 HG21 VAL A 32 12.248 -1.718 -8.944 1.00 0.00 H new ATOM 0 HG22 VAL A 32 12.884 -2.297 -7.386 1.00 0.00 H new ATOM 0 HG23 VAL A 32 11.365 -2.965 -8.031 1.00 0.00 H new ATOM 500 N THR A 33 12.437 -2.943 -4.781 1.00 0.00 N ATOM 501 CA THR A 33 13.596 -3.339 -3.996 1.00 0.00 C ATOM 502 C THR A 33 14.540 -4.196 -4.842 1.00 0.00 C ATOM 503 O THR A 33 15.729 -3.899 -4.925 1.00 0.00 O ATOM 504 CB THR A 33 13.132 -4.051 -2.714 1.00 0.00 C ATOM 505 OG1 THR A 33 12.097 -3.339 -2.051 1.00 0.00 O ATOM 506 CG2 THR A 33 14.289 -4.304 -1.743 1.00 0.00 C ATOM 0 H THR A 33 12.011 -3.719 -5.287 1.00 0.00 H new ATOM 0 HA THR A 33 14.161 -2.458 -3.692 1.00 0.00 H new ATOM 0 HB THR A 33 12.736 -5.014 -3.036 1.00 0.00 H new ATOM 0 HG1 THR A 33 11.656 -3.929 -1.405 1.00 0.00 H new ATOM 0 HG21 THR A 33 13.913 -4.809 -0.853 1.00 0.00 H new ATOM 0 HG22 THR A 33 15.039 -4.931 -2.226 1.00 0.00 H new ATOM 0 HG23 THR A 33 14.739 -3.353 -1.458 1.00 0.00 H new ATOM 514 N SER A 34 13.996 -5.218 -5.508 1.00 0.00 N ATOM 515 CA SER A 34 14.667 -6.137 -6.436 1.00 0.00 C ATOM 516 C SER A 34 15.792 -7.015 -5.863 1.00 0.00 C ATOM 517 O SER A 34 15.973 -8.127 -6.368 1.00 0.00 O ATOM 518 CB SER A 34 15.076 -5.378 -7.689 1.00 0.00 C ATOM 519 OG SER A 34 13.886 -4.821 -8.238 1.00 0.00 O ATOM 0 H SER A 34 13.006 -5.442 -5.407 1.00 0.00 H new ATOM 0 HA SER A 34 13.924 -6.895 -6.683 1.00 0.00 H new ATOM 0 HB2 SER A 34 15.795 -4.595 -7.449 1.00 0.00 H new ATOM 0 HB3 SER A 34 15.557 -6.044 -8.405 1.00 0.00 H new ATOM 0 HG SER A 34 14.105 -4.319 -9.051 1.00 0.00 H new ATOM 525 N SER A 35 16.477 -6.585 -4.804 1.00 0.00 N ATOM 526 CA SER A 35 17.414 -7.396 -4.034 1.00 0.00 C ATOM 527 C SER A 35 18.489 -8.014 -4.954 1.00 0.00 C ATOM 528 O SER A 35 19.031 -7.303 -5.808 1.00 0.00 O ATOM 529 CB SER A 35 16.598 -8.379 -3.174 1.00 0.00 C ATOM 530 OG SER A 35 15.527 -7.685 -2.542 1.00 0.00 O ATOM 0 H SER A 35 16.391 -5.633 -4.449 1.00 0.00 H new ATOM 0 HA SER A 35 18.002 -6.800 -3.336 1.00 0.00 H new ATOM 0 HB2 SER A 35 16.206 -9.184 -3.796 1.00 0.00 H new ATOM 0 HB3 SER A 35 17.239 -8.840 -2.423 1.00 0.00 H new ATOM 0 HG SER A 35 15.563 -7.838 -1.575 1.00 0.00 H new ATOM 536 N GLY A 36 18.830 -9.297 -4.801 1.00 0.00 N ATOM 537 CA GLY A 36 19.796 -10.002 -5.621 1.00 0.00 C ATOM 538 C GLY A 36 19.760 -11.475 -5.243 1.00 0.00 C ATOM 539 O GLY A 36 19.112 -11.848 -4.267 1.00 0.00 O ATOM 0 H GLY A 36 18.422 -9.886 -4.075 1.00 0.00 H new ATOM 0 HA2 GLY A 36 19.561 -9.876 -6.678 1.00 0.00 H new ATOM 0 HA3 GLY A 36 20.795 -9.595 -5.466 1.00 0.00 H new ATOM 543 N LEU A 37 20.428 -12.325 -6.014 1.00 0.00 N ATOM 544 CA LEU A 37 20.510 -13.759 -5.808 1.00 0.00 C ATOM 545 C LEU A 37 21.971 -14.148 -5.574 1.00 0.00 C ATOM 546 O LEU A 37 22.285 -14.913 -4.663 1.00 0.00 O ATOM 547 CB LEU A 37 19.920 -14.470 -7.034 1.00 0.00 C ATOM 548 CG LEU A 37 18.385 -14.379 -7.151 1.00 0.00 C ATOM 549 CD1 LEU A 37 17.993 -14.657 -8.604 1.00 0.00 C ATOM 550 CD2 LEU A 37 17.685 -15.364 -6.208 1.00 0.00 C ATOM 0 H LEU A 37 20.949 -12.016 -6.835 1.00 0.00 H new ATOM 0 HA LEU A 37 19.937 -14.061 -4.931 1.00 0.00 H new ATOM 0 HB2 LEU A 37 20.366 -14.045 -7.934 1.00 0.00 H new ATOM 0 HB3 LEU A 37 20.207 -15.521 -7.002 1.00 0.00 H new ATOM 0 HG LEU A 37 18.065 -13.379 -6.858 1.00 0.00 H new ATOM 0 HD11 LEU A 37 16.909 -14.597 -8.706 1.00 0.00 H new ATOM 0 HD12 LEU A 37 18.460 -13.918 -9.255 1.00 0.00 H new ATOM 0 HD13 LEU A 37 18.329 -15.654 -8.887 1.00 0.00 H new ATOM 0 HD21 LEU A 37 16.605 -15.270 -6.320 1.00 0.00 H new ATOM 0 HD22 LEU A 37 17.988 -16.382 -6.455 1.00 0.00 H new ATOM 0 HD23 LEU A 37 17.964 -15.142 -5.178 1.00 0.00 H new ATOM 562 N GLU A 38 22.852 -13.564 -6.385 1.00 0.00 N ATOM 563 CA GLU A 38 24.307 -13.569 -6.276 1.00 0.00 C ATOM 564 C GLU A 38 24.652 -12.138 -6.678 1.00 0.00 C ATOM 565 O GLU A 38 25.128 -11.336 -5.872 1.00 0.00 O ATOM 566 CB GLU A 38 24.955 -14.619 -7.197 1.00 0.00 C ATOM 567 CG GLU A 38 24.451 -16.037 -6.917 1.00 0.00 C ATOM 568 CD GLU A 38 25.267 -17.091 -7.685 1.00 0.00 C ATOM 569 OE1 GLU A 38 24.908 -17.428 -8.840 1.00 0.00 O ATOM 570 OE2 GLU A 38 26.270 -17.607 -7.134 1.00 0.00 O ATOM 0 H GLU A 38 22.540 -13.034 -7.199 1.00 0.00 H new ATOM 0 HA GLU A 38 24.677 -13.843 -5.288 1.00 0.00 H new ATOM 0 HB2 GLU A 38 24.749 -14.362 -8.236 1.00 0.00 H new ATOM 0 HB3 GLU A 38 26.037 -14.590 -7.070 1.00 0.00 H new ATOM 0 HG2 GLU A 38 24.509 -16.240 -5.848 1.00 0.00 H new ATOM 0 HG3 GLU A 38 23.401 -16.113 -7.199 1.00 0.00 H new ATOM 577 N SER A 39 24.234 -11.825 -7.911 1.00 0.00 N ATOM 578 CA SER A 39 24.164 -10.507 -8.505 1.00 0.00 C ATOM 579 C SER A 39 25.473 -9.704 -8.560 1.00 0.00 C ATOM 580 O SER A 39 26.561 -10.173 -8.218 1.00 0.00 O ATOM 581 CB SER A 39 22.975 -9.815 -7.818 1.00 0.00 C ATOM 582 OG SER A 39 21.834 -10.664 -7.929 1.00 0.00 O ATOM 0 H SER A 39 23.915 -12.547 -8.557 1.00 0.00 H new ATOM 0 HA SER A 39 23.998 -10.588 -9.579 1.00 0.00 H new ATOM 0 HB2 SER A 39 23.203 -9.621 -6.770 1.00 0.00 H new ATOM 0 HB3 SER A 39 22.777 -8.850 -8.285 1.00 0.00 H new ATOM 0 HG SER A 39 21.074 -10.148 -8.270 1.00 0.00 H new ATOM 588 N SER A 40 25.348 -8.518 -9.159 1.00 0.00 N ATOM 589 CA SER A 40 26.401 -7.601 -9.570 1.00 0.00 C ATOM 590 C SER A 40 25.721 -6.241 -9.785 1.00 0.00 C ATOM 591 O SER A 40 24.494 -6.140 -9.700 1.00 0.00 O ATOM 592 CB SER A 40 27.005 -8.156 -10.873 1.00 0.00 C ATOM 593 OG SER A 40 27.955 -9.178 -10.603 1.00 0.00 O ATOM 0 H SER A 40 24.425 -8.147 -9.386 1.00 0.00 H new ATOM 0 HA SER A 40 27.203 -7.492 -8.840 1.00 0.00 H new ATOM 0 HB2 SER A 40 26.211 -8.552 -11.506 1.00 0.00 H new ATOM 0 HB3 SER A 40 27.483 -7.349 -11.428 1.00 0.00 H new ATOM 0 HG SER A 40 27.747 -9.599 -9.743 1.00 0.00 H new ATOM 599 N ARG A 41 26.476 -5.188 -10.079 1.00 0.00 N ATOM 600 CA ARG A 41 25.933 -3.847 -10.334 1.00 0.00 C ATOM 601 C ARG A 41 25.672 -3.675 -11.832 1.00 0.00 C ATOM 602 O ARG A 41 25.962 -4.556 -12.641 1.00 0.00 O ATOM 603 CB ARG A 41 26.825 -2.776 -9.657 1.00 0.00 C ATOM 604 CG ARG A 41 27.815 -2.034 -10.569 1.00 0.00 C ATOM 605 CD ARG A 41 28.798 -1.214 -9.728 1.00 0.00 C ATOM 606 NE ARG A 41 29.671 -0.380 -10.575 1.00 0.00 N ATOM 607 CZ ARG A 41 30.765 0.281 -10.167 1.00 0.00 C ATOM 608 NH1 ARG A 41 31.144 0.250 -8.890 1.00 0.00 N ATOM 609 NH2 ARG A 41 31.477 0.982 -11.044 1.00 0.00 N ATOM 0 H ARG A 41 27.492 -5.236 -10.149 1.00 0.00 H new ATOM 0 HA ARG A 41 24.957 -3.709 -9.870 1.00 0.00 H new ATOM 0 HB2 ARG A 41 26.175 -2.038 -9.187 1.00 0.00 H new ATOM 0 HB3 ARG A 41 27.391 -3.257 -8.859 1.00 0.00 H new ATOM 0 HG2 ARG A 41 28.361 -2.750 -11.184 1.00 0.00 H new ATOM 0 HG3 ARG A 41 27.272 -1.378 -11.249 1.00 0.00 H new ATOM 0 HD2 ARG A 41 28.245 -0.578 -9.037 1.00 0.00 H new ATOM 0 HD3 ARG A 41 29.409 -1.885 -9.124 1.00 0.00 H new ATOM 0 HE ARG A 41 29.420 -0.298 -11.560 1.00 0.00 H new ATOM 0 HH11 ARG A 41 30.600 -0.281 -8.209 1.00 0.00 H new ATOM 0 HH12 ARG A 41 31.978 0.757 -8.593 1.00 0.00 H new ATOM 0 HH21 ARG A 41 31.191 1.016 -12.022 1.00 0.00 H new ATOM 0 HH22 ARG A 41 32.309 1.486 -10.738 1.00 0.00 H new ATOM 623 N VAL A 42 25.064 -2.546 -12.180 1.00 0.00 N ATOM 624 CA VAL A 42 24.662 -2.232 -13.544 1.00 0.00 C ATOM 625 C VAL A 42 25.878 -1.845 -14.409 1.00 0.00 C ATOM 626 O VAL A 42 27.000 -1.736 -13.907 1.00 0.00 O ATOM 627 CB VAL A 42 23.582 -1.145 -13.493 1.00 0.00 C ATOM 628 CG1 VAL A 42 22.407 -1.549 -12.592 1.00 0.00 C ATOM 629 CG2 VAL A 42 24.142 0.214 -13.064 1.00 0.00 C ATOM 0 H VAL A 42 24.833 -1.812 -11.510 1.00 0.00 H new ATOM 0 HA VAL A 42 24.236 -3.111 -14.027 1.00 0.00 H new ATOM 0 HB VAL A 42 23.210 -1.042 -14.512 1.00 0.00 H new ATOM 0 HG11 VAL A 42 21.664 -0.751 -12.583 1.00 0.00 H new ATOM 0 HG12 VAL A 42 21.953 -2.463 -12.974 1.00 0.00 H new ATOM 0 HG13 VAL A 42 22.768 -1.719 -11.578 1.00 0.00 H new ATOM 0 HG21 VAL A 42 23.337 0.949 -13.044 1.00 0.00 H new ATOM 0 HG22 VAL A 42 24.581 0.129 -12.070 1.00 0.00 H new ATOM 0 HG23 VAL A 42 24.907 0.533 -13.772 1.00 0.00 H new ATOM 639 N HIS A 43 25.652 -1.611 -15.705 1.00 0.00 N ATOM 640 CA HIS A 43 26.707 -1.317 -16.675 1.00 0.00 C ATOM 641 C HIS A 43 26.984 0.198 -16.709 1.00 0.00 C ATOM 642 O HIS A 43 26.073 0.983 -16.442 1.00 0.00 O ATOM 643 CB HIS A 43 26.296 -1.906 -18.039 1.00 0.00 C ATOM 644 CG HIS A 43 26.217 -3.418 -18.024 1.00 0.00 C ATOM 645 ND1 HIS A 43 26.998 -4.274 -18.764 1.00 0.00 N ATOM 646 CD2 HIS A 43 25.384 -4.206 -17.273 1.00 0.00 C ATOM 647 CE1 HIS A 43 26.645 -5.535 -18.469 1.00 0.00 C ATOM 648 NE2 HIS A 43 25.659 -5.545 -17.557 1.00 0.00 N ATOM 0 H HIS A 43 24.718 -1.621 -16.114 1.00 0.00 H new ATOM 0 HA HIS A 43 27.650 -1.784 -16.390 1.00 0.00 H new ATOM 0 HB2 HIS A 43 25.327 -1.499 -18.329 1.00 0.00 H new ATOM 0 HB3 HIS A 43 27.014 -1.591 -18.797 1.00 0.00 H new ATOM 0 HD1 HIS A 43 27.723 -3.997 -19.426 1.00 0.00 H new ATOM 0 HD2 HIS A 43 24.639 -3.850 -16.577 1.00 0.00 H new ATOM 0 HE1 HIS A 43 27.091 -6.417 -18.904 1.00 0.00 H new ATOM 656 N PRO A 44 28.207 0.645 -17.055 1.00 0.00 N ATOM 657 CA PRO A 44 28.597 2.056 -16.961 1.00 0.00 C ATOM 658 C PRO A 44 27.775 2.957 -17.887 1.00 0.00 C ATOM 659 O PRO A 44 27.245 3.981 -17.451 1.00 0.00 O ATOM 660 CB PRO A 44 30.091 2.095 -17.315 1.00 0.00 C ATOM 661 CG PRO A 44 30.313 0.816 -18.126 1.00 0.00 C ATOM 662 CD PRO A 44 29.350 -0.163 -17.461 1.00 0.00 C ATOM 0 HA PRO A 44 28.408 2.444 -15.960 1.00 0.00 H new ATOM 0 HB2 PRO A 44 30.341 2.984 -17.895 1.00 0.00 H new ATOM 0 HB3 PRO A 44 30.713 2.113 -16.420 1.00 0.00 H new ATOM 0 HG2 PRO A 44 30.083 0.959 -19.182 1.00 0.00 H new ATOM 0 HG3 PRO A 44 31.346 0.472 -18.069 1.00 0.00 H new ATOM 0 HD2 PRO A 44 29.050 -0.951 -18.151 1.00 0.00 H new ATOM 0 HD3 PRO A 44 29.813 -0.650 -16.603 1.00 0.00 H new ATOM 670 N THR A 45 27.617 2.560 -19.153 1.00 0.00 N ATOM 671 CA THR A 45 26.884 3.348 -20.142 1.00 0.00 C ATOM 672 C THR A 45 25.390 3.381 -19.795 1.00 0.00 C ATOM 673 O THR A 45 24.722 4.367 -20.106 1.00 0.00 O ATOM 674 CB THR A 45 27.175 2.797 -21.545 1.00 0.00 C ATOM 675 OG1 THR A 45 28.557 2.490 -21.693 1.00 0.00 O ATOM 676 CG2 THR A 45 26.733 3.735 -22.674 1.00 0.00 C ATOM 0 H THR A 45 27.993 1.685 -19.518 1.00 0.00 H new ATOM 0 HA THR A 45 27.219 4.385 -20.129 1.00 0.00 H new ATOM 0 HB THR A 45 26.581 1.887 -21.633 1.00 0.00 H new ATOM 0 HG1 THR A 45 28.720 2.139 -22.593 1.00 0.00 H new ATOM 0 HG21 THR A 45 26.969 3.282 -23.637 1.00 0.00 H new ATOM 0 HG22 THR A 45 25.658 3.904 -22.607 1.00 0.00 H new ATOM 0 HG23 THR A 45 27.257 4.687 -22.582 1.00 0.00 H new ATOM 684 N ALA A 46 24.876 2.368 -19.076 1.00 0.00 N ATOM 685 CA ALA A 46 23.494 2.368 -18.611 1.00 0.00 C ATOM 686 C ALA A 46 23.255 3.606 -17.781 1.00 0.00 C ATOM 687 O ALA A 46 22.360 4.374 -18.091 1.00 0.00 O ATOM 688 CB ALA A 46 23.155 1.105 -17.793 1.00 0.00 C ATOM 0 H ALA A 46 25.406 1.539 -18.808 1.00 0.00 H new ATOM 0 HA ALA A 46 22.841 2.366 -19.484 1.00 0.00 H new ATOM 0 HB1 ALA A 46 22.115 1.150 -17.468 1.00 0.00 H new ATOM 0 HB2 ALA A 46 23.304 0.220 -18.412 1.00 0.00 H new ATOM 0 HB3 ALA A 46 23.806 1.051 -16.920 1.00 0.00 H new ATOM 694 N ILE A 47 24.084 3.837 -16.771 1.00 0.00 N ATOM 695 CA ILE A 47 23.842 4.913 -15.819 1.00 0.00 C ATOM 696 C ILE A 47 23.827 6.246 -16.566 1.00 0.00 C ATOM 697 O ILE A 47 22.988 7.082 -16.261 1.00 0.00 O ATOM 698 CB ILE A 47 24.910 4.892 -14.703 1.00 0.00 C ATOM 699 CG1 ILE A 47 24.826 3.589 -13.881 1.00 0.00 C ATOM 700 CG2 ILE A 47 24.759 6.108 -13.771 1.00 0.00 C ATOM 701 CD1 ILE A 47 26.117 3.295 -13.102 1.00 0.00 C ATOM 0 H ILE A 47 24.929 3.294 -16.590 1.00 0.00 H new ATOM 0 HA ILE A 47 22.873 4.776 -15.339 1.00 0.00 H new ATOM 0 HB ILE A 47 25.887 4.940 -15.184 1.00 0.00 H new ATOM 0 HG12 ILE A 47 23.993 3.658 -13.182 1.00 0.00 H new ATOM 0 HG13 ILE A 47 24.612 2.755 -14.550 1.00 0.00 H new ATOM 0 HG21 ILE A 47 25.523 6.068 -12.995 1.00 0.00 H new ATOM 0 HG22 ILE A 47 24.875 7.025 -14.348 1.00 0.00 H new ATOM 0 HG23 ILE A 47 23.772 6.092 -13.309 1.00 0.00 H new ATOM 0 HD11 ILE A 47 26.001 2.367 -12.542 1.00 0.00 H new ATOM 0 HD12 ILE A 47 26.948 3.196 -13.800 1.00 0.00 H new ATOM 0 HD13 ILE A 47 26.319 4.113 -12.411 1.00 0.00 H new ATOM 713 N ALA A 48 24.688 6.437 -17.568 1.00 0.00 N ATOM 714 CA ALA A 48 24.722 7.684 -18.321 1.00 0.00 C ATOM 715 C ALA A 48 23.405 7.905 -19.080 1.00 0.00 C ATOM 716 O ALA A 48 22.828 8.989 -19.010 1.00 0.00 O ATOM 717 CB ALA A 48 25.923 7.686 -19.272 1.00 0.00 C ATOM 0 H ALA A 48 25.369 5.742 -17.874 1.00 0.00 H new ATOM 0 HA ALA A 48 24.835 8.513 -17.623 1.00 0.00 H new ATOM 0 HB1 ALA A 48 25.942 8.621 -19.832 1.00 0.00 H new ATOM 0 HB2 ALA A 48 26.843 7.589 -18.696 1.00 0.00 H new ATOM 0 HB3 ALA A 48 25.839 6.850 -19.966 1.00 0.00 H new ATOM 723 N MET A 49 22.904 6.879 -19.773 1.00 0.00 N ATOM 724 CA MET A 49 21.672 6.974 -20.567 1.00 0.00 C ATOM 725 C MET A 49 20.446 7.076 -19.643 1.00 0.00 C ATOM 726 O MET A 49 19.462 7.783 -19.889 1.00 0.00 O ATOM 727 CB MET A 49 21.604 5.759 -21.510 1.00 0.00 C ATOM 728 CG MET A 49 22.811 5.699 -22.461 1.00 0.00 C ATOM 729 SD MET A 49 22.932 7.050 -23.662 1.00 0.00 S ATOM 730 CE MET A 49 24.365 7.906 -22.960 1.00 0.00 C ATOM 0 H MET A 49 23.340 5.957 -19.801 1.00 0.00 H new ATOM 0 HA MET A 49 21.675 7.879 -21.174 1.00 0.00 H new ATOM 0 HB2 MET A 49 21.562 4.844 -20.919 1.00 0.00 H new ATOM 0 HB3 MET A 49 20.685 5.804 -22.094 1.00 0.00 H new ATOM 0 HG2 MET A 49 23.722 5.687 -21.862 1.00 0.00 H new ATOM 0 HG3 MET A 49 22.775 4.755 -23.005 1.00 0.00 H new ATOM 0 HE1 MET A 49 24.600 8.780 -23.567 1.00 0.00 H new ATOM 0 HE2 MET A 49 24.137 8.222 -21.942 1.00 0.00 H new ATOM 0 HE3 MET A 49 25.221 7.232 -22.947 1.00 0.00 H new ATOM 740 N MET A 50 20.518 6.396 -18.512 1.00 0.00 N ATOM 741 CA MET A 50 19.438 6.347 -17.557 1.00 0.00 C ATOM 742 C MET A 50 19.419 7.699 -16.837 1.00 0.00 C ATOM 743 O MET A 50 18.348 8.225 -16.567 1.00 0.00 O ATOM 744 CB MET A 50 19.579 5.107 -16.664 1.00 0.00 C ATOM 745 CG MET A 50 19.562 3.739 -17.405 1.00 0.00 C ATOM 746 SD MET A 50 19.351 3.656 -19.226 1.00 0.00 S ATOM 747 CE MET A 50 19.516 1.871 -19.579 1.00 0.00 C ATOM 0 H MET A 50 21.339 5.859 -18.233 1.00 0.00 H new ATOM 0 HA MET A 50 18.459 6.219 -18.018 1.00 0.00 H new ATOM 0 HB2 MET A 50 20.513 5.187 -16.107 1.00 0.00 H new ATOM 0 HB3 MET A 50 18.770 5.114 -15.933 1.00 0.00 H new ATOM 0 HG2 MET A 50 20.499 3.236 -17.169 1.00 0.00 H new ATOM 0 HG3 MET A 50 18.761 3.146 -16.963 1.00 0.00 H new ATOM 0 HE1 MET A 50 20.426 1.696 -20.153 1.00 0.00 H new ATOM 0 HE2 MET A 50 19.567 1.318 -18.641 1.00 0.00 H new ATOM 0 HE3 MET A 50 18.654 1.533 -20.154 1.00 0.00 H new ATOM 757 N GLU A 51 20.571 8.347 -16.659 1.00 0.00 N ATOM 758 CA GLU A 51 20.676 9.716 -16.193 1.00 0.00 C ATOM 759 C GLU A 51 20.192 10.687 -17.279 1.00 0.00 C ATOM 760 O GLU A 51 19.778 11.795 -16.936 1.00 0.00 O ATOM 761 CB GLU A 51 22.106 10.008 -15.703 1.00 0.00 C ATOM 762 CG GLU A 51 22.257 11.393 -15.061 1.00 0.00 C ATOM 763 CD GLU A 51 23.649 11.566 -14.426 1.00 0.00 C ATOM 764 OE1 GLU A 51 24.619 11.893 -15.154 1.00 0.00 O ATOM 765 OE2 GLU A 51 23.783 11.399 -13.189 1.00 0.00 O ATOM 0 H GLU A 51 21.477 7.916 -16.842 1.00 0.00 H new ATOM 0 HA GLU A 51 20.022 9.863 -15.334 1.00 0.00 H new ATOM 0 HB2 GLU A 51 22.397 9.246 -14.980 1.00 0.00 H new ATOM 0 HB3 GLU A 51 22.794 9.928 -16.544 1.00 0.00 H new ATOM 0 HG2 GLU A 51 22.100 12.165 -15.815 1.00 0.00 H new ATOM 0 HG3 GLU A 51 21.488 11.529 -14.300 1.00 0.00 H new ATOM 772 N GLU A 52 20.146 10.290 -18.562 1.00 0.00 N ATOM 773 CA GLU A 52 19.469 11.120 -19.566 1.00 0.00 C ATOM 774 C GLU A 52 17.986 11.234 -19.211 1.00 0.00 C ATOM 775 O GLU A 52 17.412 12.321 -19.322 1.00 0.00 O ATOM 776 CB GLU A 52 19.583 10.665 -21.034 1.00 0.00 C ATOM 777 CG GLU A 52 20.998 10.615 -21.613 1.00 0.00 C ATOM 778 CD GLU A 52 21.009 10.181 -23.096 1.00 0.00 C ATOM 779 OE1 GLU A 52 20.221 9.291 -23.508 1.00 0.00 O ATOM 780 OE2 GLU A 52 21.814 10.750 -23.871 1.00 0.00 O ATOM 0 H GLU A 52 20.556 9.427 -18.918 1.00 0.00 H new ATOM 0 HA GLU A 52 19.996 12.073 -19.522 1.00 0.00 H new ATOM 0 HB2 GLU A 52 19.141 9.673 -21.121 1.00 0.00 H new ATOM 0 HB3 GLU A 52 18.984 11.336 -21.649 1.00 0.00 H new ATOM 0 HG2 GLU A 52 21.461 11.597 -21.521 1.00 0.00 H new ATOM 0 HG3 GLU A 52 21.603 9.921 -21.029 1.00 0.00 H new ATOM 787 N VAL A 53 17.378 10.142 -18.725 1.00 0.00 N ATOM 788 CA VAL A 53 16.026 10.202 -18.153 1.00 0.00 C ATOM 789 C VAL A 53 16.017 10.563 -16.652 1.00 0.00 C ATOM 790 O VAL A 53 14.971 10.509 -16.004 1.00 0.00 O ATOM 791 CB VAL A 53 15.192 8.966 -18.537 1.00 0.00 C ATOM 792 CG1 VAL A 53 14.872 8.988 -20.038 1.00 0.00 C ATOM 793 CG2 VAL A 53 15.814 7.612 -18.177 1.00 0.00 C ATOM 0 H VAL A 53 17.798 9.213 -18.717 1.00 0.00 H new ATOM 0 HA VAL A 53 15.511 11.045 -18.614 1.00 0.00 H new ATOM 0 HB VAL A 53 14.288 9.047 -17.933 1.00 0.00 H new ATOM 0 HG11 VAL A 53 14.282 8.109 -20.297 1.00 0.00 H new ATOM 0 HG12 VAL A 53 14.306 9.888 -20.276 1.00 0.00 H new ATOM 0 HG13 VAL A 53 15.801 8.982 -20.608 1.00 0.00 H new ATOM 0 HG21 VAL A 53 15.146 6.810 -18.491 1.00 0.00 H new ATOM 0 HG22 VAL A 53 16.773 7.505 -18.685 1.00 0.00 H new ATOM 0 HG23 VAL A 53 15.966 7.557 -17.099 1.00 0.00 H new ATOM 803 N GLY A 54 17.160 10.980 -16.091 1.00 0.00 N ATOM 804 CA GLY A 54 17.293 11.412 -14.705 1.00 0.00 C ATOM 805 C GLY A 54 17.171 10.273 -13.688 1.00 0.00 C ATOM 806 O GLY A 54 16.950 10.534 -12.504 1.00 0.00 O ATOM 0 H GLY A 54 18.038 11.025 -16.608 1.00 0.00 H new ATOM 0 HA2 GLY A 54 18.260 11.899 -14.577 1.00 0.00 H new ATOM 0 HA3 GLY A 54 16.529 12.160 -14.492 1.00 0.00 H new ATOM 810 N ILE A 55 17.278 9.018 -14.130 1.00 0.00 N ATOM 811 CA ILE A 55 17.034 7.833 -13.315 1.00 0.00 C ATOM 812 C ILE A 55 18.322 7.338 -12.650 1.00 0.00 C ATOM 813 O ILE A 55 19.401 7.341 -13.245 1.00 0.00 O ATOM 814 CB ILE A 55 16.296 6.762 -14.139 1.00 0.00 C ATOM 815 CG1 ILE A 55 14.848 7.243 -14.390 1.00 0.00 C ATOM 816 CG2 ILE A 55 16.350 5.357 -13.509 1.00 0.00 C ATOM 817 CD1 ILE A 55 13.866 6.142 -14.789 1.00 0.00 C ATOM 0 H ILE A 55 17.544 8.796 -15.089 1.00 0.00 H new ATOM 0 HA ILE A 55 16.372 8.092 -12.489 1.00 0.00 H new ATOM 0 HB ILE A 55 16.811 6.646 -15.093 1.00 0.00 H new ATOM 0 HG12 ILE A 55 14.480 7.729 -13.486 1.00 0.00 H new ATOM 0 HG13 ILE A 55 14.862 7.999 -15.175 1.00 0.00 H new ATOM 0 HG21 ILE A 55 15.810 4.653 -14.142 1.00 0.00 H new ATOM 0 HG22 ILE A 55 17.389 5.039 -13.417 1.00 0.00 H new ATOM 0 HG23 ILE A 55 15.890 5.383 -12.521 1.00 0.00 H new ATOM 0 HD11 ILE A 55 12.878 6.575 -14.944 1.00 0.00 H new ATOM 0 HD12 ILE A 55 14.204 5.670 -15.712 1.00 0.00 H new ATOM 0 HD13 ILE A 55 13.815 5.395 -13.997 1.00 0.00 H new ATOM 829 N ASP A 56 18.160 6.850 -11.417 1.00 0.00 N ATOM 830 CA ASP A 56 19.159 6.120 -10.645 1.00 0.00 C ATOM 831 C ASP A 56 19.003 4.624 -10.924 1.00 0.00 C ATOM 832 O ASP A 56 17.878 4.122 -10.858 1.00 0.00 O ATOM 833 CB ASP A 56 18.925 6.390 -9.151 1.00 0.00 C ATOM 834 CG ASP A 56 19.601 5.329 -8.265 1.00 0.00 C ATOM 835 OD1 ASP A 56 20.836 5.413 -8.082 1.00 0.00 O ATOM 836 OD2 ASP A 56 18.891 4.421 -7.765 1.00 0.00 O ATOM 0 H ASP A 56 17.283 6.961 -10.908 1.00 0.00 H new ATOM 0 HA ASP A 56 20.162 6.442 -10.924 1.00 0.00 H new ATOM 0 HB2 ASP A 56 19.311 7.377 -8.895 1.00 0.00 H new ATOM 0 HB3 ASP A 56 17.854 6.404 -8.948 1.00 0.00 H new ATOM 841 N ILE A 57 20.098 3.919 -11.219 1.00 0.00 N ATOM 842 CA ILE A 57 20.156 2.445 -11.282 1.00 0.00 C ATOM 843 C ILE A 57 21.478 1.934 -10.678 1.00 0.00 C ATOM 844 O ILE A 57 21.552 0.799 -10.207 1.00 0.00 O ATOM 845 CB ILE A 57 19.946 1.888 -12.707 1.00 0.00 C ATOM 846 CG1 ILE A 57 20.829 2.587 -13.759 1.00 0.00 C ATOM 847 CG2 ILE A 57 18.468 1.912 -13.121 1.00 0.00 C ATOM 848 CD1 ILE A 57 21.073 1.707 -14.986 1.00 0.00 C ATOM 0 H ILE A 57 20.993 4.362 -11.427 1.00 0.00 H new ATOM 0 HA ILE A 57 19.323 2.072 -10.687 1.00 0.00 H new ATOM 0 HB ILE A 57 20.265 0.846 -12.670 1.00 0.00 H new ATOM 0 HG12 ILE A 57 20.353 3.517 -14.070 1.00 0.00 H new ATOM 0 HG13 ILE A 57 21.785 2.853 -13.309 1.00 0.00 H new ATOM 0 HG21 ILE A 57 18.366 1.512 -14.130 1.00 0.00 H new ATOM 0 HG22 ILE A 57 17.886 1.304 -12.429 1.00 0.00 H new ATOM 0 HG23 ILE A 57 18.101 2.938 -13.099 1.00 0.00 H new ATOM 0 HD11 ILE A 57 21.700 2.242 -15.699 1.00 0.00 H new ATOM 0 HD12 ILE A 57 21.574 0.788 -14.681 1.00 0.00 H new ATOM 0 HD13 ILE A 57 20.119 1.462 -15.454 1.00 0.00 H new ATOM 860 N SER A 58 22.521 2.764 -10.727 1.00 0.00 N ATOM 861 CA SER A 58 23.807 2.640 -10.052 1.00 0.00 C ATOM 862 C SER A 58 23.643 2.082 -8.625 1.00 0.00 C ATOM 863 O SER A 58 22.735 2.487 -7.895 1.00 0.00 O ATOM 864 CB SER A 58 24.426 4.054 -9.984 1.00 0.00 C ATOM 865 OG SER A 58 23.865 4.933 -10.959 1.00 0.00 O ATOM 0 H SER A 58 22.480 3.613 -11.290 1.00 0.00 H new ATOM 0 HA SER A 58 24.445 1.948 -10.602 1.00 0.00 H new ATOM 0 HB2 SER A 58 24.270 4.470 -8.989 1.00 0.00 H new ATOM 0 HB3 SER A 58 25.503 3.985 -10.135 1.00 0.00 H new ATOM 0 HG SER A 58 24.282 5.816 -10.881 1.00 0.00 H new ATOM 871 N GLY A 59 24.532 1.167 -8.216 1.00 0.00 N ATOM 872 CA GLY A 59 24.544 0.644 -6.849 1.00 0.00 C ATOM 873 C GLY A 59 23.256 -0.108 -6.493 1.00 0.00 C ATOM 874 O GLY A 59 22.794 -0.020 -5.356 1.00 0.00 O ATOM 0 H GLY A 59 25.255 0.774 -8.819 1.00 0.00 H new ATOM 0 HA2 GLY A 59 25.396 -0.025 -6.728 1.00 0.00 H new ATOM 0 HA3 GLY A 59 24.684 1.468 -6.150 1.00 0.00 H new ATOM 878 N GLN A 60 22.656 -0.812 -7.468 1.00 0.00 N ATOM 879 CA GLN A 60 21.376 -1.498 -7.305 1.00 0.00 C ATOM 880 C GLN A 60 21.388 -2.514 -6.159 1.00 0.00 C ATOM 881 O GLN A 60 20.366 -2.739 -5.508 1.00 0.00 O ATOM 882 CB GLN A 60 21.057 -2.261 -8.602 1.00 0.00 C ATOM 883 CG GLN A 60 19.560 -2.236 -8.892 1.00 0.00 C ATOM 884 CD GLN A 60 19.184 -3.222 -10.000 1.00 0.00 C ATOM 885 OE1 GLN A 60 18.928 -4.393 -9.742 1.00 0.00 O ATOM 886 NE2 GLN A 60 19.145 -2.775 -11.245 1.00 0.00 N ATOM 0 H GLN A 60 23.056 -0.918 -8.400 1.00 0.00 H new ATOM 0 HA GLN A 60 20.630 -0.737 -7.077 1.00 0.00 H new ATOM 0 HB2 GLN A 60 21.601 -1.815 -9.435 1.00 0.00 H new ATOM 0 HB3 GLN A 60 21.398 -3.293 -8.515 1.00 0.00 H new ATOM 0 HG2 GLN A 60 19.009 -2.481 -7.984 1.00 0.00 H new ATOM 0 HG3 GLN A 60 19.262 -1.229 -9.184 1.00 0.00 H new ATOM 0 HE21 GLN A 60 19.361 -1.798 -11.443 1.00 0.00 H new ATOM 0 HE22 GLN A 60 18.899 -3.408 -12.007 1.00 0.00 H new ATOM 895 N THR A 61 22.529 -3.174 -5.979 1.00 0.00 N ATOM 896 CA THR A 61 22.688 -4.320 -5.102 1.00 0.00 C ATOM 897 C THR A 61 22.565 -3.893 -3.629 1.00 0.00 C ATOM 898 O THR A 61 23.079 -2.835 -3.244 1.00 0.00 O ATOM 899 CB THR A 61 24.017 -5.029 -5.455 1.00 0.00 C ATOM 900 OG1 THR A 61 25.004 -4.113 -5.927 1.00 0.00 O ATOM 901 CG2 THR A 61 23.790 -6.039 -6.584 1.00 0.00 C ATOM 0 H THR A 61 23.392 -2.914 -6.456 1.00 0.00 H new ATOM 0 HA THR A 61 21.889 -5.046 -5.251 1.00 0.00 H new ATOM 0 HB THR A 61 24.361 -5.510 -4.539 1.00 0.00 H new ATOM 0 HG1 THR A 61 25.828 -4.600 -6.137 1.00 0.00 H new ATOM 0 HG21 THR A 61 24.731 -6.533 -6.825 1.00 0.00 H new ATOM 0 HG22 THR A 61 23.061 -6.784 -6.265 1.00 0.00 H new ATOM 0 HG23 THR A 61 23.416 -5.520 -7.467 1.00 0.00 H new ATOM 909 N SER A 62 21.885 -4.703 -2.811 1.00 0.00 N ATOM 910 CA SER A 62 21.513 -4.345 -1.443 1.00 0.00 C ATOM 911 C SER A 62 21.650 -5.555 -0.512 1.00 0.00 C ATOM 912 O SER A 62 22.544 -5.585 0.339 1.00 0.00 O ATOM 913 CB SER A 62 20.090 -3.758 -1.447 1.00 0.00 C ATOM 914 OG SER A 62 19.201 -4.556 -2.232 1.00 0.00 O ATOM 0 H SER A 62 21.575 -5.635 -3.085 1.00 0.00 H new ATOM 0 HA SER A 62 22.190 -3.583 -1.057 1.00 0.00 H new ATOM 0 HB2 SER A 62 19.718 -3.694 -0.424 1.00 0.00 H new ATOM 0 HB3 SER A 62 20.114 -2.742 -1.841 1.00 0.00 H new ATOM 0 HG SER A 62 18.305 -4.160 -2.215 1.00 0.00 H new ATOM 920 N ASP A 63 20.801 -6.568 -0.696 1.00 0.00 N ATOM 921 CA ASP A 63 20.729 -7.775 0.126 1.00 0.00 C ATOM 922 C ASP A 63 20.315 -8.948 -0.758 1.00 0.00 C ATOM 923 O ASP A 63 19.667 -8.730 -1.791 1.00 0.00 O ATOM 924 CB ASP A 63 19.700 -7.612 1.260 1.00 0.00 C ATOM 925 CG ASP A 63 20.324 -7.016 2.531 1.00 0.00 C ATOM 926 OD1 ASP A 63 21.105 -7.723 3.213 1.00 0.00 O ATOM 927 OD2 ASP A 63 20.017 -5.847 2.874 1.00 0.00 O ATOM 0 H ASP A 63 20.117 -6.569 -1.453 1.00 0.00 H new ATOM 0 HA ASP A 63 21.708 -7.954 0.571 1.00 0.00 H new ATOM 0 HB2 ASP A 63 18.887 -6.969 0.921 1.00 0.00 H new ATOM 0 HB3 ASP A 63 19.263 -8.583 1.493 1.00 0.00 H new ATOM 932 N PRO A 64 20.643 -10.196 -0.380 1.00 0.00 N ATOM 933 CA PRO A 64 20.126 -11.370 -1.066 1.00 0.00 C ATOM 934 C PRO A 64 18.611 -11.463 -0.856 1.00 0.00 C ATOM 935 O PRO A 64 18.091 -11.056 0.183 1.00 0.00 O ATOM 936 CB PRO A 64 20.872 -12.560 -0.453 1.00 0.00 C ATOM 937 CG PRO A 64 21.171 -12.090 0.973 1.00 0.00 C ATOM 938 CD PRO A 64 21.418 -10.592 0.792 1.00 0.00 C ATOM 0 HA PRO A 64 20.283 -11.338 -2.144 1.00 0.00 H new ATOM 0 HB2 PRO A 64 20.263 -13.464 -0.459 1.00 0.00 H new ATOM 0 HB3 PRO A 64 21.786 -12.788 -1.002 1.00 0.00 H new ATOM 0 HG2 PRO A 64 20.336 -12.284 1.646 1.00 0.00 H new ATOM 0 HG3 PRO A 64 22.041 -12.596 1.391 1.00 0.00 H new ATOM 0 HD2 PRO A 64 21.103 -10.035 1.675 1.00 0.00 H new ATOM 0 HD3 PRO A 64 22.478 -10.386 0.647 1.00 0.00 H new ATOM 946 N ILE A 65 17.898 -12.079 -1.799 1.00 0.00 N ATOM 947 CA ILE A 65 16.439 -12.203 -1.765 1.00 0.00 C ATOM 948 C ILE A 65 15.988 -13.020 -0.541 1.00 0.00 C ATOM 949 O ILE A 65 14.879 -12.856 -0.041 1.00 0.00 O ATOM 950 CB ILE A 65 15.967 -12.791 -3.119 1.00 0.00 C ATOM 951 CG1 ILE A 65 14.620 -12.175 -3.535 1.00 0.00 C ATOM 952 CG2 ILE A 65 15.970 -14.331 -3.161 1.00 0.00 C ATOM 953 CD1 ILE A 65 14.139 -12.606 -4.928 1.00 0.00 C ATOM 0 H ILE A 65 18.322 -12.512 -2.619 1.00 0.00 H new ATOM 0 HA ILE A 65 15.968 -11.227 -1.645 1.00 0.00 H new ATOM 0 HB ILE A 65 16.706 -12.505 -3.867 1.00 0.00 H new ATOM 0 HG12 ILE A 65 13.864 -12.450 -2.800 1.00 0.00 H new ATOM 0 HG13 ILE A 65 14.706 -11.089 -3.512 1.00 0.00 H new ATOM 0 HG21 ILE A 65 15.628 -14.669 -4.139 1.00 0.00 H new ATOM 0 HG22 ILE A 65 16.981 -14.698 -2.983 1.00 0.00 H new ATOM 0 HG23 ILE A 65 15.303 -14.717 -2.390 1.00 0.00 H new ATOM 0 HD11 ILE A 65 13.184 -12.129 -5.147 1.00 0.00 H new ATOM 0 HD12 ILE A 65 14.874 -12.306 -5.675 1.00 0.00 H new ATOM 0 HD13 ILE A 65 14.018 -13.689 -4.952 1.00 0.00 H new ATOM 965 N GLU A 66 16.883 -13.861 -0.017 1.00 0.00 N ATOM 966 CA GLU A 66 16.682 -14.733 1.108 1.00 0.00 C ATOM 967 C GLU A 66 16.516 -13.917 2.406 1.00 0.00 C ATOM 968 O GLU A 66 15.900 -14.383 3.367 1.00 0.00 O ATOM 969 CB GLU A 66 17.946 -15.610 1.104 1.00 0.00 C ATOM 970 CG GLU A 66 18.143 -16.368 2.401 1.00 0.00 C ATOM 971 CD GLU A 66 19.287 -17.394 2.312 1.00 0.00 C ATOM 972 OE1 GLU A 66 20.462 -17.025 2.559 1.00 0.00 O ATOM 973 OE2 GLU A 66 19.021 -18.585 2.013 1.00 0.00 O ATOM 0 H GLU A 66 17.823 -13.945 -0.403 1.00 0.00 H new ATOM 0 HA GLU A 66 15.775 -15.334 1.048 1.00 0.00 H new ATOM 0 HB2 GLU A 66 17.886 -16.320 0.280 1.00 0.00 H new ATOM 0 HB3 GLU A 66 18.817 -14.981 0.921 1.00 0.00 H new ATOM 0 HG2 GLU A 66 18.354 -15.661 3.204 1.00 0.00 H new ATOM 0 HG3 GLU A 66 17.218 -16.881 2.663 1.00 0.00 H new ATOM 980 N ASN A 67 17.068 -12.697 2.432 1.00 0.00 N ATOM 981 CA ASN A 67 16.948 -11.756 3.544 1.00 0.00 C ATOM 982 C ASN A 67 15.492 -11.318 3.777 1.00 0.00 C ATOM 983 O ASN A 67 15.139 -10.902 4.884 1.00 0.00 O ATOM 984 CB ASN A 67 17.810 -10.518 3.259 1.00 0.00 C ATOM 985 CG ASN A 67 18.047 -9.698 4.522 1.00 0.00 C ATOM 986 OD1 ASN A 67 17.355 -8.723 4.800 1.00 0.00 O ATOM 987 ND2 ASN A 67 19.044 -10.081 5.308 1.00 0.00 N ATOM 0 H ASN A 67 17.624 -12.332 1.659 1.00 0.00 H new ATOM 0 HA ASN A 67 17.292 -12.263 4.445 1.00 0.00 H new ATOM 0 HB2 ASN A 67 18.767 -10.829 2.841 1.00 0.00 H new ATOM 0 HB3 ASN A 67 17.321 -9.898 2.508 1.00 0.00 H new ATOM 0 HD21 ASN A 67 19.248 -9.562 6.162 1.00 0.00 H new ATOM 0 HD22 ASN A 67 19.607 -10.894 5.058 1.00 0.00 H new ATOM 994 N PHE A 68 14.654 -11.411 2.741 1.00 0.00 N ATOM 995 CA PHE A 68 13.259 -10.987 2.711 1.00 0.00 C ATOM 996 C PHE A 68 12.354 -12.221 2.752 1.00 0.00 C ATOM 997 O PHE A 68 12.806 -13.344 3.001 1.00 0.00 O ATOM 998 CB PHE A 68 13.004 -10.175 1.426 1.00 0.00 C ATOM 999 CG PHE A 68 13.964 -9.032 1.198 1.00 0.00 C ATOM 1000 CD1 PHE A 68 15.210 -9.290 0.605 1.00 0.00 C ATOM 1001 CD2 PHE A 68 13.630 -7.728 1.597 1.00 0.00 C ATOM 1002 CE1 PHE A 68 16.138 -8.251 0.434 1.00 0.00 C ATOM 1003 CE2 PHE A 68 14.547 -6.680 1.400 1.00 0.00 C ATOM 1004 CZ PHE A 68 15.803 -6.941 0.823 1.00 0.00 C ATOM 0 H PHE A 68 14.953 -11.808 1.850 1.00 0.00 H new ATOM 0 HA PHE A 68 13.039 -10.360 3.575 1.00 0.00 H new ATOM 0 HB2 PHE A 68 13.054 -10.849 0.571 1.00 0.00 H new ATOM 0 HB3 PHE A 68 11.990 -9.778 1.459 1.00 0.00 H new ATOM 0 HD1 PHE A 68 15.455 -10.290 0.280 1.00 0.00 H new ATOM 0 HD2 PHE A 68 12.672 -7.530 2.054 1.00 0.00 H new ATOM 0 HE1 PHE A 68 17.107 -8.457 0.005 1.00 0.00 H new ATOM 0 HE2 PHE A 68 14.286 -5.673 1.692 1.00 0.00 H new ATOM 0 HZ PHE A 68 16.509 -6.137 0.679 1.00 0.00 H new ATOM 1014 N ASN A 69 11.061 -12.018 2.491 1.00 0.00 N ATOM 1015 CA ASN A 69 10.105 -13.080 2.265 1.00 0.00 C ATOM 1016 C ASN A 69 9.210 -12.630 1.131 1.00 0.00 C ATOM 1017 O ASN A 69 8.810 -11.462 1.112 1.00 0.00 O ATOM 1018 CB ASN A 69 9.257 -13.330 3.516 1.00 0.00 C ATOM 1019 CG ASN A 69 8.378 -14.580 3.466 1.00 0.00 C ATOM 1020 OD1 ASN A 69 8.043 -15.095 2.404 1.00 0.00 O ATOM 1021 ND2 ASN A 69 7.943 -15.073 4.614 1.00 0.00 N ATOM 0 H ASN A 69 10.650 -11.086 2.432 1.00 0.00 H new ATOM 0 HA ASN A 69 10.623 -14.009 2.026 1.00 0.00 H new ATOM 0 HB2 ASN A 69 9.921 -13.406 4.377 1.00 0.00 H new ATOM 0 HB3 ASN A 69 8.618 -12.462 3.682 1.00 0.00 H new ATOM 0 HD21 ASN A 69 7.326 -15.885 4.619 1.00 0.00 H new ATOM 0 HD22 ASN A 69 8.225 -14.641 5.494 1.00 0.00 H new ATOM 1028 N ALA A 70 8.849 -13.523 0.214 1.00 0.00 N ATOM 1029 CA ALA A 70 8.022 -13.119 -0.886 1.00 0.00 C ATOM 1030 C ALA A 70 6.615 -12.847 -0.389 1.00 0.00 C ATOM 1031 O ALA A 70 5.905 -12.057 -1.004 1.00 0.00 O ATOM 1032 CB ALA A 70 8.006 -14.185 -1.972 1.00 0.00 C ATOM 0 H ALA A 70 9.116 -14.507 0.220 1.00 0.00 H new ATOM 0 HA ALA A 70 8.433 -12.207 -1.319 1.00 0.00 H new ATOM 0 HB1 ALA A 70 7.372 -13.856 -2.796 1.00 0.00 H new ATOM 0 HB2 ALA A 70 9.020 -14.348 -2.337 1.00 0.00 H new ATOM 0 HB3 ALA A 70 7.614 -15.116 -1.562 1.00 0.00 H new ATOM 1038 N ASP A 71 6.226 -13.476 0.727 1.00 0.00 N ATOM 1039 CA ASP A 71 4.905 -13.299 1.286 1.00 0.00 C ATOM 1040 C ASP A 71 4.671 -11.859 1.766 1.00 0.00 C ATOM 1041 O ASP A 71 3.529 -11.397 1.814 1.00 0.00 O ATOM 1042 CB ASP A 71 4.674 -14.288 2.431 1.00 0.00 C ATOM 1043 CG ASP A 71 3.248 -14.161 2.997 1.00 0.00 C ATOM 1044 OD1 ASP A 71 2.285 -14.566 2.302 1.00 0.00 O ATOM 1045 OD2 ASP A 71 3.088 -13.700 4.155 1.00 0.00 O ATOM 0 H ASP A 71 6.822 -14.114 1.255 1.00 0.00 H new ATOM 0 HA ASP A 71 4.185 -13.498 0.492 1.00 0.00 H new ATOM 0 HB2 ASP A 71 4.838 -15.305 2.075 1.00 0.00 H new ATOM 0 HB3 ASP A 71 5.400 -14.107 3.223 1.00 0.00 H new ATOM 1050 N ASP A 72 5.747 -11.132 2.098 1.00 0.00 N ATOM 1051 CA ASP A 72 5.682 -9.721 2.455 1.00 0.00 C ATOM 1052 C ASP A 72 5.543 -8.834 1.211 1.00 0.00 C ATOM 1053 O ASP A 72 4.961 -7.746 1.266 1.00 0.00 O ATOM 1054 CB ASP A 72 6.935 -9.315 3.228 1.00 0.00 C ATOM 1055 CG ASP A 72 6.800 -7.880 3.767 1.00 0.00 C ATOM 1056 OD1 ASP A 72 5.964 -7.650 4.674 1.00 0.00 O ATOM 1057 OD2 ASP A 72 7.556 -6.981 3.326 1.00 0.00 O ATOM 0 H ASP A 72 6.691 -11.516 2.124 1.00 0.00 H new ATOM 0 HA ASP A 72 4.801 -9.579 3.081 1.00 0.00 H new ATOM 0 HB2 ASP A 72 7.098 -10.006 4.055 1.00 0.00 H new ATOM 0 HB3 ASP A 72 7.808 -9.384 2.578 1.00 0.00 H new ATOM 1062 N TYR A 73 6.082 -9.311 0.086 1.00 0.00 N ATOM 1063 CA TYR A 73 6.050 -8.657 -1.209 1.00 0.00 C ATOM 1064 C TYR A 73 4.694 -8.859 -1.897 1.00 0.00 C ATOM 1065 O TYR A 73 3.875 -9.681 -1.480 1.00 0.00 O ATOM 1066 CB TYR A 73 7.260 -9.095 -2.064 1.00 0.00 C ATOM 1067 CG TYR A 73 8.499 -8.276 -1.745 1.00 0.00 C ATOM 1068 CD1 TYR A 73 9.098 -8.389 -0.478 1.00 0.00 C ATOM 1069 CD2 TYR A 73 8.969 -7.307 -2.654 1.00 0.00 C ATOM 1070 CE1 TYR A 73 10.087 -7.480 -0.078 1.00 0.00 C ATOM 1071 CE2 TYR A 73 9.970 -6.393 -2.262 1.00 0.00 C ATOM 1072 CZ TYR A 73 10.497 -6.451 -0.949 1.00 0.00 C ATOM 1073 OH TYR A 73 11.358 -5.510 -0.479 1.00 0.00 O ATOM 0 H TYR A 73 6.573 -10.205 0.060 1.00 0.00 H new ATOM 0 HA TYR A 73 6.148 -7.580 -1.073 1.00 0.00 H new ATOM 0 HB2 TYR A 73 7.467 -10.151 -1.889 1.00 0.00 H new ATOM 0 HB3 TYR A 73 7.016 -8.989 -3.121 1.00 0.00 H new ATOM 0 HD1 TYR A 73 8.794 -9.181 0.191 1.00 0.00 H new ATOM 0 HD2 TYR A 73 8.562 -7.264 -3.653 1.00 0.00 H new ATOM 0 HE1 TYR A 73 10.536 -7.568 0.900 1.00 0.00 H new ATOM 0 HE2 TYR A 73 10.332 -5.653 -2.960 1.00 0.00 H new ATOM 0 HH TYR A 73 11.932 -5.906 0.210 1.00 0.00 H new ATOM 1083 N ASP A 74 4.444 -8.071 -2.952 1.00 0.00 N ATOM 1084 CA ASP A 74 3.197 -8.136 -3.720 1.00 0.00 C ATOM 1085 C ASP A 74 3.456 -8.523 -5.172 1.00 0.00 C ATOM 1086 O ASP A 74 2.659 -9.256 -5.762 1.00 0.00 O ATOM 1087 CB ASP A 74 2.467 -6.799 -3.653 1.00 0.00 C ATOM 1088 CG ASP A 74 1.128 -6.882 -4.408 1.00 0.00 C ATOM 1089 OD1 ASP A 74 0.139 -7.368 -3.808 1.00 0.00 O ATOM 1090 OD2 ASP A 74 1.055 -6.423 -5.571 1.00 0.00 O ATOM 0 H ASP A 74 5.102 -7.371 -3.295 1.00 0.00 H new ATOM 0 HA ASP A 74 2.570 -8.909 -3.275 1.00 0.00 H new ATOM 0 HB2 ASP A 74 2.289 -6.526 -2.613 1.00 0.00 H new ATOM 0 HB3 ASP A 74 3.089 -6.016 -4.087 1.00 0.00 H new ATOM 1095 N VAL A 75 4.584 -8.088 -5.746 1.00 0.00 N ATOM 1096 CA VAL A 75 4.855 -8.252 -7.158 1.00 0.00 C ATOM 1097 C VAL A 75 6.336 -8.538 -7.381 1.00 0.00 C ATOM 1098 O VAL A 75 7.216 -7.886 -6.818 1.00 0.00 O ATOM 1099 CB VAL A 75 4.341 -7.013 -7.934 1.00 0.00 C ATOM 1100 CG1 VAL A 75 4.393 -5.663 -7.191 1.00 0.00 C ATOM 1101 CG2 VAL A 75 5.002 -6.880 -9.315 1.00 0.00 C ATOM 0 H VAL A 75 5.328 -7.613 -5.234 1.00 0.00 H new ATOM 0 HA VAL A 75 4.317 -9.115 -7.549 1.00 0.00 H new ATOM 0 HB VAL A 75 3.279 -7.230 -8.046 1.00 0.00 H new ATOM 0 HG11 VAL A 75 4.007 -4.876 -7.839 1.00 0.00 H new ATOM 0 HG12 VAL A 75 3.785 -5.721 -6.288 1.00 0.00 H new ATOM 0 HG13 VAL A 75 5.424 -5.436 -6.920 1.00 0.00 H new ATOM 0 HG21 VAL A 75 4.611 -5.998 -9.822 1.00 0.00 H new ATOM 0 HG22 VAL A 75 6.081 -6.781 -9.194 1.00 0.00 H new ATOM 0 HG23 VAL A 75 4.784 -7.767 -9.910 1.00 0.00 H new ATOM 1111 N VAL A 76 6.624 -9.505 -8.247 1.00 0.00 N ATOM 1112 CA VAL A 76 7.976 -9.922 -8.551 1.00 0.00 C ATOM 1113 C VAL A 76 7.991 -10.273 -10.038 1.00 0.00 C ATOM 1114 O VAL A 76 7.173 -11.068 -10.507 1.00 0.00 O ATOM 1115 CB VAL A 76 8.320 -11.125 -7.656 1.00 0.00 C ATOM 1116 CG1 VAL A 76 9.711 -11.692 -7.974 1.00 0.00 C ATOM 1117 CG2 VAL A 76 8.245 -10.832 -6.137 1.00 0.00 C ATOM 0 H VAL A 76 5.911 -10.023 -8.760 1.00 0.00 H new ATOM 0 HA VAL A 76 8.722 -9.151 -8.358 1.00 0.00 H new ATOM 0 HB VAL A 76 7.548 -11.858 -7.890 1.00 0.00 H new ATOM 0 HG11 VAL A 76 9.916 -12.540 -7.321 1.00 0.00 H new ATOM 0 HG12 VAL A 76 9.742 -12.019 -9.013 1.00 0.00 H new ATOM 0 HG13 VAL A 76 10.464 -10.920 -7.814 1.00 0.00 H new ATOM 0 HG21 VAL A 76 8.502 -11.733 -5.580 1.00 0.00 H new ATOM 0 HG22 VAL A 76 8.946 -10.037 -5.885 1.00 0.00 H new ATOM 0 HG23 VAL A 76 7.234 -10.520 -5.876 1.00 0.00 H new ATOM 1127 N ILE A 77 8.913 -9.668 -10.780 1.00 0.00 N ATOM 1128 CA ILE A 77 9.132 -9.934 -12.187 1.00 0.00 C ATOM 1129 C ILE A 77 10.400 -10.771 -12.259 1.00 0.00 C ATOM 1130 O ILE A 77 11.452 -10.326 -11.783 1.00 0.00 O ATOM 1131 CB ILE A 77 9.300 -8.622 -12.979 1.00 0.00 C ATOM 1132 CG1 ILE A 77 8.316 -7.488 -12.602 1.00 0.00 C ATOM 1133 CG2 ILE A 77 9.269 -8.900 -14.488 1.00 0.00 C ATOM 1134 CD1 ILE A 77 6.822 -7.796 -12.710 1.00 0.00 C ATOM 0 H ILE A 77 9.543 -8.960 -10.403 1.00 0.00 H new ATOM 0 HA ILE A 77 8.282 -10.454 -12.628 1.00 0.00 H new ATOM 0 HB ILE A 77 10.279 -8.239 -12.690 1.00 0.00 H new ATOM 0 HG12 ILE A 77 8.526 -7.186 -11.576 1.00 0.00 H new ATOM 0 HG13 ILE A 77 8.531 -6.629 -13.237 1.00 0.00 H new ATOM 0 HG21 ILE A 77 9.389 -7.964 -15.033 1.00 0.00 H new ATOM 0 HG22 ILE A 77 10.081 -9.579 -14.750 1.00 0.00 H new ATOM 0 HG23 ILE A 77 8.315 -9.355 -14.755 1.00 0.00 H new ATOM 0 HD11 ILE A 77 6.247 -6.917 -12.417 1.00 0.00 H new ATOM 0 HD12 ILE A 77 6.579 -8.062 -13.739 1.00 0.00 H new ATOM 0 HD13 ILE A 77 6.573 -8.628 -12.051 1.00 0.00 H new ATOM 1146 N SER A 78 10.322 -11.942 -12.881 1.00 0.00 N ATOM 1147 CA SER A 78 11.497 -12.715 -13.203 1.00 0.00 C ATOM 1148 C SER A 78 11.860 -12.309 -14.618 1.00 0.00 C ATOM 1149 O SER A 78 11.260 -12.797 -15.564 1.00 0.00 O ATOM 1150 CB SER A 78 11.202 -14.210 -13.129 1.00 0.00 C ATOM 1151 OG SER A 78 11.059 -14.605 -11.777 1.00 0.00 O ATOM 0 H SER A 78 9.444 -12.373 -13.171 1.00 0.00 H new ATOM 0 HA SER A 78 12.311 -12.528 -12.502 1.00 0.00 H new ATOM 0 HB2 SER A 78 10.291 -14.438 -13.682 1.00 0.00 H new ATOM 0 HB3 SER A 78 12.009 -14.773 -13.598 1.00 0.00 H new ATOM 0 HG SER A 78 11.343 -15.537 -11.677 1.00 0.00 H new ATOM 1157 N LEU A 79 12.816 -11.395 -14.795 1.00 0.00 N ATOM 1158 CA LEU A 79 13.169 -10.903 -16.131 1.00 0.00 C ATOM 1159 C LEU A 79 13.847 -11.980 -16.987 1.00 0.00 C ATOM 1160 O LEU A 79 14.169 -11.719 -18.146 1.00 0.00 O ATOM 1161 CB LEU A 79 14.021 -9.628 -16.040 1.00 0.00 C ATOM 1162 CG LEU A 79 13.224 -8.412 -15.556 1.00 0.00 C ATOM 1163 CD1 LEU A 79 14.187 -7.250 -15.335 1.00 0.00 C ATOM 1164 CD2 LEU A 79 12.148 -7.976 -16.554 1.00 0.00 C ATOM 0 H LEU A 79 13.358 -10.982 -14.036 1.00 0.00 H new ATOM 0 HA LEU A 79 12.239 -10.647 -16.638 1.00 0.00 H new ATOM 0 HB2 LEU A 79 14.856 -9.803 -15.361 1.00 0.00 H new ATOM 0 HB3 LEU A 79 14.447 -9.411 -17.020 1.00 0.00 H new ATOM 0 HG LEU A 79 12.720 -8.696 -14.632 1.00 0.00 H new ATOM 0 HD11 LEU A 79 13.632 -6.378 -14.990 1.00 0.00 H new ATOM 0 HD12 LEU A 79 14.927 -7.529 -14.585 1.00 0.00 H new ATOM 0 HD13 LEU A 79 14.691 -7.012 -16.272 1.00 0.00 H new ATOM 0 HD21 LEU A 79 11.615 -7.111 -16.159 1.00 0.00 H new ATOM 0 HD22 LEU A 79 12.617 -7.712 -17.502 1.00 0.00 H new ATOM 0 HD23 LEU A 79 11.445 -8.794 -16.712 1.00 0.00 H new ATOM 1176 N CYS A 80 14.085 -13.166 -16.426 1.00 0.00 N ATOM 1177 CA CYS A 80 14.509 -14.344 -17.143 1.00 0.00 C ATOM 1178 C CYS A 80 13.722 -15.510 -16.547 1.00 0.00 C ATOM 1179 O CYS A 80 13.759 -15.680 -15.325 1.00 0.00 O ATOM 1180 CB CYS A 80 16.026 -14.534 -16.971 1.00 0.00 C ATOM 1181 SG CYS A 80 17.031 -13.122 -17.514 1.00 0.00 S ATOM 0 H CYS A 80 13.981 -13.327 -15.424 1.00 0.00 H new ATOM 0 HA CYS A 80 14.319 -14.269 -18.214 1.00 0.00 H new ATOM 0 HB2 CYS A 80 16.237 -14.731 -15.920 1.00 0.00 H new ATOM 0 HB3 CYS A 80 16.334 -15.418 -17.529 1.00 0.00 H new ATOM 1186 N GLY A 81 13.064 -16.308 -17.394 1.00 0.00 N ATOM 1187 CA GLY A 81 12.375 -17.542 -17.027 1.00 0.00 C ATOM 1188 C GLY A 81 11.413 -17.377 -15.846 1.00 0.00 C ATOM 1189 O GLY A 81 10.753 -16.343 -15.705 1.00 0.00 O ATOM 0 H GLY A 81 12.996 -16.101 -18.391 1.00 0.00 H new ATOM 0 HA2 GLY A 81 11.819 -17.909 -17.890 1.00 0.00 H new ATOM 0 HA3 GLY A 81 13.116 -18.302 -16.779 1.00 0.00 H new ATOM 1193 N SER A 82 11.330 -18.420 -15.013 1.00 0.00 N ATOM 1194 CA SER A 82 10.494 -18.462 -13.814 1.00 0.00 C ATOM 1195 C SER A 82 11.421 -18.487 -12.590 1.00 0.00 C ATOM 1196 O SER A 82 12.127 -17.507 -12.347 1.00 0.00 O ATOM 1197 CB SER A 82 9.477 -19.617 -13.929 1.00 0.00 C ATOM 1198 OG SER A 82 8.760 -19.537 -15.156 1.00 0.00 O ATOM 0 H SER A 82 11.858 -19.280 -15.160 1.00 0.00 H new ATOM 0 HA SER A 82 9.872 -17.575 -13.697 1.00 0.00 H new ATOM 0 HB2 SER A 82 9.997 -20.573 -13.868 1.00 0.00 H new ATOM 0 HB3 SER A 82 8.780 -19.579 -13.092 1.00 0.00 H new ATOM 0 HG SER A 82 8.170 -18.755 -15.140 1.00 0.00 H new ATOM 1204 N GLY A 83 11.488 -19.593 -11.838 1.00 0.00 N ATOM 1205 CA GLY A 83 12.466 -19.792 -10.772 1.00 0.00 C ATOM 1206 C GLY A 83 13.800 -20.230 -11.373 1.00 0.00 C ATOM 1207 O GLY A 83 14.183 -21.390 -11.227 1.00 0.00 O ATOM 0 H GLY A 83 10.854 -20.383 -11.958 1.00 0.00 H new ATOM 0 HA2 GLY A 83 12.596 -18.869 -10.208 1.00 0.00 H new ATOM 0 HA3 GLY A 83 12.107 -20.546 -10.072 1.00 0.00 H new ATOM 1211 N VAL A 84 14.485 -19.325 -12.087 1.00 0.00 N ATOM 1212 CA VAL A 84 15.688 -19.653 -12.867 1.00 0.00 C ATOM 1213 C VAL A 84 16.809 -20.218 -11.974 1.00 0.00 C ATOM 1214 O VAL A 84 17.357 -21.286 -12.252 1.00 0.00 O ATOM 1215 CB VAL A 84 16.140 -18.443 -13.721 1.00 0.00 C ATOM 1216 CG1 VAL A 84 15.329 -18.394 -15.023 1.00 0.00 C ATOM 1217 CG2 VAL A 84 16.028 -17.068 -13.035 1.00 0.00 C ATOM 0 H VAL A 84 14.220 -18.342 -12.140 1.00 0.00 H new ATOM 0 HA VAL A 84 15.436 -20.451 -13.566 1.00 0.00 H new ATOM 0 HB VAL A 84 17.202 -18.613 -13.897 1.00 0.00 H new ATOM 0 HG11 VAL A 84 15.651 -17.541 -15.620 1.00 0.00 H new ATOM 0 HG12 VAL A 84 15.490 -19.313 -15.587 1.00 0.00 H new ATOM 0 HG13 VAL A 84 14.269 -18.293 -14.788 1.00 0.00 H new ATOM 0 HG21 VAL A 84 16.370 -16.291 -13.719 1.00 0.00 H new ATOM 0 HG22 VAL A 84 14.989 -16.881 -12.763 1.00 0.00 H new ATOM 0 HG23 VAL A 84 16.646 -17.058 -12.137 1.00 0.00 H new ATOM 1227 N ASN A 85 17.116 -19.514 -10.884 1.00 0.00 N ATOM 1228 CA ASN A 85 17.979 -19.951 -9.781 1.00 0.00 C ATOM 1229 C ASN A 85 17.492 -19.128 -8.587 1.00 0.00 C ATOM 1230 O ASN A 85 18.237 -18.351 -7.993 1.00 0.00 O ATOM 1231 CB ASN A 85 19.469 -19.723 -10.113 1.00 0.00 C ATOM 1232 CG ASN A 85 20.393 -20.433 -9.121 1.00 0.00 C ATOM 1233 OD1 ASN A 85 20.942 -21.489 -9.424 1.00 0.00 O ATOM 1234 ND2 ASN A 85 20.586 -19.893 -7.927 1.00 0.00 N ATOM 0 H ASN A 85 16.751 -18.573 -10.737 1.00 0.00 H new ATOM 0 HA ASN A 85 17.915 -21.020 -9.578 1.00 0.00 H new ATOM 0 HB2 ASN A 85 19.675 -20.083 -11.121 1.00 0.00 H new ATOM 0 HB3 ASN A 85 19.682 -18.654 -10.106 1.00 0.00 H new ATOM 0 HD21 ASN A 85 21.195 -20.354 -7.251 1.00 0.00 H new ATOM 0 HD22 ASN A 85 20.126 -19.016 -7.684 1.00 0.00 H new ATOM 1241 N LEU A 86 16.180 -19.186 -8.350 1.00 0.00 N ATOM 1242 CA LEU A 86 15.442 -18.319 -7.437 1.00 0.00 C ATOM 1243 C LEU A 86 14.285 -19.129 -6.832 1.00 0.00 C ATOM 1244 O LEU A 86 13.675 -19.897 -7.579 1.00 0.00 O ATOM 1245 CB LEU A 86 14.990 -17.104 -8.278 1.00 0.00 C ATOM 1246 CG LEU A 86 13.833 -16.255 -7.721 1.00 0.00 C ATOM 1247 CD1 LEU A 86 14.014 -14.775 -8.084 1.00 0.00 C ATOM 1248 CD2 LEU A 86 12.508 -16.700 -8.358 1.00 0.00 C ATOM 0 H LEU A 86 15.579 -19.869 -8.811 1.00 0.00 H new ATOM 0 HA LEU A 86 16.029 -17.955 -6.594 1.00 0.00 H new ATOM 0 HB2 LEU A 86 15.851 -16.451 -8.418 1.00 0.00 H new ATOM 0 HB3 LEU A 86 14.700 -17.465 -9.265 1.00 0.00 H new ATOM 0 HG LEU A 86 13.826 -16.387 -6.639 1.00 0.00 H new ATOM 0 HD11 LEU A 86 13.184 -14.197 -7.679 1.00 0.00 H new ATOM 0 HD12 LEU A 86 14.950 -14.409 -7.663 1.00 0.00 H new ATOM 0 HD13 LEU A 86 14.037 -14.666 -9.168 1.00 0.00 H new ATOM 0 HD21 LEU A 86 11.692 -16.096 -7.960 1.00 0.00 H new ATOM 0 HD22 LEU A 86 12.562 -16.570 -9.439 1.00 0.00 H new ATOM 0 HD23 LEU A 86 12.328 -17.750 -8.127 1.00 0.00 H new ATOM 1260 N PRO A 87 13.971 -18.992 -5.525 1.00 0.00 N ATOM 1261 CA PRO A 87 12.954 -19.831 -4.896 1.00 0.00 C ATOM 1262 C PRO A 87 11.548 -19.571 -5.454 1.00 0.00 C ATOM 1263 O PRO A 87 11.214 -18.421 -5.731 1.00 0.00 O ATOM 1264 CB PRO A 87 13.048 -19.580 -3.385 1.00 0.00 C ATOM 1265 CG PRO A 87 14.460 -19.028 -3.195 1.00 0.00 C ATOM 1266 CD PRO A 87 14.716 -18.270 -4.497 1.00 0.00 C ATOM 0 HA PRO A 87 13.138 -20.882 -5.117 1.00 0.00 H new ATOM 0 HB2 PRO A 87 12.292 -18.870 -3.050 1.00 0.00 H new ATOM 0 HB3 PRO A 87 12.897 -20.498 -2.817 1.00 0.00 H new ATOM 0 HG2 PRO A 87 14.522 -18.371 -2.328 1.00 0.00 H new ATOM 0 HG3 PRO A 87 15.187 -19.826 -3.044 1.00 0.00 H new ATOM 0 HD2 PRO A 87 14.379 -17.236 -4.422 1.00 0.00 H new ATOM 0 HD3 PRO A 87 15.780 -18.242 -4.731 1.00 0.00 H new ATOM 1274 N PRO A 88 10.686 -20.594 -5.587 1.00 0.00 N ATOM 1275 CA PRO A 88 9.421 -20.461 -6.306 1.00 0.00 C ATOM 1276 C PRO A 88 8.433 -19.519 -5.619 1.00 0.00 C ATOM 1277 O PRO A 88 7.639 -18.884 -6.309 1.00 0.00 O ATOM 1278 CB PRO A 88 8.878 -21.886 -6.440 1.00 0.00 C ATOM 1279 CG PRO A 88 9.518 -22.631 -5.267 1.00 0.00 C ATOM 1280 CD PRO A 88 10.890 -21.970 -5.159 1.00 0.00 C ATOM 0 HA PRO A 88 9.576 -19.998 -7.281 1.00 0.00 H new ATOM 0 HB2 PRO A 88 7.790 -21.907 -6.381 1.00 0.00 H new ATOM 0 HB3 PRO A 88 9.154 -22.331 -7.396 1.00 0.00 H new ATOM 0 HG2 PRO A 88 8.940 -22.516 -4.350 1.00 0.00 H new ATOM 0 HG3 PRO A 88 9.598 -23.701 -5.462 1.00 0.00 H new ATOM 0 HD2 PRO A 88 11.268 -22.013 -4.138 1.00 0.00 H new ATOM 0 HD3 PRO A 88 11.621 -22.475 -5.791 1.00 0.00 H new ATOM 1288 N GLU A 89 8.521 -19.343 -4.297 1.00 0.00 N ATOM 1289 CA GLU A 89 7.643 -18.437 -3.555 1.00 0.00 C ATOM 1290 C GLU A 89 7.693 -17.005 -4.112 1.00 0.00 C ATOM 1291 O GLU A 89 6.748 -16.233 -3.939 1.00 0.00 O ATOM 1292 CB GLU A 89 8.008 -18.489 -2.061 1.00 0.00 C ATOM 1293 CG GLU A 89 9.353 -17.829 -1.704 1.00 0.00 C ATOM 1294 CD GLU A 89 9.913 -18.369 -0.373 1.00 0.00 C ATOM 1295 OE1 GLU A 89 10.490 -19.484 -0.362 1.00 0.00 O ATOM 1296 OE2 GLU A 89 9.797 -17.677 0.670 1.00 0.00 O ATOM 0 H GLU A 89 9.204 -19.825 -3.712 1.00 0.00 H new ATOM 0 HA GLU A 89 6.611 -18.768 -3.676 1.00 0.00 H new ATOM 0 HB2 GLU A 89 7.217 -18.002 -1.491 1.00 0.00 H new ATOM 0 HB3 GLU A 89 8.035 -19.531 -1.743 1.00 0.00 H new ATOM 0 HG2 GLU A 89 10.072 -18.011 -2.503 1.00 0.00 H new ATOM 0 HG3 GLU A 89 9.222 -16.749 -1.633 1.00 0.00 H new ATOM 1303 N TRP A 90 8.777 -16.658 -4.810 1.00 0.00 N ATOM 1304 CA TRP A 90 8.971 -15.345 -5.382 1.00 0.00 C ATOM 1305 C TRP A 90 8.114 -15.125 -6.616 1.00 0.00 C ATOM 1306 O TRP A 90 7.482 -14.076 -6.729 1.00 0.00 O ATOM 1307 CB TRP A 90 10.463 -15.153 -5.628 1.00 0.00 C ATOM 1308 CG TRP A 90 11.194 -14.857 -4.359 1.00 0.00 C ATOM 1309 CD1 TRP A 90 11.895 -15.729 -3.607 1.00 0.00 C ATOM 1310 CD2 TRP A 90 11.146 -13.628 -3.589 1.00 0.00 C ATOM 1311 NE1 TRP A 90 12.239 -15.135 -2.405 1.00 0.00 N ATOM 1312 CE2 TRP A 90 11.729 -13.855 -2.310 1.00 0.00 C ATOM 1313 CE3 TRP A 90 10.593 -12.364 -3.834 1.00 0.00 C ATOM 1314 CZ2 TRP A 90 11.712 -12.874 -1.305 1.00 0.00 C ATOM 1315 CZ3 TRP A 90 10.532 -11.385 -2.832 1.00 0.00 C ATOM 1316 CH2 TRP A 90 11.090 -11.637 -1.571 1.00 0.00 C ATOM 0 H TRP A 90 9.550 -17.299 -4.990 1.00 0.00 H new ATOM 0 HA TRP A 90 8.634 -14.577 -4.686 1.00 0.00 H new ATOM 0 HB2 TRP A 90 10.876 -16.052 -6.086 1.00 0.00 H new ATOM 0 HB3 TRP A 90 10.614 -14.337 -6.335 1.00 0.00 H new ATOM 0 HD1 TRP A 90 12.149 -16.737 -3.898 1.00 0.00 H new ATOM 0 HE1 TRP A 90 12.798 -15.586 -1.681 1.00 0.00 H new ATOM 0 HE3 TRP A 90 10.205 -12.139 -4.816 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 12.168 -13.064 -0.345 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 10.055 -10.437 -3.032 1.00 0.00 H new ATOM 0 HH2 TRP A 90 11.043 -10.881 -0.801 1.00 0.00 H new ATOM 1327 N VAL A 91 8.031 -16.101 -7.514 1.00 0.00 N ATOM 1328 CA VAL A 91 7.178 -15.984 -8.681 1.00 0.00 C ATOM 1329 C VAL A 91 5.712 -16.055 -8.268 1.00 0.00 C ATOM 1330 O VAL A 91 4.904 -15.348 -8.861 1.00 0.00 O ATOM 1331 CB VAL A 91 7.586 -16.975 -9.789 1.00 0.00 C ATOM 1332 CG1 VAL A 91 8.920 -16.540 -10.403 1.00 0.00 C ATOM 1333 CG2 VAL A 91 7.723 -18.444 -9.381 1.00 0.00 C ATOM 0 H VAL A 91 8.545 -16.980 -7.452 1.00 0.00 H new ATOM 0 HA VAL A 91 7.316 -15.003 -9.135 1.00 0.00 H new ATOM 0 HB VAL A 91 6.752 -16.936 -10.490 1.00 0.00 H new ATOM 0 HG11 VAL A 91 9.206 -17.242 -11.186 1.00 0.00 H new ATOM 0 HG12 VAL A 91 8.816 -15.543 -10.830 1.00 0.00 H new ATOM 0 HG13 VAL A 91 9.689 -16.525 -9.630 1.00 0.00 H new ATOM 0 HG21 VAL A 91 8.014 -19.037 -10.248 1.00 0.00 H new ATOM 0 HG22 VAL A 91 8.484 -18.537 -8.606 1.00 0.00 H new ATOM 0 HG23 VAL A 91 6.769 -18.806 -8.998 1.00 0.00 H new ATOM 1343 N THR A 92 5.342 -16.809 -7.232 1.00 0.00 N ATOM 1344 CA THR A 92 3.938 -17.075 -6.936 1.00 0.00 C ATOM 1345 C THR A 92 3.239 -15.950 -6.154 1.00 0.00 C ATOM 1346 O THR A 92 2.318 -16.220 -5.377 1.00 0.00 O ATOM 1347 CB THR A 92 3.818 -18.455 -6.261 1.00 0.00 C ATOM 1348 OG1 THR A 92 4.540 -18.505 -5.043 1.00 0.00 O ATOM 1349 CG2 THR A 92 4.388 -19.544 -7.162 1.00 0.00 C ATOM 0 H THR A 92 5.998 -17.246 -6.584 1.00 0.00 H new ATOM 0 HA THR A 92 3.393 -17.098 -7.880 1.00 0.00 H new ATOM 0 HB THR A 92 2.756 -18.616 -6.074 1.00 0.00 H new ATOM 0 HG1 THR A 92 4.442 -19.393 -4.641 1.00 0.00 H new ATOM 0 HG21 THR A 92 4.294 -20.511 -6.668 1.00 0.00 H new ATOM 0 HG22 THR A 92 3.838 -19.562 -8.103 1.00 0.00 H new ATOM 0 HG23 THR A 92 5.440 -19.338 -7.360 1.00 0.00 H new ATOM 1357 N GLN A 93 3.665 -14.694 -6.331 1.00 0.00 N ATOM 1358 CA GLN A 93 2.962 -13.557 -5.769 1.00 0.00 C ATOM 1359 C GLN A 93 1.735 -13.203 -6.627 1.00 0.00 C ATOM 1360 O GLN A 93 1.382 -13.948 -7.548 1.00 0.00 O ATOM 1361 CB GLN A 93 3.935 -12.396 -5.458 1.00 0.00 C ATOM 1362 CG GLN A 93 4.986 -12.813 -4.411 1.00 0.00 C ATOM 1363 CD GLN A 93 4.331 -13.431 -3.164 1.00 0.00 C ATOM 1364 OE1 GLN A 93 3.360 -12.903 -2.619 1.00 0.00 O ATOM 1365 NE2 GLN A 93 4.769 -14.609 -2.738 1.00 0.00 N ATOM 0 H GLN A 93 4.499 -14.448 -6.864 1.00 0.00 H new ATOM 0 HA GLN A 93 2.548 -13.815 -4.794 1.00 0.00 H new ATOM 0 HB2 GLN A 93 4.435 -12.083 -6.374 1.00 0.00 H new ATOM 0 HB3 GLN A 93 3.374 -11.537 -5.091 1.00 0.00 H new ATOM 0 HG2 GLN A 93 5.676 -13.531 -4.854 1.00 0.00 H new ATOM 0 HG3 GLN A 93 5.575 -11.943 -4.120 1.00 0.00 H new ATOM 0 HE21 GLN A 93 5.573 -15.047 -3.188 1.00 0.00 H new ATOM 0 HE22 GLN A 93 4.302 -15.076 -1.961 1.00 0.00 H new ATOM 1374 N GLU A 94 1.053 -12.097 -6.312 1.00 0.00 N ATOM 1375 CA GLU A 94 -0.247 -11.765 -6.902 1.00 0.00 C ATOM 1376 C GLU A 94 -0.157 -11.498 -8.416 1.00 0.00 C ATOM 1377 O GLU A 94 -1.179 -11.498 -9.111 1.00 0.00 O ATOM 1378 CB GLU A 94 -0.870 -10.561 -6.172 1.00 0.00 C ATOM 1379 CG GLU A 94 -1.211 -10.831 -4.697 1.00 0.00 C ATOM 1380 CD GLU A 94 -2.268 -11.943 -4.530 1.00 0.00 C ATOM 1381 OE1 GLU A 94 -3.479 -11.669 -4.713 1.00 0.00 O ATOM 1382 OE2 GLU A 94 -1.900 -13.099 -4.207 1.00 0.00 O ATOM 0 H GLU A 94 1.388 -11.406 -5.640 1.00 0.00 H new ATOM 0 HA GLU A 94 -0.892 -12.634 -6.775 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -0.179 -9.719 -6.226 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -1.778 -10.262 -6.695 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -0.304 -11.113 -4.163 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -1.578 -9.913 -4.238 1.00 0.00 H new ATOM 1389 N ILE A 95 1.057 -11.298 -8.936 1.00 0.00 N ATOM 1390 CA ILE A 95 1.368 -11.217 -10.349 1.00 0.00 C ATOM 1391 C ILE A 95 2.737 -11.878 -10.550 1.00 0.00 C ATOM 1392 O ILE A 95 3.661 -11.657 -9.758 1.00 0.00 O ATOM 1393 CB ILE A 95 1.299 -9.744 -10.829 1.00 0.00 C ATOM 1394 CG1 ILE A 95 1.846 -9.596 -12.265 1.00 0.00 C ATOM 1395 CG2 ILE A 95 2.024 -8.791 -9.858 1.00 0.00 C ATOM 1396 CD1 ILE A 95 1.446 -8.281 -12.943 1.00 0.00 C ATOM 0 H ILE A 95 1.882 -11.184 -8.348 1.00 0.00 H new ATOM 0 HA ILE A 95 0.641 -11.748 -10.963 1.00 0.00 H new ATOM 0 HB ILE A 95 0.247 -9.459 -10.840 1.00 0.00 H new ATOM 0 HG12 ILE A 95 2.933 -9.665 -12.239 1.00 0.00 H new ATOM 0 HG13 ILE A 95 1.488 -10.430 -12.869 1.00 0.00 H new ATOM 0 HG21 ILE A 95 1.953 -7.769 -10.230 1.00 0.00 H new ATOM 0 HG22 ILE A 95 1.560 -8.852 -8.874 1.00 0.00 H new ATOM 0 HG23 ILE A 95 3.073 -9.077 -9.783 1.00 0.00 H new ATOM 0 HD11 ILE A 95 1.866 -8.247 -13.948 1.00 0.00 H new ATOM 0 HD12 ILE A 95 0.359 -8.218 -13.001 1.00 0.00 H new ATOM 0 HD13 ILE A 95 1.828 -7.441 -12.362 1.00 0.00 H new ATOM 1408 N PHE A 96 2.854 -12.679 -11.613 1.00 0.00 N ATOM 1409 CA PHE A 96 4.107 -13.229 -12.116 1.00 0.00 C ATOM 1410 C PHE A 96 4.273 -12.642 -13.525 1.00 0.00 C ATOM 1411 O PHE A 96 3.318 -12.669 -14.310 1.00 0.00 O ATOM 1412 CB PHE A 96 4.077 -14.764 -12.149 1.00 0.00 C ATOM 1413 CG PHE A 96 5.137 -15.379 -13.045 1.00 0.00 C ATOM 1414 CD1 PHE A 96 6.502 -15.190 -12.750 1.00 0.00 C ATOM 1415 CD2 PHE A 96 4.768 -16.100 -14.198 1.00 0.00 C ATOM 1416 CE1 PHE A 96 7.486 -15.732 -13.594 1.00 0.00 C ATOM 1417 CE2 PHE A 96 5.758 -16.632 -15.046 1.00 0.00 C ATOM 1418 CZ PHE A 96 7.118 -16.449 -14.743 1.00 0.00 C ATOM 0 H PHE A 96 2.047 -12.970 -12.164 1.00 0.00 H new ATOM 0 HA PHE A 96 4.945 -12.968 -11.470 1.00 0.00 H new ATOM 0 HB2 PHE A 96 4.208 -15.142 -11.135 1.00 0.00 H new ATOM 0 HB3 PHE A 96 3.094 -15.092 -12.487 1.00 0.00 H new ATOM 0 HD1 PHE A 96 6.792 -14.628 -11.874 1.00 0.00 H new ATOM 0 HD2 PHE A 96 3.724 -16.245 -14.432 1.00 0.00 H new ATOM 0 HE1 PHE A 96 8.531 -15.596 -13.357 1.00 0.00 H new ATOM 0 HE2 PHE A 96 5.472 -17.182 -15.931 1.00 0.00 H new ATOM 0 HZ PHE A 96 7.878 -16.859 -15.392 1.00 0.00 H new ATOM 1428 N GLU A 97 5.454 -12.117 -13.853 1.00 0.00 N ATOM 1429 CA GLU A 97 5.789 -11.593 -15.174 1.00 0.00 C ATOM 1430 C GLU A 97 7.239 -11.959 -15.488 1.00 0.00 C ATOM 1431 O GLU A 97 8.020 -12.304 -14.593 1.00 0.00 O ATOM 1432 CB GLU A 97 5.593 -10.074 -15.236 1.00 0.00 C ATOM 1433 CG GLU A 97 4.147 -9.555 -15.260 1.00 0.00 C ATOM 1434 CD GLU A 97 3.446 -9.644 -16.632 1.00 0.00 C ATOM 1435 OE1 GLU A 97 3.769 -10.530 -17.460 1.00 0.00 O ATOM 1436 OE2 GLU A 97 2.544 -8.804 -16.885 1.00 0.00 O ATOM 0 H GLU A 97 6.224 -12.043 -13.188 1.00 0.00 H new ATOM 0 HA GLU A 97 5.123 -12.035 -15.915 1.00 0.00 H new ATOM 0 HB2 GLU A 97 6.097 -9.633 -14.376 1.00 0.00 H new ATOM 0 HB3 GLU A 97 6.100 -9.704 -16.127 1.00 0.00 H new ATOM 0 HG2 GLU A 97 3.562 -10.118 -14.533 1.00 0.00 H new ATOM 0 HG3 GLU A 97 4.145 -8.515 -14.934 1.00 0.00 H new ATOM 1443 N ASP A 98 7.573 -11.869 -16.772 1.00 0.00 N ATOM 1444 CA ASP A 98 8.796 -12.353 -17.398 1.00 0.00 C ATOM 1445 C ASP A 98 8.791 -11.889 -18.845 1.00 0.00 C ATOM 1446 O ASP A 98 7.800 -12.099 -19.554 1.00 0.00 O ATOM 1447 CB ASP A 98 8.864 -13.890 -17.388 1.00 0.00 C ATOM 1448 CG ASP A 98 9.878 -14.444 -18.419 1.00 0.00 C ATOM 1449 OD1 ASP A 98 11.024 -13.949 -18.527 1.00 0.00 O ATOM 1450 OD2 ASP A 98 9.507 -15.387 -19.165 1.00 0.00 O ATOM 0 H ASP A 98 6.952 -11.425 -17.448 1.00 0.00 H new ATOM 0 HA ASP A 98 9.652 -11.966 -16.845 1.00 0.00 H new ATOM 0 HB2 ASP A 98 9.141 -14.232 -16.391 1.00 0.00 H new ATOM 0 HB3 ASP A 98 7.875 -14.296 -17.601 1.00 0.00 H new ATOM 1455 N TRP A 99 9.876 -11.242 -19.273 1.00 0.00 N ATOM 1456 CA TRP A 99 9.953 -10.561 -20.558 1.00 0.00 C ATOM 1457 C TRP A 99 11.391 -10.625 -21.070 1.00 0.00 C ATOM 1458 O TRP A 99 12.327 -10.452 -20.289 1.00 0.00 O ATOM 1459 CB TRP A 99 9.547 -9.089 -20.394 1.00 0.00 C ATOM 1460 CG TRP A 99 8.210 -8.778 -19.788 1.00 0.00 C ATOM 1461 CD1 TRP A 99 7.003 -9.241 -20.181 1.00 0.00 C ATOM 1462 CD2 TRP A 99 7.940 -7.923 -18.644 1.00 0.00 C ATOM 1463 NE1 TRP A 99 6.019 -8.756 -19.339 1.00 0.00 N ATOM 1464 CE2 TRP A 99 6.540 -7.919 -18.382 1.00 0.00 C ATOM 1465 CE3 TRP A 99 8.756 -7.156 -17.791 1.00 0.00 C ATOM 1466 CZ2 TRP A 99 5.972 -7.187 -17.331 1.00 0.00 C ATOM 1467 CZ3 TRP A 99 8.203 -6.489 -16.688 1.00 0.00 C ATOM 1468 CH2 TRP A 99 6.820 -6.489 -16.461 1.00 0.00 C ATOM 0 H TRP A 99 10.735 -11.178 -18.727 1.00 0.00 H new ATOM 0 HA TRP A 99 9.279 -11.046 -21.264 1.00 0.00 H new ATOM 0 HB2 TRP A 99 10.308 -8.601 -19.785 1.00 0.00 H new ATOM 0 HB3 TRP A 99 9.580 -8.624 -21.379 1.00 0.00 H new ATOM 0 HD1 TRP A 99 6.832 -9.892 -21.026 1.00 0.00 H new ATOM 0 HE1 TRP A 99 5.030 -8.990 -19.419 1.00 0.00 H new ATOM 0 HE3 TRP A 99 9.815 -7.081 -17.987 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 4.901 -7.161 -17.194 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 8.854 -5.967 -16.002 1.00 0.00 H new ATOM 0 HH2 TRP A 99 6.409 -5.953 -15.618 1.00 0.00 H new ATOM 1479 N GLN A 100 11.577 -10.791 -22.384 1.00 0.00 N ATOM 1480 CA GLN A 100 12.893 -10.751 -23.014 1.00 0.00 C ATOM 1481 C GLN A 100 13.252 -9.287 -23.292 1.00 0.00 C ATOM 1482 O GLN A 100 13.029 -8.777 -24.392 1.00 0.00 O ATOM 1483 CB GLN A 100 12.910 -11.630 -24.279 1.00 0.00 C ATOM 1484 CG GLN A 100 12.725 -13.127 -23.962 1.00 0.00 C ATOM 1485 CD GLN A 100 12.785 -14.034 -25.197 1.00 0.00 C ATOM 1486 OE1 GLN A 100 12.976 -13.595 -26.332 1.00 0.00 O ATOM 1487 NE2 GLN A 100 12.627 -15.338 -25.010 1.00 0.00 N ATOM 0 H GLN A 100 10.813 -10.957 -23.039 1.00 0.00 H new ATOM 0 HA GLN A 100 13.654 -11.165 -22.352 1.00 0.00 H new ATOM 0 HB2 GLN A 100 12.118 -11.305 -24.954 1.00 0.00 H new ATOM 0 HB3 GLN A 100 13.855 -11.487 -24.804 1.00 0.00 H new ATOM 0 HG2 GLN A 100 13.496 -13.437 -23.257 1.00 0.00 H new ATOM 0 HG3 GLN A 100 11.765 -13.268 -23.466 1.00 0.00 H new ATOM 0 HE21 GLN A 100 12.469 -15.703 -24.071 1.00 0.00 H new ATOM 0 HE22 GLN A 100 12.664 -15.975 -25.805 1.00 0.00 H new ATOM 1496 N LEU A 101 13.780 -8.593 -22.276 1.00 0.00 N ATOM 1497 CA LEU A 101 14.346 -7.250 -22.435 1.00 0.00 C ATOM 1498 C LEU A 101 15.599 -7.416 -23.290 1.00 0.00 C ATOM 1499 O LEU A 101 16.440 -8.254 -22.968 1.00 0.00 O ATOM 1500 CB LEU A 101 14.644 -6.612 -21.055 1.00 0.00 C ATOM 1501 CG LEU A 101 13.448 -5.893 -20.415 1.00 0.00 C ATOM 1502 CD1 LEU A 101 12.204 -6.768 -20.288 1.00 0.00 C ATOM 1503 CD2 LEU A 101 13.854 -5.406 -19.018 1.00 0.00 C ATOM 0 H LEU A 101 13.826 -8.948 -21.321 1.00 0.00 H new ATOM 0 HA LEU A 101 13.649 -6.569 -22.923 1.00 0.00 H new ATOM 0 HB2 LEU A 101 14.990 -7.391 -20.376 1.00 0.00 H new ATOM 0 HB3 LEU A 101 15.462 -5.901 -21.167 1.00 0.00 H new ATOM 0 HG LEU A 101 13.187 -5.065 -21.074 1.00 0.00 H new ATOM 0 HD11 LEU A 101 11.400 -6.193 -19.828 1.00 0.00 H new ATOM 0 HD12 LEU A 101 11.891 -7.101 -21.277 1.00 0.00 H new ATOM 0 HD13 LEU A 101 12.431 -7.635 -19.668 1.00 0.00 H new ATOM 0 HD21 LEU A 101 13.012 -4.893 -18.553 1.00 0.00 H new ATOM 0 HD22 LEU A 101 14.143 -6.260 -18.405 1.00 0.00 H new ATOM 0 HD23 LEU A 101 14.696 -4.719 -19.103 1.00 0.00 H new ATOM 1515 N GLU A 102 15.749 -6.638 -24.365 1.00 0.00 N ATOM 1516 CA GLU A 102 16.799 -6.892 -25.357 1.00 0.00 C ATOM 1517 C GLU A 102 18.213 -6.572 -24.850 1.00 0.00 C ATOM 1518 O GLU A 102 19.166 -7.146 -25.378 1.00 0.00 O ATOM 1519 CB GLU A 102 16.498 -6.155 -26.673 1.00 0.00 C ATOM 1520 CG GLU A 102 15.266 -6.734 -27.389 1.00 0.00 C ATOM 1521 CD GLU A 102 15.195 -6.271 -28.856 1.00 0.00 C ATOM 1522 OE1 GLU A 102 15.842 -6.902 -29.729 1.00 0.00 O ATOM 1523 OE2 GLU A 102 14.473 -5.290 -29.155 1.00 0.00 O ATOM 0 H GLU A 102 15.160 -5.831 -24.571 1.00 0.00 H new ATOM 0 HA GLU A 102 16.788 -7.966 -25.545 1.00 0.00 H new ATOM 0 HB2 GLU A 102 16.334 -5.097 -26.467 1.00 0.00 H new ATOM 0 HB3 GLU A 102 17.364 -6.221 -27.332 1.00 0.00 H new ATOM 0 HG2 GLU A 102 15.301 -7.823 -27.352 1.00 0.00 H new ATOM 0 HG3 GLU A 102 14.361 -6.426 -26.865 1.00 0.00 H new ATOM 1530 N ASP A 103 18.327 -5.733 -23.804 1.00 0.00 N ATOM 1531 CA ASP A 103 19.575 -5.282 -23.158 1.00 0.00 C ATOM 1532 C ASP A 103 20.519 -4.476 -24.090 1.00 0.00 C ATOM 1533 O ASP A 103 20.927 -4.950 -25.157 1.00 0.00 O ATOM 1534 CB ASP A 103 20.312 -6.444 -22.477 1.00 0.00 C ATOM 1535 CG ASP A 103 21.797 -6.090 -22.296 1.00 0.00 C ATOM 1536 OD1 ASP A 103 22.086 -5.096 -21.589 1.00 0.00 O ATOM 1537 OD2 ASP A 103 22.651 -6.802 -22.877 1.00 0.00 O ATOM 0 H ASP A 103 17.503 -5.328 -23.361 1.00 0.00 H new ATOM 0 HA ASP A 103 19.261 -4.578 -22.387 1.00 0.00 H new ATOM 0 HB2 ASP A 103 19.859 -6.655 -21.508 1.00 0.00 H new ATOM 0 HB3 ASP A 103 20.216 -7.349 -23.078 1.00 0.00 H new ATOM 1542 N PRO A 104 20.901 -3.244 -23.705 1.00 0.00 N ATOM 1543 CA PRO A 104 21.764 -2.400 -24.516 1.00 0.00 C ATOM 1544 C PRO A 104 23.270 -2.602 -24.268 1.00 0.00 C ATOM 1545 O PRO A 104 24.054 -1.938 -24.946 1.00 0.00 O ATOM 1546 CB PRO A 104 21.320 -0.994 -24.152 1.00 0.00 C ATOM 1547 CG PRO A 104 21.045 -1.105 -22.655 1.00 0.00 C ATOM 1548 CD PRO A 104 20.412 -2.486 -22.555 1.00 0.00 C ATOM 0 HA PRO A 104 21.662 -2.637 -25.575 1.00 0.00 H new ATOM 0 HB2 PRO A 104 22.093 -0.257 -24.368 1.00 0.00 H new ATOM 0 HB3 PRO A 104 20.430 -0.694 -24.706 1.00 0.00 H new ATOM 0 HG2 PRO A 104 21.959 -1.030 -22.065 1.00 0.00 H new ATOM 0 HG3 PRO A 104 20.374 -0.321 -22.304 1.00 0.00 H new ATOM 0 HD2 PRO A 104 20.689 -2.974 -21.621 1.00 0.00 H new ATOM 0 HD3 PRO A 104 19.324 -2.417 -22.568 1.00 0.00 H new ATOM 1556 N ASP A 105 23.703 -3.443 -23.315 1.00 0.00 N ATOM 1557 CA ASP A 105 25.116 -3.539 -22.940 1.00 0.00 C ATOM 1558 C ASP A 105 25.999 -3.797 -24.169 1.00 0.00 C ATOM 1559 O ASP A 105 25.765 -4.751 -24.922 1.00 0.00 O ATOM 1560 CB ASP A 105 25.388 -4.649 -21.924 1.00 0.00 C ATOM 1561 CG ASP A 105 26.908 -4.871 -21.791 1.00 0.00 C ATOM 1562 OD1 ASP A 105 27.633 -3.904 -21.451 1.00 0.00 O ATOM 1563 OD2 ASP A 105 27.388 -6.010 -22.009 1.00 0.00 O ATOM 0 H ASP A 105 23.089 -4.067 -22.791 1.00 0.00 H new ATOM 0 HA ASP A 105 25.361 -2.579 -22.486 1.00 0.00 H new ATOM 0 HB2 ASP A 105 24.964 -4.381 -20.956 1.00 0.00 H new ATOM 0 HB3 ASP A 105 24.902 -5.572 -22.241 1.00 0.00 H new ATOM 1568 N GLY A 106 27.021 -2.953 -24.362 1.00 0.00 N ATOM 1569 CA GLY A 106 27.994 -3.080 -25.441 1.00 0.00 C ATOM 1570 C GLY A 106 27.428 -2.740 -26.826 1.00 0.00 C ATOM 1571 O GLY A 106 28.181 -2.778 -27.805 1.00 0.00 O ATOM 0 H GLY A 106 27.193 -2.149 -23.758 1.00 0.00 H new ATOM 0 HA2 GLY A 106 28.841 -2.425 -25.234 1.00 0.00 H new ATOM 0 HA3 GLY A 106 28.376 -4.101 -25.455 1.00 0.00 H new ATOM 1575 N GLN A 107 26.139 -2.404 -26.930 1.00 0.00 N ATOM 1576 CA GLN A 107 25.504 -1.955 -28.163 1.00 0.00 C ATOM 1577 C GLN A 107 25.623 -0.420 -28.264 1.00 0.00 C ATOM 1578 O GLN A 107 26.052 0.252 -27.320 1.00 0.00 O ATOM 1579 CB GLN A 107 24.042 -2.445 -28.239 1.00 0.00 C ATOM 1580 CG GLN A 107 23.821 -3.921 -27.847 1.00 0.00 C ATOM 1581 CD GLN A 107 22.710 -4.624 -28.637 1.00 0.00 C ATOM 1582 OE1 GLN A 107 22.726 -4.655 -29.866 1.00 0.00 O ATOM 1583 NE2 GLN A 107 21.728 -5.216 -27.966 1.00 0.00 N ATOM 0 H GLN A 107 25.497 -2.439 -26.138 1.00 0.00 H new ATOM 0 HA GLN A 107 26.015 -2.389 -29.023 1.00 0.00 H new ATOM 0 HB2 GLN A 107 23.432 -1.818 -27.589 1.00 0.00 H new ATOM 0 HB3 GLN A 107 23.679 -2.298 -29.256 1.00 0.00 H new ATOM 0 HG2 GLN A 107 24.754 -4.466 -27.990 1.00 0.00 H new ATOM 0 HG3 GLN A 107 23.583 -3.971 -26.785 1.00 0.00 H new ATOM 0 HE21 GLN A 107 21.718 -5.188 -26.946 1.00 0.00 H new ATOM 0 HE22 GLN A 107 20.984 -5.698 -28.470 1.00 0.00 H new ATOM 1592 N SER A 108 25.248 0.141 -29.416 1.00 0.00 N ATOM 1593 CA SER A 108 25.313 1.576 -29.676 1.00 0.00 C ATOM 1594 C SER A 108 24.279 2.339 -28.829 1.00 0.00 C ATOM 1595 O SER A 108 23.318 1.750 -28.330 1.00 0.00 O ATOM 1596 CB SER A 108 25.129 1.812 -31.184 1.00 0.00 C ATOM 1597 OG SER A 108 26.032 1.004 -31.930 1.00 0.00 O ATOM 0 H SER A 108 24.886 -0.398 -30.203 1.00 0.00 H new ATOM 0 HA SER A 108 26.288 1.965 -29.382 1.00 0.00 H new ATOM 0 HB2 SER A 108 24.103 1.581 -31.471 1.00 0.00 H new ATOM 0 HB3 SER A 108 25.296 2.864 -31.416 1.00 0.00 H new ATOM 0 HG SER A 108 25.900 1.165 -32.888 1.00 0.00 H new ATOM 1603 N LEU A 109 24.429 3.665 -28.693 1.00 0.00 N ATOM 1604 CA LEU A 109 23.565 4.478 -27.822 1.00 0.00 C ATOM 1605 C LEU A 109 22.113 4.473 -28.291 1.00 0.00 C ATOM 1606 O LEU A 109 21.210 4.576 -27.466 1.00 0.00 O ATOM 1607 CB LEU A 109 24.090 5.922 -27.681 1.00 0.00 C ATOM 1608 CG LEU A 109 25.500 6.064 -27.072 1.00 0.00 C ATOM 1609 CD1 LEU A 109 25.789 7.546 -26.810 1.00 0.00 C ATOM 1610 CD2 LEU A 109 25.697 5.263 -25.780 1.00 0.00 C ATOM 0 H LEU A 109 25.147 4.202 -29.180 1.00 0.00 H new ATOM 0 HA LEU A 109 23.595 4.014 -26.836 1.00 0.00 H new ATOM 0 HB2 LEU A 109 24.092 6.386 -28.667 1.00 0.00 H new ATOM 0 HB3 LEU A 109 23.389 6.485 -27.065 1.00 0.00 H new ATOM 0 HG LEU A 109 26.200 5.651 -27.798 1.00 0.00 H new ATOM 0 HD11 LEU A 109 26.785 7.652 -26.379 1.00 0.00 H new ATOM 0 HD12 LEU A 109 25.739 8.098 -27.749 1.00 0.00 H new ATOM 0 HD13 LEU A 109 25.049 7.944 -26.115 1.00 0.00 H new ATOM 0 HD21 LEU A 109 26.712 5.412 -25.411 1.00 0.00 H new ATOM 0 HD22 LEU A 109 24.984 5.603 -25.029 1.00 0.00 H new ATOM 0 HD23 LEU A 109 25.536 4.204 -25.980 1.00 0.00 H new ATOM 1622 N GLU A 110 21.866 4.261 -29.585 1.00 0.00 N ATOM 1623 CA GLU A 110 20.522 4.064 -30.124 1.00 0.00 C ATOM 1624 C GLU A 110 19.813 2.900 -29.433 1.00 0.00 C ATOM 1625 O GLU A 110 18.609 2.966 -29.202 1.00 0.00 O ATOM 1626 CB GLU A 110 20.563 3.836 -31.648 1.00 0.00 C ATOM 1627 CG GLU A 110 21.651 2.877 -32.152 1.00 0.00 C ATOM 1628 CD GLU A 110 21.563 2.687 -33.678 1.00 0.00 C ATOM 1629 OE1 GLU A 110 20.813 1.793 -34.141 1.00 0.00 O ATOM 1630 OE2 GLU A 110 22.257 3.420 -34.424 1.00 0.00 O ATOM 0 H GLU A 110 22.600 4.221 -30.292 1.00 0.00 H new ATOM 0 HA GLU A 110 19.955 4.974 -29.927 1.00 0.00 H new ATOM 0 HB2 GLU A 110 19.593 3.453 -31.965 1.00 0.00 H new ATOM 0 HB3 GLU A 110 20.701 4.800 -32.137 1.00 0.00 H new ATOM 0 HG2 GLU A 110 22.634 3.267 -31.888 1.00 0.00 H new ATOM 0 HG3 GLU A 110 21.547 1.912 -31.656 1.00 0.00 H new ATOM 1637 N VAL A 111 20.545 1.854 -29.058 1.00 0.00 N ATOM 1638 CA VAL A 111 19.992 0.669 -28.429 1.00 0.00 C ATOM 1639 C VAL A 111 19.688 0.977 -26.967 1.00 0.00 C ATOM 1640 O VAL A 111 18.605 0.634 -26.516 1.00 0.00 O ATOM 1641 CB VAL A 111 20.922 -0.536 -28.624 1.00 0.00 C ATOM 1642 CG1 VAL A 111 20.270 -1.839 -28.149 1.00 0.00 C ATOM 1643 CG2 VAL A 111 21.332 -0.672 -30.104 1.00 0.00 C ATOM 0 H VAL A 111 21.556 1.810 -29.187 1.00 0.00 H new ATOM 0 HA VAL A 111 19.052 0.390 -28.905 1.00 0.00 H new ATOM 0 HB VAL A 111 21.810 -0.358 -28.017 1.00 0.00 H new ATOM 0 HG11 VAL A 111 20.960 -2.669 -28.304 1.00 0.00 H new ATOM 0 HG12 VAL A 111 20.029 -1.760 -27.089 1.00 0.00 H new ATOM 0 HG13 VAL A 111 19.356 -2.016 -28.716 1.00 0.00 H new ATOM 0 HG21 VAL A 111 21.991 -1.532 -30.221 1.00 0.00 H new ATOM 0 HG22 VAL A 111 20.441 -0.811 -30.717 1.00 0.00 H new ATOM 0 HG23 VAL A 111 21.854 0.231 -30.422 1.00 0.00 H new ATOM 1653 N PHE A 112 20.554 1.691 -26.240 1.00 0.00 N ATOM 1654 CA PHE A 112 20.216 2.188 -24.900 1.00 0.00 C ATOM 1655 C PHE A 112 18.931 3.010 -24.966 1.00 0.00 C ATOM 1656 O PHE A 112 17.991 2.746 -24.225 1.00 0.00 O ATOM 1657 CB PHE A 112 21.362 3.034 -24.316 1.00 0.00 C ATOM 1658 CG PHE A 112 22.552 2.243 -23.801 1.00 0.00 C ATOM 1659 CD1 PHE A 112 23.611 1.886 -24.658 1.00 0.00 C ATOM 1660 CD2 PHE A 112 22.579 1.827 -22.455 1.00 0.00 C ATOM 1661 CE1 PHE A 112 24.666 1.091 -24.182 1.00 0.00 C ATOM 1662 CE2 PHE A 112 23.629 1.019 -21.986 1.00 0.00 C ATOM 1663 CZ PHE A 112 24.664 0.638 -22.855 1.00 0.00 C ATOM 0 H PHE A 112 21.492 1.938 -26.555 1.00 0.00 H new ATOM 0 HA PHE A 112 20.064 1.332 -24.242 1.00 0.00 H new ATOM 0 HB2 PHE A 112 21.710 3.725 -25.084 1.00 0.00 H new ATOM 0 HB3 PHE A 112 20.967 3.638 -23.499 1.00 0.00 H new ATOM 0 HD1 PHE A 112 23.612 2.224 -25.684 1.00 0.00 H new ATOM 0 HD2 PHE A 112 21.791 2.130 -21.782 1.00 0.00 H new ATOM 0 HE1 PHE A 112 25.481 0.828 -24.840 1.00 0.00 H new ATOM 0 HE2 PHE A 112 23.640 0.691 -20.957 1.00 0.00 H new ATOM 0 HZ PHE A 112 25.458 -0.003 -22.502 1.00 0.00 H new ATOM 1673 N ARG A 113 18.849 3.956 -25.897 1.00 0.00 N ATOM 1674 CA ARG A 113 17.711 4.871 -26.008 1.00 0.00 C ATOM 1675 C ARG A 113 16.439 4.126 -26.435 1.00 0.00 C ATOM 1676 O ARG A 113 15.359 4.438 -25.938 1.00 0.00 O ATOM 1677 CB ARG A 113 18.117 6.013 -26.960 1.00 0.00 C ATOM 1678 CG ARG A 113 19.201 6.895 -26.303 1.00 0.00 C ATOM 1679 CD ARG A 113 19.893 7.832 -27.291 1.00 0.00 C ATOM 1680 NE ARG A 113 20.840 8.729 -26.598 1.00 0.00 N ATOM 1681 CZ ARG A 113 21.835 9.412 -27.179 1.00 0.00 C ATOM 1682 NH1 ARG A 113 22.071 9.311 -28.489 1.00 0.00 N ATOM 1683 NH2 ARG A 113 22.593 10.205 -26.438 1.00 0.00 N ATOM 0 H ARG A 113 19.572 4.112 -26.600 1.00 0.00 H new ATOM 0 HA ARG A 113 17.461 5.307 -25.041 1.00 0.00 H new ATOM 0 HB2 ARG A 113 18.492 5.600 -27.896 1.00 0.00 H new ATOM 0 HB3 ARG A 113 17.245 6.619 -27.206 1.00 0.00 H new ATOM 0 HG2 ARG A 113 18.747 7.487 -25.508 1.00 0.00 H new ATOM 0 HG3 ARG A 113 19.948 6.254 -25.836 1.00 0.00 H new ATOM 0 HD2 ARG A 113 20.424 7.246 -28.041 1.00 0.00 H new ATOM 0 HD3 ARG A 113 19.146 8.425 -27.819 1.00 0.00 H new ATOM 0 HE ARG A 113 20.726 8.838 -25.590 1.00 0.00 H new ATOM 0 HH11 ARG A 113 21.488 8.705 -29.067 1.00 0.00 H new ATOM 0 HH12 ARG A 113 22.834 9.840 -28.912 1.00 0.00 H new ATOM 0 HH21 ARG A 113 22.416 10.290 -25.437 1.00 0.00 H new ATOM 0 HH22 ARG A 113 23.354 10.731 -26.868 1.00 0.00 H new ATOM 1697 N THR A 114 16.562 3.081 -27.253 1.00 0.00 N ATOM 1698 CA THR A 114 15.481 2.176 -27.587 1.00 0.00 C ATOM 1699 C THR A 114 15.049 1.407 -26.340 1.00 0.00 C ATOM 1700 O THR A 114 13.861 1.369 -26.029 1.00 0.00 O ATOM 1701 CB THR A 114 15.999 1.245 -28.695 1.00 0.00 C ATOM 1702 OG1 THR A 114 16.004 1.915 -29.943 1.00 0.00 O ATOM 1703 CG2 THR A 114 15.217 -0.061 -28.803 1.00 0.00 C ATOM 0 H THR A 114 17.442 2.841 -27.709 1.00 0.00 H new ATOM 0 HA THR A 114 14.601 2.709 -27.946 1.00 0.00 H new ATOM 0 HB THR A 114 17.018 0.976 -28.417 1.00 0.00 H new ATOM 0 HG1 THR A 114 16.834 2.428 -30.036 1.00 0.00 H new ATOM 0 HG21 THR A 114 15.635 -0.670 -29.604 1.00 0.00 H new ATOM 0 HG22 THR A 114 15.285 -0.605 -27.861 1.00 0.00 H new ATOM 0 HG23 THR A 114 14.172 0.158 -29.021 1.00 0.00 H new ATOM 1711 N VAL A 115 15.986 0.804 -25.606 1.00 0.00 N ATOM 1712 CA VAL A 115 15.651 -0.095 -24.515 1.00 0.00 C ATOM 1713 C VAL A 115 15.059 0.716 -23.362 1.00 0.00 C ATOM 1714 O VAL A 115 14.182 0.202 -22.677 1.00 0.00 O ATOM 1715 CB VAL A 115 16.835 -1.024 -24.168 1.00 0.00 C ATOM 1716 CG1 VAL A 115 16.488 -1.936 -22.977 1.00 0.00 C ATOM 1717 CG2 VAL A 115 17.175 -1.963 -25.340 1.00 0.00 C ATOM 0 H VAL A 115 16.988 0.927 -25.754 1.00 0.00 H new ATOM 0 HA VAL A 115 14.870 -0.797 -24.807 1.00 0.00 H new ATOM 0 HB VAL A 115 17.675 -0.369 -23.937 1.00 0.00 H new ATOM 0 HG11 VAL A 115 17.338 -2.580 -22.752 1.00 0.00 H new ATOM 0 HG12 VAL A 115 16.256 -1.324 -22.105 1.00 0.00 H new ATOM 0 HG13 VAL A 115 15.624 -2.550 -23.229 1.00 0.00 H new ATOM 0 HG21 VAL A 115 18.012 -2.603 -25.062 1.00 0.00 H new ATOM 0 HG22 VAL A 115 16.308 -2.581 -25.574 1.00 0.00 H new ATOM 0 HG23 VAL A 115 17.445 -1.371 -26.214 1.00 0.00 H new ATOM 1727 N ARG A 116 15.401 2.002 -23.218 1.00 0.00 N ATOM 1728 CA ARG A 116 14.699 2.876 -22.279 1.00 0.00 C ATOM 1729 C ARG A 116 13.204 2.875 -22.610 1.00 0.00 C ATOM 1730 O ARG A 116 12.398 2.597 -21.733 1.00 0.00 O ATOM 1731 CB ARG A 116 15.258 4.319 -22.296 1.00 0.00 C ATOM 1732 CG ARG A 116 16.635 4.481 -21.626 1.00 0.00 C ATOM 1733 CD ARG A 116 16.916 5.922 -21.163 1.00 0.00 C ATOM 1734 NE ARG A 116 17.479 6.822 -22.202 1.00 0.00 N ATOM 1735 CZ ARG A 116 16.841 7.727 -22.962 1.00 0.00 C ATOM 1736 NH1 ARG A 116 15.519 7.705 -23.110 1.00 0.00 N ATOM 1737 NH2 ARG A 116 17.532 8.676 -23.579 1.00 0.00 N ATOM 0 H ARG A 116 16.154 2.455 -23.736 1.00 0.00 H new ATOM 0 HA ARG A 116 14.855 2.489 -21.272 1.00 0.00 H new ATOM 0 HB2 ARG A 116 15.330 4.654 -23.331 1.00 0.00 H new ATOM 0 HB3 ARG A 116 14.546 4.976 -21.797 1.00 0.00 H new ATOM 0 HG2 ARG A 116 16.696 3.812 -20.768 1.00 0.00 H new ATOM 0 HG3 ARG A 116 17.411 4.173 -22.326 1.00 0.00 H new ATOM 0 HD2 ARG A 116 15.987 6.356 -20.794 1.00 0.00 H new ATOM 0 HD3 ARG A 116 17.608 5.888 -20.321 1.00 0.00 H new ATOM 0 HE ARG A 116 18.484 6.742 -22.359 1.00 0.00 H new ATOM 0 HH11 ARG A 116 14.965 6.989 -22.640 1.00 0.00 H new ATOM 0 HH12 ARG A 116 15.059 8.404 -23.693 1.00 0.00 H new ATOM 0 HH21 ARG A 116 18.546 8.717 -23.476 1.00 0.00 H new ATOM 0 HH22 ARG A 116 17.050 9.364 -24.157 1.00 0.00 H new ATOM 1751 N GLY A 117 12.839 3.096 -23.873 1.00 0.00 N ATOM 1752 CA GLY A 117 11.448 3.092 -24.318 1.00 0.00 C ATOM 1753 C GLY A 117 10.787 1.730 -24.110 1.00 0.00 C ATOM 1754 O GLY A 117 9.696 1.665 -23.543 1.00 0.00 O ATOM 0 H GLY A 117 13.507 3.284 -24.621 1.00 0.00 H new ATOM 0 HA2 GLY A 117 10.890 3.853 -23.773 1.00 0.00 H new ATOM 0 HA3 GLY A 117 11.404 3.360 -25.374 1.00 0.00 H new ATOM 1758 N GLN A 118 11.464 0.638 -24.500 1.00 0.00 N ATOM 1759 CA GLN A 118 10.937 -0.725 -24.359 1.00 0.00 C ATOM 1760 C GLN A 118 10.597 -1.012 -22.899 1.00 0.00 C ATOM 1761 O GLN A 118 9.492 -1.436 -22.568 1.00 0.00 O ATOM 1762 CB GLN A 118 11.952 -1.769 -24.849 1.00 0.00 C ATOM 1763 CG GLN A 118 12.194 -1.705 -26.360 1.00 0.00 C ATOM 1764 CD GLN A 118 13.067 -2.857 -26.857 1.00 0.00 C ATOM 1765 OE1 GLN A 118 13.862 -3.436 -26.121 1.00 0.00 O ATOM 1766 NE2 GLN A 118 12.939 -3.195 -28.126 1.00 0.00 N ATOM 0 H GLN A 118 12.392 0.677 -24.922 1.00 0.00 H new ATOM 0 HA GLN A 118 10.037 -0.794 -24.970 1.00 0.00 H new ATOM 0 HB2 GLN A 118 12.898 -1.620 -24.328 1.00 0.00 H new ATOM 0 HB3 GLN A 118 11.596 -2.765 -24.585 1.00 0.00 H new ATOM 0 HG2 GLN A 118 11.236 -1.727 -26.880 1.00 0.00 H new ATOM 0 HG3 GLN A 118 12.671 -0.757 -26.610 1.00 0.00 H new ATOM 0 HE21 GLN A 118 12.273 -2.702 -28.720 1.00 0.00 H new ATOM 0 HE22 GLN A 118 13.506 -3.950 -28.512 1.00 0.00 H new ATOM 1775 N VAL A 119 11.565 -0.759 -22.023 1.00 0.00 N ATOM 1776 CA VAL A 119 11.433 -1.068 -20.602 1.00 0.00 C ATOM 1777 C VAL A 119 10.392 -0.147 -19.972 1.00 0.00 C ATOM 1778 O VAL A 119 9.564 -0.636 -19.209 1.00 0.00 O ATOM 1779 CB VAL A 119 12.799 -0.976 -19.907 1.00 0.00 C ATOM 1780 CG1 VAL A 119 12.657 -1.257 -18.408 1.00 0.00 C ATOM 1781 CG2 VAL A 119 13.766 -2.027 -20.459 1.00 0.00 C ATOM 0 H VAL A 119 12.458 -0.336 -22.276 1.00 0.00 H new ATOM 0 HA VAL A 119 11.084 -2.093 -20.476 1.00 0.00 H new ATOM 0 HB VAL A 119 13.179 0.030 -20.086 1.00 0.00 H new ATOM 0 HG11 VAL A 119 13.634 -1.188 -17.931 1.00 0.00 H new ATOM 0 HG12 VAL A 119 11.983 -0.525 -17.963 1.00 0.00 H new ATOM 0 HG13 VAL A 119 12.252 -2.259 -18.262 1.00 0.00 H new ATOM 0 HG21 VAL A 119 14.726 -1.941 -19.950 1.00 0.00 H new ATOM 0 HG22 VAL A 119 13.355 -3.023 -20.292 1.00 0.00 H new ATOM 0 HG23 VAL A 119 13.906 -1.867 -21.528 1.00 0.00 H new ATOM 1791 N LYS A 120 10.387 1.149 -20.304 1.00 0.00 N ATOM 1792 CA LYS A 120 9.403 2.087 -19.773 1.00 0.00 C ATOM 1793 C LYS A 120 8.014 1.547 -20.061 1.00 0.00 C ATOM 1794 O LYS A 120 7.198 1.482 -19.153 1.00 0.00 O ATOM 1795 CB LYS A 120 9.575 3.458 -20.449 1.00 0.00 C ATOM 1796 CG LYS A 120 8.655 4.531 -19.842 1.00 0.00 C ATOM 1797 CD LYS A 120 8.788 5.856 -20.610 1.00 0.00 C ATOM 1798 CE LYS A 120 7.809 6.908 -20.054 1.00 0.00 C ATOM 1799 NZ LYS A 120 7.833 8.175 -20.839 1.00 0.00 N ATOM 0 H LYS A 120 11.061 1.570 -20.943 1.00 0.00 H new ATOM 0 HA LYS A 120 9.543 2.203 -18.698 1.00 0.00 H new ATOM 0 HB2 LYS A 120 10.613 3.778 -20.356 1.00 0.00 H new ATOM 0 HB3 LYS A 120 9.365 3.364 -21.514 1.00 0.00 H new ATOM 0 HG2 LYS A 120 7.620 4.190 -19.872 1.00 0.00 H new ATOM 0 HG3 LYS A 120 8.910 4.685 -18.793 1.00 0.00 H new ATOM 0 HD2 LYS A 120 9.810 6.226 -20.532 1.00 0.00 H new ATOM 0 HD3 LYS A 120 8.589 5.690 -21.669 1.00 0.00 H new ATOM 0 HE2 LYS A 120 6.799 6.499 -20.059 1.00 0.00 H new ATOM 0 HE3 LYS A 120 8.061 7.122 -19.015 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 7.159 8.851 -20.427 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 8.790 8.581 -20.813 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 7.567 7.978 -21.825 1.00 0.00 H new ATOM 1813 N GLU A 121 7.767 1.110 -21.294 1.00 0.00 N ATOM 1814 CA GLU A 121 6.463 0.643 -21.718 1.00 0.00 C ATOM 1815 C GLU A 121 6.053 -0.630 -20.963 1.00 0.00 C ATOM 1816 O GLU A 121 4.917 -0.721 -20.501 1.00 0.00 O ATOM 1817 CB GLU A 121 6.508 0.474 -23.240 1.00 0.00 C ATOM 1818 CG GLU A 121 5.168 0.000 -23.806 1.00 0.00 C ATOM 1819 CD GLU A 121 5.182 -0.013 -25.346 1.00 0.00 C ATOM 1820 OE1 GLU A 121 5.577 -1.042 -25.947 1.00 0.00 O ATOM 1821 OE2 GLU A 121 4.779 0.999 -25.969 1.00 0.00 O ATOM 0 H GLU A 121 8.476 1.073 -22.027 1.00 0.00 H new ATOM 0 HA GLU A 121 5.686 1.367 -21.473 1.00 0.00 H new ATOM 0 HB2 GLU A 121 6.781 1.423 -23.702 1.00 0.00 H new ATOM 0 HB3 GLU A 121 7.286 -0.243 -23.502 1.00 0.00 H new ATOM 0 HG2 GLU A 121 4.948 -1.001 -23.434 1.00 0.00 H new ATOM 0 HG3 GLU A 121 4.370 0.654 -23.453 1.00 0.00 H new ATOM 1828 N ARG A 122 6.964 -1.593 -20.766 1.00 0.00 N ATOM 1829 CA ARG A 122 6.648 -2.805 -19.999 1.00 0.00 C ATOM 1830 C ARG A 122 6.367 -2.489 -18.530 1.00 0.00 C ATOM 1831 O ARG A 122 5.375 -2.966 -17.979 1.00 0.00 O ATOM 1832 CB ARG A 122 7.744 -3.868 -20.144 1.00 0.00 C ATOM 1833 CG ARG A 122 7.809 -4.410 -21.585 1.00 0.00 C ATOM 1834 CD ARG A 122 8.272 -5.864 -21.571 1.00 0.00 C ATOM 1835 NE ARG A 122 8.405 -6.398 -22.941 1.00 0.00 N ATOM 1836 CZ ARG A 122 7.515 -7.151 -23.608 1.00 0.00 C ATOM 1837 NH1 ARG A 122 6.376 -7.533 -23.036 1.00 0.00 N ATOM 1838 NH2 ARG A 122 7.773 -7.517 -24.860 1.00 0.00 N ATOM 0 H ARG A 122 7.918 -1.557 -21.124 1.00 0.00 H new ATOM 0 HA ARG A 122 5.733 -3.221 -20.421 1.00 0.00 H new ATOM 0 HB2 ARG A 122 8.708 -3.439 -19.870 1.00 0.00 H new ATOM 0 HB3 ARG A 122 7.552 -4.688 -19.453 1.00 0.00 H new ATOM 0 HG2 ARG A 122 6.829 -4.336 -22.056 1.00 0.00 H new ATOM 0 HG3 ARG A 122 8.495 -3.806 -22.180 1.00 0.00 H new ATOM 0 HD2 ARG A 122 9.229 -5.938 -21.055 1.00 0.00 H new ATOM 0 HD3 ARG A 122 7.560 -6.469 -21.010 1.00 0.00 H new ATOM 0 HE ARG A 122 9.268 -6.170 -23.435 1.00 0.00 H new ATOM 0 HH11 ARG A 122 6.168 -7.254 -22.077 1.00 0.00 H new ATOM 0 HH12 ARG A 122 5.711 -8.105 -23.556 1.00 0.00 H new ATOM 0 HH21 ARG A 122 8.642 -7.226 -25.308 1.00 0.00 H new ATOM 0 HH22 ARG A 122 7.102 -8.089 -25.373 1.00 0.00 H new ATOM 1852 N VAL A 123 7.198 -1.662 -17.902 1.00 0.00 N ATOM 1853 CA VAL A 123 6.996 -1.264 -16.513 1.00 0.00 C ATOM 1854 C VAL A 123 5.693 -0.443 -16.406 1.00 0.00 C ATOM 1855 O VAL A 123 4.940 -0.625 -15.451 1.00 0.00 O ATOM 1856 CB VAL A 123 8.251 -0.545 -15.998 1.00 0.00 C ATOM 1857 CG1 VAL A 123 8.108 -0.101 -14.540 1.00 0.00 C ATOM 1858 CG2 VAL A 123 9.518 -1.421 -16.059 1.00 0.00 C ATOM 0 H VAL A 123 8.024 -1.252 -18.338 1.00 0.00 H new ATOM 0 HA VAL A 123 6.863 -2.128 -15.862 1.00 0.00 H new ATOM 0 HB VAL A 123 8.353 0.313 -16.662 1.00 0.00 H new ATOM 0 HG11 VAL A 123 9.021 0.402 -14.222 1.00 0.00 H new ATOM 0 HG12 VAL A 123 7.265 0.584 -14.449 1.00 0.00 H new ATOM 0 HG13 VAL A 123 7.936 -0.973 -13.909 1.00 0.00 H new ATOM 0 HG21 VAL A 123 10.370 -0.855 -15.681 1.00 0.00 H new ATOM 0 HG22 VAL A 123 9.374 -2.312 -15.448 1.00 0.00 H new ATOM 0 HG23 VAL A 123 9.707 -1.716 -17.091 1.00 0.00 H new ATOM 1868 N GLU A 124 5.361 0.404 -17.387 1.00 0.00 N ATOM 1869 CA GLU A 124 4.098 1.139 -17.421 1.00 0.00 C ATOM 1870 C GLU A 124 2.930 0.160 -17.459 1.00 0.00 C ATOM 1871 O GLU A 124 1.973 0.332 -16.713 1.00 0.00 O ATOM 1872 CB GLU A 124 3.994 2.092 -18.631 1.00 0.00 C ATOM 1873 CG GLU A 124 4.601 3.478 -18.403 1.00 0.00 C ATOM 1874 CD GLU A 124 4.220 4.443 -19.543 1.00 0.00 C ATOM 1875 OE1 GLU A 124 4.806 4.356 -20.648 1.00 0.00 O ATOM 1876 OE2 GLU A 124 3.334 5.308 -19.336 1.00 0.00 O ATOM 0 H GLU A 124 5.968 0.598 -18.184 1.00 0.00 H new ATOM 0 HA GLU A 124 4.063 1.747 -16.517 1.00 0.00 H new ATOM 0 HB2 GLU A 124 4.488 1.629 -19.485 1.00 0.00 H new ATOM 0 HB3 GLU A 124 2.943 2.209 -18.896 1.00 0.00 H new ATOM 0 HG2 GLU A 124 4.253 3.879 -17.451 1.00 0.00 H new ATOM 0 HG3 GLU A 124 5.686 3.397 -18.338 1.00 0.00 H new ATOM 1883 N ASN A 125 3.017 -0.879 -18.288 1.00 0.00 N ATOM 1884 CA ASN A 125 1.950 -1.859 -18.448 1.00 0.00 C ATOM 1885 C ASN A 125 1.729 -2.648 -17.154 1.00 0.00 C ATOM 1886 O ASN A 125 0.584 -2.863 -16.759 1.00 0.00 O ATOM 1887 CB ASN A 125 2.261 -2.798 -19.621 1.00 0.00 C ATOM 1888 CG ASN A 125 1.130 -3.798 -19.834 1.00 0.00 C ATOM 1889 OD1 ASN A 125 1.229 -4.955 -19.438 1.00 0.00 O ATOM 1890 ND2 ASN A 125 0.033 -3.382 -20.449 1.00 0.00 N ATOM 0 H ASN A 125 3.835 -1.063 -18.869 1.00 0.00 H new ATOM 0 HA ASN A 125 1.025 -1.327 -18.671 1.00 0.00 H new ATOM 0 HB2 ASN A 125 2.411 -2.214 -20.529 1.00 0.00 H new ATOM 0 HB3 ASN A 125 3.192 -3.332 -19.428 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -0.743 -4.026 -20.599 1.00 0.00 H new ATOM 0 HD22 ASN A 125 -0.035 -2.417 -20.773 1.00 0.00 H new ATOM 1897 N LEU A 126 2.809 -3.020 -16.464 1.00 0.00 N ATOM 1898 CA LEU A 126 2.782 -3.649 -15.152 1.00 0.00 C ATOM 1899 C LEU A 126 2.071 -2.755 -14.134 1.00 0.00 C ATOM 1900 O LEU A 126 1.188 -3.216 -13.419 1.00 0.00 O ATOM 1901 CB LEU A 126 4.243 -3.911 -14.737 1.00 0.00 C ATOM 1902 CG LEU A 126 4.436 -4.294 -13.261 1.00 0.00 C ATOM 1903 CD1 LEU A 126 3.771 -5.641 -12.976 1.00 0.00 C ATOM 1904 CD2 LEU A 126 5.926 -4.334 -12.925 1.00 0.00 C ATOM 0 H LEU A 126 3.756 -2.885 -16.819 1.00 0.00 H new ATOM 0 HA LEU A 126 2.226 -4.586 -15.189 1.00 0.00 H new ATOM 0 HB2 LEU A 126 4.645 -4.710 -15.360 1.00 0.00 H new ATOM 0 HB3 LEU A 126 4.831 -3.017 -14.946 1.00 0.00 H new ATOM 0 HG LEU A 126 3.963 -3.543 -12.629 1.00 0.00 H new ATOM 0 HD11 LEU A 126 3.914 -5.903 -11.928 1.00 0.00 H new ATOM 0 HD12 LEU A 126 2.705 -5.573 -13.191 1.00 0.00 H new ATOM 0 HD13 LEU A 126 4.220 -6.409 -13.606 1.00 0.00 H new ATOM 0 HD21 LEU A 126 6.056 -4.606 -11.877 1.00 0.00 H new ATOM 0 HD22 LEU A 126 6.421 -5.072 -13.556 1.00 0.00 H new ATOM 0 HD23 LEU A 126 6.365 -3.352 -13.102 1.00 0.00 H new ATOM 1916 N ILE A 127 2.445 -1.481 -14.063 1.00 0.00 N ATOM 1917 CA ILE A 127 1.880 -0.534 -13.109 1.00 0.00 C ATOM 1918 C ILE A 127 0.402 -0.354 -13.445 1.00 0.00 C ATOM 1919 O ILE A 127 -0.435 -0.460 -12.557 1.00 0.00 O ATOM 1920 CB ILE A 127 2.705 0.762 -13.209 1.00 0.00 C ATOM 1921 CG1 ILE A 127 4.067 0.481 -12.546 1.00 0.00 C ATOM 1922 CG2 ILE A 127 2.012 1.954 -12.536 1.00 0.00 C ATOM 1923 CD1 ILE A 127 5.121 1.538 -12.832 1.00 0.00 C ATOM 0 H ILE A 127 3.155 -1.074 -14.672 1.00 0.00 H new ATOM 0 HA ILE A 127 1.929 -0.876 -12.075 1.00 0.00 H new ATOM 0 HB ILE A 127 2.821 1.039 -14.257 1.00 0.00 H new ATOM 0 HG12 ILE A 127 3.926 0.405 -11.468 1.00 0.00 H new ATOM 0 HG13 ILE A 127 4.434 -0.486 -12.889 1.00 0.00 H new ATOM 0 HG21 ILE A 127 2.637 2.842 -12.636 1.00 0.00 H new ATOM 0 HG22 ILE A 127 1.049 2.132 -13.014 1.00 0.00 H new ATOM 0 HG23 ILE A 127 1.858 1.736 -11.479 1.00 0.00 H new ATOM 0 HD11 ILE A 127 6.051 1.269 -12.331 1.00 0.00 H new ATOM 0 HD12 ILE A 127 5.292 1.600 -13.907 1.00 0.00 H new ATOM 0 HD13 ILE A 127 4.777 2.504 -12.464 1.00 0.00 H new ATOM 1935 N ALA A 128 0.072 -0.154 -14.722 1.00 0.00 N ATOM 1936 CA ALA A 128 -1.294 0.055 -15.173 1.00 0.00 C ATOM 1937 C ALA A 128 -2.212 -1.117 -14.798 1.00 0.00 C ATOM 1938 O ALA A 128 -3.401 -0.886 -14.554 1.00 0.00 O ATOM 1939 CB ALA A 128 -1.298 0.286 -16.687 1.00 0.00 C ATOM 0 H ALA A 128 0.758 -0.133 -15.477 1.00 0.00 H new ATOM 0 HA ALA A 128 -1.689 0.936 -14.667 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -2.321 0.443 -17.028 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -0.698 1.165 -16.923 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -0.878 -0.585 -17.189 1.00 0.00 H new ATOM 1945 N LYS A 129 -1.702 -2.359 -14.741 1.00 0.00 N ATOM 1946 CA LYS A 129 -2.511 -3.502 -14.330 1.00 0.00 C ATOM 1947 C LYS A 129 -2.607 -3.635 -12.809 1.00 0.00 C ATOM 1948 O LYS A 129 -3.690 -3.982 -12.329 1.00 0.00 O ATOM 1949 CB LYS A 129 -2.149 -4.800 -15.082 1.00 0.00 C ATOM 1950 CG LYS A 129 -0.755 -5.365 -14.775 1.00 0.00 C ATOM 1951 CD LYS A 129 -0.375 -6.616 -15.584 1.00 0.00 C ATOM 1952 CE LYS A 129 -0.259 -6.341 -17.090 1.00 0.00 C ATOM 1953 NZ LYS A 129 0.267 -7.514 -17.840 1.00 0.00 N ATOM 0 H LYS A 129 -0.736 -2.589 -14.975 1.00 0.00 H new ATOM 0 HA LYS A 129 -3.534 -3.298 -14.647 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -2.893 -5.560 -14.842 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -2.220 -4.612 -16.153 1.00 0.00 H new ATOM 0 HG2 LYS A 129 -0.014 -4.588 -14.964 1.00 0.00 H new ATOM 0 HG3 LYS A 129 -0.701 -5.606 -13.713 1.00 0.00 H new ATOM 0 HD2 LYS A 129 0.574 -7.005 -15.217 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -1.123 -7.391 -15.418 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -1.239 -6.070 -17.484 1.00 0.00 H new ATOM 0 HE3 LYS A 129 0.397 -5.486 -17.251 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 0.376 -7.264 -18.844 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 1.191 -7.790 -17.450 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -0.397 -8.309 -17.751 1.00 0.00 H new ATOM 1967 N ILE A 130 -1.545 -3.363 -12.036 1.00 0.00 N ATOM 1968 CA ILE A 130 -1.589 -3.560 -10.592 1.00 0.00 C ATOM 1969 C ILE A 130 -2.199 -2.383 -9.821 1.00 0.00 C ATOM 1970 O ILE A 130 -2.904 -2.606 -8.831 1.00 0.00 O ATOM 1971 CB ILE A 130 -0.226 -3.997 -10.033 1.00 0.00 C ATOM 1972 CG1 ILE A 130 0.819 -2.867 -10.063 1.00 0.00 C ATOM 1973 CG2 ILE A 130 0.247 -5.288 -10.726 1.00 0.00 C ATOM 1974 CD1 ILE A 130 2.216 -3.297 -9.624 1.00 0.00 C ATOM 0 H ILE A 130 -0.656 -3.009 -12.389 1.00 0.00 H new ATOM 0 HA ILE A 130 -2.282 -4.385 -10.427 1.00 0.00 H new ATOM 0 HB ILE A 130 -0.352 -4.226 -8.975 1.00 0.00 H new ATOM 0 HG12 ILE A 130 0.875 -2.466 -11.075 1.00 0.00 H new ATOM 0 HG13 ILE A 130 0.480 -2.057 -9.417 1.00 0.00 H new ATOM 0 HG21 ILE A 130 1.214 -5.586 -10.320 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -0.480 -6.082 -10.552 1.00 0.00 H new ATOM 0 HG23 ILE A 130 0.342 -5.112 -11.797 1.00 0.00 H new ATOM 0 HD11 ILE A 130 2.892 -2.443 -9.674 1.00 0.00 H new ATOM 0 HD12 ILE A 130 2.177 -3.670 -8.600 1.00 0.00 H new ATOM 0 HD13 ILE A 130 2.578 -4.085 -10.284 1.00 0.00 H new ATOM 1986 N SER A 131 -1.911 -1.152 -10.236 1.00 0.00 N ATOM 1987 CA SER A 131 -2.217 0.071 -9.525 1.00 0.00 C ATOM 1988 C SER A 131 -3.557 0.631 -9.995 1.00 0.00 C ATOM 1989 O SER A 131 -4.476 0.751 -9.153 1.00 0.00 O ATOM 1990 CB SER A 131 -1.058 1.054 -9.680 1.00 0.00 C ATOM 1991 OG SER A 131 0.107 0.498 -9.077 1.00 0.00 O ATOM 1992 OXT SER A 131 -3.704 0.936 -11.202 1.00 0.00 O ATOM 0 H SER A 131 -1.435 -0.980 -11.121 1.00 0.00 H new ATOM 0 HA SER A 131 -2.326 -0.125 -8.458 1.00 0.00 H new ATOM 0 HB2 SER A 131 -0.875 1.257 -10.735 1.00 0.00 H new ATOM 0 HB3 SER A 131 -1.307 2.006 -9.211 1.00 0.00 H new ATOM 0 HG SER A 131 0.856 1.123 -9.174 1.00 0.00 H new TER 1998 SER A 131