USER MOD reduce.3.24.130724 H: found=0, std=0, add=993, rem=0, adj=30 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 33 THR OG1 : rot 163:sc= 1.17 USER MOD Set 1.2: A 73 TYR OH : rot 30:sc= 0.994 USER MOD Set 2.1: A 16 GLN : amide:sc= -0.512 K(o=-1.8,f=-11!) USER MOD Set 2.2: A 50 MET CE :methyl 146:sc= -1.32 (180deg=-2.14!) USER MOD Set 3.1: A 13 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 43 HIS : no HE2:sc= 0.245 K(o=0.24,f=-1.2) USER MOD Single : A 1 MET CE :methyl 162:sc= 0 (180deg=-0.374) USER MOD Single : A 1 MET N :NH3+ 135:sc= 0.0456 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ -175:sc= 1.31 (180deg=1.26) USER MOD Single : A 5 MET CE :methyl -173:sc= -1.03 (180deg=-1.28) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 ASN : amide:sc= 1.21 K(o=1.2,f=-0.24) USER MOD Single : A 12 SER OG : rot 180:sc= 0.0464 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 17 MET CE :methyl -111:sc= -1.33 (180deg=-5.2!) USER MOD Single : A 23 LYS NZ :NH3+ 154:sc= 1.11 (180deg=0.665) USER MOD Single : A 24 THR OG1 : rot 94:sc= 0.377 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 SER OG : rot 150:sc= 0.059 USER MOD Single : A 35 SER OG : rot -126:sc= 1.37 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot -170:sc= 0.961 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 58 SER OG : rot 180:sc= -0.414 USER MOD Single : A 60 GLN : amide:sc= -0.345 K(o=-0.34,f=-2.3) USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot 161:sc= 1.3 USER MOD Single : A 67 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 69 ASN : amide:sc= 0.274 K(o=0.27,f=-8.4!) USER MOD Single : A 78 SER OG : rot 117:sc= 0.355 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= -0.0405 K(o=-0.041,f=-0.95) USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 GLN : amide:sc= 0.402 K(o=0.4,f=-0.48) USER MOD Single : A 100 GLN : amide:sc= 0 K(o=0,f=-0.52) USER MOD Single : A 107 GLN : amide:sc= 0.999 K(o=1,f=-0.32) USER MOD Single : A 108 SER OG : rot 180:sc= 0.0025 USER MOD Single : A 114 THR OG1 : rot 86:sc= 0.683 USER MOD Single : A 118 GLN : amide:sc= 1.24 K(o=1.2,f=-0.022) USER MOD Single : A 120 LYS NZ :NH3+ -173:sc= 1.28 (180deg=1.2) USER MOD Single : A 125 ASN : amide:sc= -0.488 K(o=-0.49,f=-3.3!) USER MOD Single : A 129 LYS NZ :NH3+ -172:sc= 1.2 (180deg=1.17) USER MOD Single : A 131 SER OG : rot 180:sc= -0.0306 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.575 -0.472 0.939 1.00 0.00 N ATOM 2 CA MET A 1 1.924 -0.202 -0.492 1.00 0.00 C ATOM 3 C MET A 1 2.490 -1.469 -1.167 1.00 0.00 C ATOM 4 O MET A 1 3.117 -2.295 -0.501 1.00 0.00 O ATOM 5 CB MET A 1 2.827 1.057 -0.652 1.00 0.00 C ATOM 6 CG MET A 1 4.290 0.929 -0.184 1.00 0.00 C ATOM 7 SD MET A 1 5.149 2.517 0.070 1.00 0.00 S ATOM 8 CE MET A 1 5.388 3.101 -1.631 1.00 0.00 C ATOM 0 H1 MET A 1 1.924 0.306 1.534 1.00 0.00 H new ATOM 0 H2 MET A 1 0.542 -0.546 1.036 1.00 0.00 H new ATOM 0 H3 MET A 1 2.016 -1.364 1.242 1.00 0.00 H new ATOM 0 HA MET A 1 1.007 0.046 -1.026 1.00 0.00 H new ATOM 0 HB2 MET A 1 2.831 1.340 -1.705 1.00 0.00 H new ATOM 0 HB3 MET A 1 2.366 1.878 -0.103 1.00 0.00 H new ATOM 0 HG2 MET A 1 4.311 0.367 0.749 1.00 0.00 H new ATOM 0 HG3 MET A 1 4.843 0.346 -0.920 1.00 0.00 H new ATOM 0 HE1 MET A 1 5.599 4.170 -1.622 1.00 0.00 H new ATOM 0 HE2 MET A 1 6.225 2.569 -2.084 1.00 0.00 H new ATOM 0 HE3 MET A 1 4.484 2.915 -2.210 1.00 0.00 H new ATOM 18 N LYS A 2 2.268 -1.655 -2.480 1.00 0.00 N ATOM 19 CA LYS A 2 2.619 -2.915 -3.176 1.00 0.00 C ATOM 20 C LYS A 2 4.129 -2.958 -3.329 1.00 0.00 C ATOM 21 O LYS A 2 4.679 -2.004 -3.870 1.00 0.00 O ATOM 22 CB LYS A 2 1.888 -3.096 -4.532 1.00 0.00 C ATOM 23 CG LYS A 2 0.485 -2.464 -4.576 1.00 0.00 C ATOM 24 CD LYS A 2 -0.134 -2.531 -5.977 1.00 0.00 C ATOM 25 CE LYS A 2 -1.298 -1.533 -6.115 1.00 0.00 C ATOM 26 NZ LYS A 2 -2.554 -1.993 -5.456 1.00 0.00 N ATOM 0 H LYS A 2 1.847 -0.950 -3.085 1.00 0.00 H new ATOM 0 HA LYS A 2 2.277 -3.757 -2.573 1.00 0.00 H new ATOM 0 HB2 LYS A 2 2.497 -2.658 -5.323 1.00 0.00 H new ATOM 0 HB3 LYS A 2 1.803 -4.161 -4.748 1.00 0.00 H new ATOM 0 HG2 LYS A 2 -0.166 -2.977 -3.868 1.00 0.00 H new ATOM 0 HG3 LYS A 2 0.546 -1.424 -4.257 1.00 0.00 H new ATOM 0 HD2 LYS A 2 0.628 -2.312 -6.726 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -0.492 -3.542 -6.172 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -1.000 -0.577 -5.685 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -1.494 -1.359 -7.173 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -3.297 -1.277 -5.586 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -2.861 -2.891 -5.882 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -2.382 -2.133 -4.440 1.00 0.00 H new ATOM 40 N LYS A 3 4.816 -4.012 -2.885 1.00 0.00 N ATOM 41 CA LYS A 3 6.256 -4.129 -3.139 1.00 0.00 C ATOM 42 C LYS A 3 6.454 -4.951 -4.396 1.00 0.00 C ATOM 43 O LYS A 3 5.783 -5.969 -4.579 1.00 0.00 O ATOM 44 CB LYS A 3 7.059 -4.678 -1.951 1.00 0.00 C ATOM 45 CG LYS A 3 6.650 -4.117 -0.583 1.00 0.00 C ATOM 46 CD LYS A 3 7.563 -4.682 0.509 1.00 0.00 C ATOM 47 CE LYS A 3 7.120 -4.113 1.860 1.00 0.00 C ATOM 48 NZ LYS A 3 7.909 -4.683 2.982 1.00 0.00 N ATOM 0 H LYS A 3 4.410 -4.784 -2.357 1.00 0.00 H new ATOM 0 HA LYS A 3 6.657 -3.126 -3.282 1.00 0.00 H new ATOM 0 HB2 LYS A 3 6.953 -5.763 -1.929 1.00 0.00 H new ATOM 0 HB3 LYS A 3 8.115 -4.464 -2.115 1.00 0.00 H new ATOM 0 HG2 LYS A 3 6.712 -3.029 -0.594 1.00 0.00 H new ATOM 0 HG3 LYS A 3 5.612 -4.375 -0.370 1.00 0.00 H new ATOM 0 HD2 LYS A 3 7.509 -5.771 0.521 1.00 0.00 H new ATOM 0 HD3 LYS A 3 8.601 -4.416 0.309 1.00 0.00 H new ATOM 0 HE2 LYS A 3 7.230 -3.029 1.852 1.00 0.00 H new ATOM 0 HE3 LYS A 3 6.062 -4.325 2.015 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 7.526 -4.340 3.886 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 7.852 -5.721 2.954 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 8.902 -4.388 2.893 1.00 0.00 H new ATOM 62 N VAL A 4 7.374 -4.495 -5.228 1.00 0.00 N ATOM 63 CA VAL A 4 7.634 -4.950 -6.579 1.00 0.00 C ATOM 64 C VAL A 4 9.075 -5.451 -6.597 1.00 0.00 C ATOM 65 O VAL A 4 9.931 -4.950 -5.863 1.00 0.00 O ATOM 66 CB VAL A 4 7.456 -3.771 -7.565 1.00 0.00 C ATOM 67 CG1 VAL A 4 7.457 -4.201 -9.036 1.00 0.00 C ATOM 68 CG2 VAL A 4 6.190 -2.922 -7.375 1.00 0.00 C ATOM 0 H VAL A 4 8.004 -3.741 -4.955 1.00 0.00 H new ATOM 0 HA VAL A 4 6.946 -5.741 -6.879 1.00 0.00 H new ATOM 0 HB VAL A 4 8.330 -3.167 -7.320 1.00 0.00 H new ATOM 0 HG11 VAL A 4 7.328 -3.325 -9.671 1.00 0.00 H new ATOM 0 HG12 VAL A 4 8.405 -4.685 -9.273 1.00 0.00 H new ATOM 0 HG13 VAL A 4 6.639 -4.900 -9.211 1.00 0.00 H new ATOM 0 HG21 VAL A 4 6.170 -2.126 -8.120 1.00 0.00 H new ATOM 0 HG22 VAL A 4 5.308 -3.552 -7.493 1.00 0.00 H new ATOM 0 HG23 VAL A 4 6.192 -2.484 -6.377 1.00 0.00 H new ATOM 78 N MET A 5 9.359 -6.404 -7.467 1.00 0.00 N ATOM 79 CA MET A 5 10.708 -6.838 -7.791 1.00 0.00 C ATOM 80 C MET A 5 10.830 -6.963 -9.297 1.00 0.00 C ATOM 81 O MET A 5 9.863 -7.350 -9.948 1.00 0.00 O ATOM 82 CB MET A 5 11.070 -8.178 -7.139 1.00 0.00 C ATOM 83 CG MET A 5 11.050 -8.172 -5.614 1.00 0.00 C ATOM 84 SD MET A 5 12.051 -9.525 -4.959 1.00 0.00 S ATOM 85 CE MET A 5 12.009 -9.126 -3.205 1.00 0.00 C ATOM 0 H MET A 5 8.639 -6.911 -7.982 1.00 0.00 H new ATOM 0 HA MET A 5 11.401 -6.093 -7.400 1.00 0.00 H new ATOM 0 HB2 MET A 5 10.375 -8.939 -7.495 1.00 0.00 H new ATOM 0 HB3 MET A 5 12.064 -8.473 -7.474 1.00 0.00 H new ATOM 0 HG2 MET A 5 11.430 -7.220 -5.244 1.00 0.00 H new ATOM 0 HG3 MET A 5 10.024 -8.266 -5.258 1.00 0.00 H new ATOM 0 HE1 MET A 5 12.682 -9.791 -2.664 1.00 0.00 H new ATOM 0 HE2 MET A 5 12.325 -8.093 -3.059 1.00 0.00 H new ATOM 0 HE3 MET A 5 10.994 -9.251 -2.828 1.00 0.00 H new ATOM 95 N PHE A 6 12.017 -6.684 -9.825 1.00 0.00 N ATOM 96 CA PHE A 6 12.412 -6.949 -11.198 1.00 0.00 C ATOM 97 C PHE A 6 13.757 -7.626 -11.020 1.00 0.00 C ATOM 98 O PHE A 6 14.623 -7.051 -10.358 1.00 0.00 O ATOM 99 CB PHE A 6 12.515 -5.675 -12.050 1.00 0.00 C ATOM 100 CG PHE A 6 11.266 -4.821 -12.134 1.00 0.00 C ATOM 101 CD1 PHE A 6 10.921 -3.982 -11.060 1.00 0.00 C ATOM 102 CD2 PHE A 6 10.471 -4.817 -13.297 1.00 0.00 C ATOM 103 CE1 PHE A 6 9.782 -3.169 -11.136 1.00 0.00 C ATOM 104 CE2 PHE A 6 9.334 -3.997 -13.377 1.00 0.00 C ATOM 105 CZ PHE A 6 8.985 -3.176 -12.292 1.00 0.00 C ATOM 0 H PHE A 6 12.761 -6.248 -9.281 1.00 0.00 H new ATOM 0 HA PHE A 6 11.684 -7.552 -11.740 1.00 0.00 H new ATOM 0 HB2 PHE A 6 13.323 -5.061 -11.652 1.00 0.00 H new ATOM 0 HB3 PHE A 6 12.802 -5.962 -13.062 1.00 0.00 H new ATOM 0 HD1 PHE A 6 11.536 -3.964 -10.173 1.00 0.00 H new ATOM 0 HD2 PHE A 6 10.738 -5.448 -14.132 1.00 0.00 H new ATOM 0 HE1 PHE A 6 9.516 -2.535 -10.303 1.00 0.00 H new ATOM 0 HE2 PHE A 6 8.729 -3.998 -14.271 1.00 0.00 H new ATOM 0 HZ PHE A 6 8.106 -2.552 -12.347 1.00 0.00 H new ATOM 115 N VAL A 7 13.927 -8.841 -11.535 1.00 0.00 N ATOM 116 CA VAL A 7 15.093 -9.636 -11.186 1.00 0.00 C ATOM 117 C VAL A 7 15.533 -10.545 -12.330 1.00 0.00 C ATOM 118 O VAL A 7 14.718 -11.101 -13.066 1.00 0.00 O ATOM 119 CB VAL A 7 14.793 -10.378 -9.853 1.00 0.00 C ATOM 120 CG1 VAL A 7 13.368 -10.957 -9.742 1.00 0.00 C ATOM 121 CG2 VAL A 7 15.793 -11.500 -9.531 1.00 0.00 C ATOM 0 H VAL A 7 13.281 -9.288 -12.185 1.00 0.00 H new ATOM 0 HA VAL A 7 15.958 -8.992 -11.024 1.00 0.00 H new ATOM 0 HB VAL A 7 14.896 -9.578 -9.120 1.00 0.00 H new ATOM 0 HG11 VAL A 7 13.252 -11.456 -8.780 1.00 0.00 H new ATOM 0 HG12 VAL A 7 12.640 -10.150 -9.823 1.00 0.00 H new ATOM 0 HG13 VAL A 7 13.204 -11.675 -10.545 1.00 0.00 H new ATOM 0 HG21 VAL A 7 15.519 -11.971 -8.587 1.00 0.00 H new ATOM 0 HG22 VAL A 7 15.774 -12.244 -10.327 1.00 0.00 H new ATOM 0 HG23 VAL A 7 16.796 -11.081 -9.450 1.00 0.00 H new ATOM 131 N CYS A 8 16.849 -10.669 -12.473 1.00 0.00 N ATOM 132 CA CYS A 8 17.572 -11.619 -13.312 1.00 0.00 C ATOM 133 C CYS A 8 18.732 -12.140 -12.431 1.00 0.00 C ATOM 134 O CYS A 8 18.912 -11.653 -11.311 1.00 0.00 O ATOM 135 CB CYS A 8 17.997 -10.920 -14.619 1.00 0.00 C ATOM 136 SG CYS A 8 18.849 -11.959 -15.849 1.00 0.00 S ATOM 0 H CYS A 8 17.489 -10.059 -11.964 1.00 0.00 H new ATOM 0 HA CYS A 8 16.982 -12.474 -13.643 1.00 0.00 H new ATOM 0 HB2 CYS A 8 17.107 -10.497 -15.086 1.00 0.00 H new ATOM 0 HB3 CYS A 8 18.651 -10.086 -14.364 1.00 0.00 H new ATOM 141 N LYS A 9 19.512 -13.131 -12.886 1.00 0.00 N ATOM 142 CA LYS A 9 20.489 -13.846 -12.043 1.00 0.00 C ATOM 143 C LYS A 9 21.438 -12.913 -11.286 1.00 0.00 C ATOM 144 O LYS A 9 21.629 -13.108 -10.086 1.00 0.00 O ATOM 145 CB LYS A 9 21.260 -14.866 -12.904 1.00 0.00 C ATOM 146 CG LYS A 9 22.186 -15.768 -12.069 1.00 0.00 C ATOM 147 CD LYS A 9 22.901 -16.799 -12.952 1.00 0.00 C ATOM 148 CE LYS A 9 23.839 -17.665 -12.095 1.00 0.00 C ATOM 149 NZ LYS A 9 24.579 -18.671 -12.904 1.00 0.00 N ATOM 0 H LYS A 9 19.485 -13.462 -13.850 1.00 0.00 H new ATOM 0 HA LYS A 9 19.931 -14.373 -11.269 1.00 0.00 H new ATOM 0 HB2 LYS A 9 20.549 -15.487 -13.448 1.00 0.00 H new ATOM 0 HB3 LYS A 9 21.852 -14.333 -13.648 1.00 0.00 H new ATOM 0 HG2 LYS A 9 22.924 -15.155 -11.551 1.00 0.00 H new ATOM 0 HG3 LYS A 9 21.604 -16.282 -11.304 1.00 0.00 H new ATOM 0 HD2 LYS A 9 22.168 -17.430 -13.455 1.00 0.00 H new ATOM 0 HD3 LYS A 9 23.471 -16.291 -13.730 1.00 0.00 H new ATOM 0 HE2 LYS A 9 24.552 -17.022 -11.579 1.00 0.00 H new ATOM 0 HE3 LYS A 9 23.257 -18.176 -11.328 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 25.198 -19.230 -12.282 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 23.901 -19.303 -13.377 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 25.156 -18.185 -13.620 1.00 0.00 H new ATOM 163 N ARG A 10 22.024 -11.912 -11.946 1.00 0.00 N ATOM 164 CA ARG A 10 22.976 -10.986 -11.320 1.00 0.00 C ATOM 165 C ARG A 10 22.561 -9.550 -11.639 1.00 0.00 C ATOM 166 O ARG A 10 22.044 -9.298 -12.724 1.00 0.00 O ATOM 167 CB ARG A 10 24.405 -11.344 -11.780 1.00 0.00 C ATOM 168 CG ARG A 10 25.504 -10.683 -10.929 1.00 0.00 C ATOM 169 CD ARG A 10 26.885 -11.295 -11.200 1.00 0.00 C ATOM 170 NE ARG A 10 27.900 -10.733 -10.286 1.00 0.00 N ATOM 171 CZ ARG A 10 28.840 -11.390 -9.587 1.00 0.00 C ATOM 172 NH1 ARG A 10 28.943 -12.716 -9.602 1.00 0.00 N ATOM 173 NH2 ARG A 10 29.690 -10.681 -8.854 1.00 0.00 N ATOM 0 H ARG A 10 21.853 -11.718 -12.933 1.00 0.00 H new ATOM 0 HA ARG A 10 22.969 -11.075 -10.234 1.00 0.00 H new ATOM 0 HB2 ARG A 10 24.530 -12.426 -11.745 1.00 0.00 H new ATOM 0 HB3 ARG A 10 24.530 -11.043 -12.820 1.00 0.00 H new ATOM 0 HG2 ARG A 10 25.533 -9.614 -11.141 1.00 0.00 H new ATOM 0 HG3 ARG A 10 25.260 -10.792 -9.872 1.00 0.00 H new ATOM 0 HD2 ARG A 10 26.838 -12.377 -11.076 1.00 0.00 H new ATOM 0 HD3 ARG A 10 27.175 -11.104 -12.233 1.00 0.00 H new ATOM 0 HE ARG A 10 27.885 -9.720 -10.171 1.00 0.00 H new ATOM 0 HH11 ARG A 10 28.294 -13.272 -10.159 1.00 0.00 H new ATOM 0 HH12 ARG A 10 29.671 -13.177 -9.057 1.00 0.00 H new ATOM 0 HH21 ARG A 10 29.619 -9.664 -8.832 1.00 0.00 H new ATOM 0 HH22 ARG A 10 30.414 -11.154 -8.313 1.00 0.00 H new ATOM 187 N ASN A 11 22.815 -8.612 -10.715 1.00 0.00 N ATOM 188 CA ASN A 11 22.393 -7.203 -10.833 1.00 0.00 C ATOM 189 C ASN A 11 22.951 -6.504 -12.077 1.00 0.00 C ATOM 190 O ASN A 11 22.342 -5.556 -12.571 1.00 0.00 O ATOM 191 CB ASN A 11 22.897 -6.402 -9.617 1.00 0.00 C ATOM 192 CG ASN A 11 22.286 -4.997 -9.566 1.00 0.00 C ATOM 193 OD1 ASN A 11 21.109 -4.786 -9.838 1.00 0.00 O ATOM 194 ND2 ASN A 11 23.081 -4.021 -9.167 1.00 0.00 N ATOM 0 H ASN A 11 23.325 -8.810 -9.854 1.00 0.00 H new ATOM 0 HA ASN A 11 21.305 -7.227 -10.897 1.00 0.00 H new ATOM 0 HB2 ASN A 11 22.650 -6.939 -8.701 1.00 0.00 H new ATOM 0 HB3 ASN A 11 23.983 -6.324 -9.658 1.00 0.00 H new ATOM 0 HD21 ASN A 11 22.719 -3.071 -9.080 1.00 0.00 H new ATOM 0 HD22 ASN A 11 24.057 -4.217 -8.945 1.00 0.00 H new ATOM 201 N SER A 12 24.138 -6.917 -12.534 1.00 0.00 N ATOM 202 CA SER A 12 24.885 -6.245 -13.587 1.00 0.00 C ATOM 203 C SER A 12 24.024 -6.131 -14.849 1.00 0.00 C ATOM 204 O SER A 12 23.769 -5.019 -15.325 1.00 0.00 O ATOM 205 CB SER A 12 26.198 -7.008 -13.842 1.00 0.00 C ATOM 206 OG SER A 12 26.638 -7.677 -12.663 1.00 0.00 O ATOM 0 H SER A 12 24.610 -7.745 -12.171 1.00 0.00 H new ATOM 0 HA SER A 12 25.141 -5.230 -13.281 1.00 0.00 H new ATOM 0 HB2 SER A 12 26.052 -7.733 -14.643 1.00 0.00 H new ATOM 0 HB3 SER A 12 26.967 -6.313 -14.178 1.00 0.00 H new ATOM 0 HG SER A 12 27.472 -8.156 -12.851 1.00 0.00 H new ATOM 212 N SER A 13 23.522 -7.274 -15.326 1.00 0.00 N ATOM 213 CA SER A 13 22.750 -7.364 -16.552 1.00 0.00 C ATOM 214 C SER A 13 21.256 -7.204 -16.266 1.00 0.00 C ATOM 215 O SER A 13 20.768 -7.645 -15.225 1.00 0.00 O ATOM 216 CB SER A 13 23.038 -8.708 -17.246 1.00 0.00 C ATOM 217 OG SER A 13 24.438 -8.955 -17.327 1.00 0.00 O ATOM 0 H SER A 13 23.647 -8.172 -14.858 1.00 0.00 H new ATOM 0 HA SER A 13 23.046 -6.554 -17.218 1.00 0.00 H new ATOM 0 HB2 SER A 13 22.555 -9.515 -16.696 1.00 0.00 H new ATOM 0 HB3 SER A 13 22.608 -8.703 -18.248 1.00 0.00 H new ATOM 0 HG SER A 13 24.593 -9.815 -17.770 1.00 0.00 H new ATOM 223 N ARG A 14 20.510 -6.683 -17.246 1.00 0.00 N ATOM 224 CA ARG A 14 19.043 -6.595 -17.332 1.00 0.00 C ATOM 225 C ARG A 14 18.429 -5.644 -16.294 1.00 0.00 C ATOM 226 O ARG A 14 17.679 -4.754 -16.690 1.00 0.00 O ATOM 227 CB ARG A 14 18.394 -8.002 -17.319 1.00 0.00 C ATOM 228 CG ARG A 14 18.991 -9.034 -18.306 1.00 0.00 C ATOM 229 CD ARG A 14 18.486 -8.915 -19.752 1.00 0.00 C ATOM 230 NE ARG A 14 17.291 -9.764 -19.956 1.00 0.00 N ATOM 231 CZ ARG A 14 17.110 -10.712 -20.889 1.00 0.00 C ATOM 232 NH1 ARG A 14 18.049 -10.999 -21.787 1.00 0.00 N ATOM 233 NH2 ARG A 14 15.971 -11.397 -20.889 1.00 0.00 N ATOM 0 H ARG A 14 20.952 -6.277 -18.071 1.00 0.00 H new ATOM 0 HA ARG A 14 18.812 -6.142 -18.296 1.00 0.00 H new ATOM 0 HB2 ARG A 14 18.472 -8.407 -16.310 1.00 0.00 H new ATOM 0 HB3 ARG A 14 17.332 -7.892 -17.537 1.00 0.00 H new ATOM 0 HG2 ARG A 14 20.076 -8.929 -18.306 1.00 0.00 H new ATOM 0 HG3 ARG A 14 18.768 -10.036 -17.940 1.00 0.00 H new ATOM 0 HD2 ARG A 14 18.243 -7.876 -19.974 1.00 0.00 H new ATOM 0 HD3 ARG A 14 19.274 -9.213 -20.444 1.00 0.00 H new ATOM 0 HE ARG A 14 16.514 -9.611 -19.313 1.00 0.00 H new ATOM 0 HH11 ARG A 14 18.935 -10.493 -21.778 1.00 0.00 H new ATOM 0 HH12 ARG A 14 17.883 -11.725 -22.484 1.00 0.00 H new ATOM 0 HH21 ARG A 14 15.256 -11.198 -20.189 1.00 0.00 H new ATOM 0 HH22 ARG A 14 15.812 -12.122 -21.589 1.00 0.00 H new ATOM 247 N SER A 15 18.758 -5.759 -15.010 1.00 0.00 N ATOM 248 CA SER A 15 18.241 -4.933 -13.920 1.00 0.00 C ATOM 249 C SER A 15 18.907 -3.539 -13.894 1.00 0.00 C ATOM 250 O SER A 15 19.435 -3.107 -12.868 1.00 0.00 O ATOM 251 CB SER A 15 18.403 -5.693 -12.598 1.00 0.00 C ATOM 252 OG SER A 15 17.937 -7.034 -12.729 1.00 0.00 O ATOM 0 H SER A 15 19.422 -6.462 -14.685 1.00 0.00 H new ATOM 0 HA SER A 15 17.179 -4.744 -14.079 1.00 0.00 H new ATOM 0 HB2 SER A 15 19.451 -5.694 -12.299 1.00 0.00 H new ATOM 0 HB3 SER A 15 17.848 -5.185 -11.810 1.00 0.00 H new ATOM 0 HG SER A 15 18.050 -7.504 -11.877 1.00 0.00 H new ATOM 258 N GLN A 16 18.943 -2.857 -15.047 1.00 0.00 N ATOM 259 CA GLN A 16 19.596 -1.575 -15.265 1.00 0.00 C ATOM 260 C GLN A 16 18.624 -0.514 -15.802 1.00 0.00 C ATOM 261 O GLN A 16 19.068 0.496 -16.342 1.00 0.00 O ATOM 262 CB GLN A 16 20.827 -1.755 -16.181 1.00 0.00 C ATOM 263 CG GLN A 16 20.457 -2.129 -17.635 1.00 0.00 C ATOM 264 CD GLN A 16 21.527 -1.721 -18.650 1.00 0.00 C ATOM 265 OE1 GLN A 16 21.444 -0.646 -19.220 1.00 0.00 O ATOM 266 NE2 GLN A 16 22.540 -2.518 -18.930 1.00 0.00 N ATOM 0 H GLN A 16 18.492 -3.209 -15.891 1.00 0.00 H new ATOM 0 HA GLN A 16 19.942 -1.202 -14.301 1.00 0.00 H new ATOM 0 HB2 GLN A 16 21.405 -0.831 -16.187 1.00 0.00 H new ATOM 0 HB3 GLN A 16 21.470 -2.531 -15.766 1.00 0.00 H new ATOM 0 HG2 GLN A 16 20.297 -3.205 -17.698 1.00 0.00 H new ATOM 0 HG3 GLN A 16 19.514 -1.651 -17.898 1.00 0.00 H new ATOM 0 HE21 GLN A 16 22.624 -3.420 -18.462 1.00 0.00 H new ATOM 0 HE22 GLN A 16 23.240 -2.232 -19.615 1.00 0.00 H new ATOM 275 N MET A 17 17.317 -0.760 -15.765 1.00 0.00 N ATOM 276 CA MET A 17 16.316 0.214 -16.192 1.00 0.00 C ATOM 277 C MET A 17 14.916 -0.063 -15.659 1.00 0.00 C ATOM 278 O MET A 17 14.227 0.896 -15.337 1.00 0.00 O ATOM 279 CB MET A 17 16.263 0.271 -17.730 1.00 0.00 C ATOM 280 CG MET A 17 16.660 1.645 -18.250 1.00 0.00 C ATOM 281 SD MET A 17 15.559 3.051 -17.965 1.00 0.00 S ATOM 282 CE MET A 17 16.099 3.677 -16.349 1.00 0.00 C ATOM 0 H MET A 17 16.921 -1.641 -15.438 1.00 0.00 H new ATOM 0 HA MET A 17 16.631 1.169 -15.772 1.00 0.00 H new ATOM 0 HB2 MET A 17 16.930 -0.484 -18.147 1.00 0.00 H new ATOM 0 HB3 MET A 17 15.256 0.029 -18.070 1.00 0.00 H new ATOM 0 HG2 MET A 17 17.628 1.893 -17.814 1.00 0.00 H new ATOM 0 HG3 MET A 17 16.808 1.558 -19.326 1.00 0.00 H new ATOM 0 HE1 MET A 17 15.323 3.487 -15.607 1.00 0.00 H new ATOM 0 HE2 MET A 17 17.018 3.171 -16.051 1.00 0.00 H new ATOM 0 HE3 MET A 17 16.281 4.750 -16.417 1.00 0.00 H new ATOM 292 N ALA A 18 14.441 -1.314 -15.605 1.00 0.00 N ATOM 293 CA ALA A 18 13.020 -1.577 -15.310 1.00 0.00 C ATOM 294 C ALA A 18 12.646 -1.179 -13.894 1.00 0.00 C ATOM 295 O ALA A 18 11.740 -0.378 -13.682 1.00 0.00 O ATOM 296 CB ALA A 18 12.663 -3.038 -15.616 1.00 0.00 C ATOM 0 H ALA A 18 15.006 -2.149 -15.758 1.00 0.00 H new ATOM 0 HA ALA A 18 12.423 -0.946 -15.968 1.00 0.00 H new ATOM 0 HB1 ALA A 18 11.610 -3.210 -15.391 1.00 0.00 H new ATOM 0 HB2 ALA A 18 12.847 -3.244 -16.670 1.00 0.00 H new ATOM 0 HB3 ALA A 18 13.277 -3.698 -15.004 1.00 0.00 H new ATOM 302 N GLU A 19 13.401 -1.670 -12.927 1.00 0.00 N ATOM 303 CA GLU A 19 13.330 -1.241 -11.548 1.00 0.00 C ATOM 304 C GLU A 19 13.555 0.276 -11.440 1.00 0.00 C ATOM 305 O GLU A 19 12.847 0.940 -10.681 1.00 0.00 O ATOM 306 CB GLU A 19 14.332 -2.070 -10.730 1.00 0.00 C ATOM 307 CG GLU A 19 15.816 -1.780 -11.007 1.00 0.00 C ATOM 308 CD GLU A 19 16.255 -1.843 -12.479 1.00 0.00 C ATOM 309 OE1 GLU A 19 15.924 -2.819 -13.187 1.00 0.00 O ATOM 310 OE2 GLU A 19 16.868 -0.860 -12.949 1.00 0.00 O ATOM 0 H GLU A 19 14.098 -2.397 -13.087 1.00 0.00 H new ATOM 0 HA GLU A 19 12.336 -1.417 -11.136 1.00 0.00 H new ATOM 0 HB2 GLU A 19 14.138 -1.899 -9.671 1.00 0.00 H new ATOM 0 HB3 GLU A 19 14.145 -3.126 -10.922 1.00 0.00 H new ATOM 0 HG2 GLU A 19 16.049 -0.787 -10.622 1.00 0.00 H new ATOM 0 HG3 GLU A 19 16.416 -2.491 -10.439 1.00 0.00 H new ATOM 317 N GLY A 20 14.466 0.837 -12.243 1.00 0.00 N ATOM 318 CA GLY A 20 14.734 2.265 -12.322 1.00 0.00 C ATOM 319 C GLY A 20 13.471 3.045 -12.676 1.00 0.00 C ATOM 320 O GLY A 20 13.055 3.954 -11.959 1.00 0.00 O ATOM 0 H GLY A 20 15.051 0.287 -12.872 1.00 0.00 H new ATOM 0 HA2 GLY A 20 15.127 2.617 -11.368 1.00 0.00 H new ATOM 0 HA3 GLY A 20 15.503 2.452 -13.072 1.00 0.00 H new ATOM 324 N PHE A 21 12.794 2.659 -13.750 1.00 0.00 N ATOM 325 CA PHE A 21 11.533 3.273 -14.122 1.00 0.00 C ATOM 326 C PHE A 21 10.456 3.014 -13.096 1.00 0.00 C ATOM 327 O PHE A 21 9.599 3.873 -12.907 1.00 0.00 O ATOM 328 CB PHE A 21 11.076 2.801 -15.503 1.00 0.00 C ATOM 329 CG PHE A 21 11.377 3.836 -16.553 1.00 0.00 C ATOM 330 CD1 PHE A 21 10.820 5.127 -16.453 1.00 0.00 C ATOM 331 CD2 PHE A 21 12.274 3.527 -17.579 1.00 0.00 C ATOM 332 CE1 PHE A 21 11.129 6.088 -17.434 1.00 0.00 C ATOM 333 CE2 PHE A 21 12.609 4.495 -18.532 1.00 0.00 C ATOM 334 CZ PHE A 21 12.017 5.770 -18.478 1.00 0.00 C ATOM 0 H PHE A 21 13.102 1.919 -14.380 1.00 0.00 H new ATOM 0 HA PHE A 21 11.703 4.349 -14.161 1.00 0.00 H new ATOM 0 HB2 PHE A 21 11.576 1.866 -15.755 1.00 0.00 H new ATOM 0 HB3 PHE A 21 10.006 2.596 -15.485 1.00 0.00 H new ATOM 0 HD1 PHE A 21 10.163 5.376 -15.633 1.00 0.00 H new ATOM 0 HD2 PHE A 21 12.709 2.540 -17.636 1.00 0.00 H new ATOM 0 HE1 PHE A 21 10.684 7.071 -17.385 1.00 0.00 H new ATOM 0 HE2 PHE A 21 13.322 4.263 -19.309 1.00 0.00 H new ATOM 0 HZ PHE A 21 12.244 6.504 -19.237 1.00 0.00 H new ATOM 344 N ALA A 22 10.474 1.873 -12.417 1.00 0.00 N ATOM 345 CA ALA A 22 9.394 1.546 -11.514 1.00 0.00 C ATOM 346 C ALA A 22 9.439 2.433 -10.275 1.00 0.00 C ATOM 347 O ALA A 22 8.388 2.939 -9.885 1.00 0.00 O ATOM 348 CB ALA A 22 9.436 0.058 -11.178 1.00 0.00 C ATOM 0 H ALA A 22 11.214 1.174 -12.477 1.00 0.00 H new ATOM 0 HA ALA A 22 8.438 1.744 -11.999 1.00 0.00 H new ATOM 0 HB1 ALA A 22 8.620 -0.184 -10.497 1.00 0.00 H new ATOM 0 HB2 ALA A 22 9.330 -0.525 -12.093 1.00 0.00 H new ATOM 0 HB3 ALA A 22 10.388 -0.181 -10.704 1.00 0.00 H new ATOM 354 N LYS A 23 10.624 2.711 -9.698 1.00 0.00 N ATOM 355 CA LYS A 23 10.674 3.679 -8.592 1.00 0.00 C ATOM 356 C LYS A 23 10.236 5.057 -9.087 1.00 0.00 C ATOM 357 O LYS A 23 9.620 5.806 -8.340 1.00 0.00 O ATOM 358 CB LYS A 23 12.028 3.718 -7.832 1.00 0.00 C ATOM 359 CG LYS A 23 13.131 4.687 -8.337 1.00 0.00 C ATOM 360 CD LYS A 23 14.181 4.025 -9.247 1.00 0.00 C ATOM 361 CE LYS A 23 15.413 3.495 -8.482 1.00 0.00 C ATOM 362 NZ LYS A 23 16.429 4.555 -8.193 1.00 0.00 N ATOM 0 H LYS A 23 11.519 2.300 -9.964 1.00 0.00 H new ATOM 0 HA LYS A 23 9.966 3.334 -7.838 1.00 0.00 H new ATOM 0 HB2 LYS A 23 11.818 3.968 -6.792 1.00 0.00 H new ATOM 0 HB3 LYS A 23 12.443 2.710 -7.840 1.00 0.00 H new ATOM 0 HG2 LYS A 23 12.659 5.506 -8.881 1.00 0.00 H new ATOM 0 HG3 LYS A 23 13.636 5.125 -7.476 1.00 0.00 H new ATOM 0 HD2 LYS A 23 13.715 3.200 -9.785 1.00 0.00 H new ATOM 0 HD3 LYS A 23 14.510 4.747 -9.994 1.00 0.00 H new ATOM 0 HE2 LYS A 23 15.085 3.049 -7.543 1.00 0.00 H new ATOM 0 HE3 LYS A 23 15.881 2.702 -9.065 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 16.978 4.289 -7.351 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 17.069 4.653 -9.007 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 15.947 5.460 -8.021 1.00 0.00 H new ATOM 376 N THR A 24 10.541 5.376 -10.346 1.00 0.00 N ATOM 377 CA THR A 24 10.284 6.676 -10.915 1.00 0.00 C ATOM 378 C THR A 24 8.776 6.900 -11.074 1.00 0.00 C ATOM 379 O THR A 24 8.222 7.881 -10.577 1.00 0.00 O ATOM 380 CB THR A 24 11.102 6.746 -12.204 1.00 0.00 C ATOM 381 OG1 THR A 24 12.462 6.892 -11.852 1.00 0.00 O ATOM 382 CG2 THR A 24 10.657 7.864 -13.124 1.00 0.00 C ATOM 0 H THR A 24 10.978 4.723 -10.997 1.00 0.00 H new ATOM 0 HA THR A 24 10.598 7.500 -10.274 1.00 0.00 H new ATOM 0 HB THR A 24 10.947 5.825 -12.766 1.00 0.00 H new ATOM 0 HG1 THR A 24 12.888 6.010 -11.820 1.00 0.00 H new ATOM 0 HG21 THR A 24 11.274 7.864 -14.022 1.00 0.00 H new ATOM 0 HG22 THR A 24 9.614 7.714 -13.401 1.00 0.00 H new ATOM 0 HG23 THR A 24 10.762 8.820 -12.612 1.00 0.00 H new ATOM 390 N LEU A 25 8.114 5.969 -11.754 1.00 0.00 N ATOM 391 CA LEU A 25 6.709 6.059 -12.146 1.00 0.00 C ATOM 392 C LEU A 25 5.789 5.754 -10.964 1.00 0.00 C ATOM 393 O LEU A 25 4.722 6.351 -10.845 1.00 0.00 O ATOM 394 CB LEU A 25 6.447 5.043 -13.278 1.00 0.00 C ATOM 395 CG LEU A 25 7.165 5.362 -14.602 1.00 0.00 C ATOM 396 CD1 LEU A 25 7.226 4.098 -15.463 1.00 0.00 C ATOM 397 CD2 LEU A 25 6.488 6.495 -15.375 1.00 0.00 C ATOM 0 H LEU A 25 8.555 5.101 -12.058 1.00 0.00 H new ATOM 0 HA LEU A 25 6.500 7.073 -12.486 1.00 0.00 H new ATOM 0 HB2 LEU A 25 6.757 4.054 -12.940 1.00 0.00 H new ATOM 0 HB3 LEU A 25 5.374 4.994 -13.464 1.00 0.00 H new ATOM 0 HG LEU A 25 8.173 5.701 -14.361 1.00 0.00 H new ATOM 0 HD11 LEU A 25 7.734 4.321 -16.401 1.00 0.00 H new ATOM 0 HD12 LEU A 25 7.773 3.321 -14.930 1.00 0.00 H new ATOM 0 HD13 LEU A 25 6.214 3.751 -15.672 1.00 0.00 H new ATOM 0 HD21 LEU A 25 7.033 6.681 -16.300 1.00 0.00 H new ATOM 0 HD22 LEU A 25 5.461 6.213 -15.609 1.00 0.00 H new ATOM 0 HD23 LEU A 25 6.486 7.400 -14.767 1.00 0.00 H new ATOM 409 N GLY A 26 6.185 4.799 -10.119 1.00 0.00 N ATOM 410 CA GLY A 26 5.349 4.229 -9.070 1.00 0.00 C ATOM 411 C GLY A 26 5.632 4.777 -7.674 1.00 0.00 C ATOM 412 O GLY A 26 5.067 4.248 -6.721 1.00 0.00 O ATOM 0 H GLY A 26 7.120 4.393 -10.150 1.00 0.00 H new ATOM 0 HA2 GLY A 26 4.303 4.413 -9.315 1.00 0.00 H new ATOM 0 HA3 GLY A 26 5.488 3.148 -9.058 1.00 0.00 H new ATOM 416 N ALA A 27 6.463 5.816 -7.537 1.00 0.00 N ATOM 417 CA ALA A 27 7.007 6.319 -6.270 1.00 0.00 C ATOM 418 C ALA A 27 6.007 6.353 -5.106 1.00 0.00 C ATOM 419 O ALA A 27 6.316 5.891 -4.005 1.00 0.00 O ATOM 420 CB ALA A 27 7.573 7.729 -6.500 1.00 0.00 C ATOM 0 H ALA A 27 6.789 6.353 -8.341 1.00 0.00 H new ATOM 0 HA ALA A 27 7.781 5.613 -5.969 1.00 0.00 H new ATOM 0 HB1 ALA A 27 7.981 8.114 -5.565 1.00 0.00 H new ATOM 0 HB2 ALA A 27 8.363 7.686 -7.250 1.00 0.00 H new ATOM 0 HB3 ALA A 27 6.778 8.388 -6.848 1.00 0.00 H new ATOM 426 N GLY A 28 4.818 6.912 -5.341 1.00 0.00 N ATOM 427 CA GLY A 28 3.814 7.143 -4.302 1.00 0.00 C ATOM 428 C GLY A 28 2.836 5.983 -4.096 1.00 0.00 C ATOM 429 O GLY A 28 1.968 6.084 -3.225 1.00 0.00 O ATOM 0 H GLY A 28 4.523 7.220 -6.268 1.00 0.00 H new ATOM 0 HA2 GLY A 28 4.324 7.344 -3.360 1.00 0.00 H new ATOM 0 HA3 GLY A 28 3.247 8.039 -4.555 1.00 0.00 H new ATOM 433 N LYS A 29 2.939 4.900 -4.882 1.00 0.00 N ATOM 434 CA LYS A 29 1.978 3.785 -4.871 1.00 0.00 C ATOM 435 C LYS A 29 2.634 2.431 -4.626 1.00 0.00 C ATOM 436 O LYS A 29 1.974 1.556 -4.070 1.00 0.00 O ATOM 437 CB LYS A 29 1.079 3.829 -6.134 1.00 0.00 C ATOM 438 CG LYS A 29 1.831 3.853 -7.480 1.00 0.00 C ATOM 439 CD LYS A 29 0.916 4.179 -8.677 1.00 0.00 C ATOM 440 CE LYS A 29 0.629 5.689 -8.780 1.00 0.00 C ATOM 441 NZ LYS A 29 -0.342 6.022 -9.860 1.00 0.00 N ATOM 0 H LYS A 29 3.699 4.772 -5.550 1.00 0.00 H new ATOM 0 HA LYS A 29 1.323 3.918 -4.010 1.00 0.00 H new ATOM 0 HB2 LYS A 29 0.420 2.961 -6.121 1.00 0.00 H new ATOM 0 HB3 LYS A 29 0.443 4.713 -6.076 1.00 0.00 H new ATOM 0 HG2 LYS A 29 2.631 4.592 -7.430 1.00 0.00 H new ATOM 0 HG3 LYS A 29 2.302 2.884 -7.644 1.00 0.00 H new ATOM 0 HD2 LYS A 29 1.385 3.834 -9.598 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -0.024 3.636 -8.575 1.00 0.00 H new ATOM 0 HE2 LYS A 29 0.240 6.046 -7.826 1.00 0.00 H new ATOM 0 HE3 LYS A 29 1.563 6.220 -8.962 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -0.497 7.050 -9.883 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 0.037 5.709 -10.776 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -1.245 5.540 -9.676 1.00 0.00 H new ATOM 455 N ILE A 30 3.902 2.233 -5.000 1.00 0.00 N ATOM 456 CA ILE A 30 4.583 0.937 -4.921 1.00 0.00 C ATOM 457 C ILE A 30 6.061 1.101 -4.535 1.00 0.00 C ATOM 458 O ILE A 30 6.680 2.119 -4.843 1.00 0.00 O ATOM 459 CB ILE A 30 4.396 0.148 -6.244 1.00 0.00 C ATOM 460 CG1 ILE A 30 4.930 0.910 -7.476 1.00 0.00 C ATOM 461 CG2 ILE A 30 2.919 -0.233 -6.428 1.00 0.00 C ATOM 462 CD1 ILE A 30 4.654 0.252 -8.832 1.00 0.00 C ATOM 0 H ILE A 30 4.492 2.978 -5.371 1.00 0.00 H new ATOM 0 HA ILE A 30 4.125 0.351 -4.124 1.00 0.00 H new ATOM 0 HB ILE A 30 4.993 -0.761 -6.165 1.00 0.00 H new ATOM 0 HG12 ILE A 30 4.493 1.908 -7.481 1.00 0.00 H new ATOM 0 HG13 ILE A 30 6.007 1.034 -7.365 1.00 0.00 H new ATOM 0 HG21 ILE A 30 2.799 -0.786 -7.359 1.00 0.00 H new ATOM 0 HG22 ILE A 30 2.597 -0.855 -5.593 1.00 0.00 H new ATOM 0 HG23 ILE A 30 2.312 0.671 -6.463 1.00 0.00 H new ATOM 0 HD11 ILE A 30 5.071 0.869 -9.628 1.00 0.00 H new ATOM 0 HD12 ILE A 30 5.116 -0.735 -8.858 1.00 0.00 H new ATOM 0 HD13 ILE A 30 3.578 0.153 -8.976 1.00 0.00 H new ATOM 474 N ALA A 31 6.609 0.089 -3.851 1.00 0.00 N ATOM 475 CA ALA A 31 8.030 -0.046 -3.521 1.00 0.00 C ATOM 476 C ALA A 31 8.676 -0.985 -4.534 1.00 0.00 C ATOM 477 O ALA A 31 7.981 -1.793 -5.138 1.00 0.00 O ATOM 478 CB ALA A 31 8.207 -0.589 -2.095 1.00 0.00 C ATOM 0 H ALA A 31 6.051 -0.689 -3.499 1.00 0.00 H new ATOM 0 HA ALA A 31 8.510 0.931 -3.564 1.00 0.00 H new ATOM 0 HB1 ALA A 31 9.270 -0.682 -1.870 1.00 0.00 H new ATOM 0 HB2 ALA A 31 7.744 0.096 -1.385 1.00 0.00 H new ATOM 0 HB3 ALA A 31 7.733 -1.567 -2.017 1.00 0.00 H new ATOM 484 N VAL A 32 9.989 -0.924 -4.717 1.00 0.00 N ATOM 485 CA VAL A 32 10.720 -1.704 -5.712 1.00 0.00 C ATOM 486 C VAL A 32 12.025 -2.175 -5.062 1.00 0.00 C ATOM 487 O VAL A 32 12.750 -1.370 -4.472 1.00 0.00 O ATOM 488 CB VAL A 32 10.986 -0.828 -6.954 1.00 0.00 C ATOM 489 CG1 VAL A 32 11.589 -1.667 -8.088 1.00 0.00 C ATOM 490 CG2 VAL A 32 9.714 -0.144 -7.482 1.00 0.00 C ATOM 0 H VAL A 32 10.592 -0.315 -4.164 1.00 0.00 H new ATOM 0 HA VAL A 32 10.148 -2.572 -6.040 1.00 0.00 H new ATOM 0 HB VAL A 32 11.685 -0.056 -6.634 1.00 0.00 H new ATOM 0 HG11 VAL A 32 11.769 -1.031 -8.955 1.00 0.00 H new ATOM 0 HG12 VAL A 32 12.531 -2.104 -7.756 1.00 0.00 H new ATOM 0 HG13 VAL A 32 10.896 -2.463 -8.360 1.00 0.00 H new ATOM 0 HG21 VAL A 32 9.961 0.459 -8.356 1.00 0.00 H new ATOM 0 HG22 VAL A 32 8.982 -0.902 -7.759 1.00 0.00 H new ATOM 0 HG23 VAL A 32 9.296 0.497 -6.705 1.00 0.00 H new ATOM 500 N THR A 33 12.340 -3.457 -5.233 1.00 0.00 N ATOM 501 CA THR A 33 13.567 -4.082 -4.788 1.00 0.00 C ATOM 502 C THR A 33 14.001 -5.003 -5.914 1.00 0.00 C ATOM 503 O THR A 33 13.360 -6.026 -6.147 1.00 0.00 O ATOM 504 CB THR A 33 13.285 -4.887 -3.513 1.00 0.00 C ATOM 505 OG1 THR A 33 12.660 -4.076 -2.531 1.00 0.00 O ATOM 506 CG2 THR A 33 14.551 -5.514 -2.912 1.00 0.00 C ATOM 0 H THR A 33 11.715 -4.110 -5.706 1.00 0.00 H new ATOM 0 HA THR A 33 14.345 -3.353 -4.561 1.00 0.00 H new ATOM 0 HB THR A 33 12.617 -5.696 -3.810 1.00 0.00 H new ATOM 0 HG1 THR A 33 12.251 -4.647 -1.847 1.00 0.00 H new ATOM 0 HG21 THR A 33 14.289 -6.071 -2.012 1.00 0.00 H new ATOM 0 HG22 THR A 33 15.003 -6.190 -3.638 1.00 0.00 H new ATOM 0 HG23 THR A 33 15.261 -4.727 -2.658 1.00 0.00 H new ATOM 514 N SER A 34 15.048 -4.656 -6.652 1.00 0.00 N ATOM 515 CA SER A 34 15.559 -5.571 -7.656 1.00 0.00 C ATOM 516 C SER A 34 16.440 -6.614 -6.977 1.00 0.00 C ATOM 517 O SER A 34 17.589 -6.326 -6.644 1.00 0.00 O ATOM 518 CB SER A 34 16.265 -4.791 -8.775 1.00 0.00 C ATOM 519 OG SER A 34 16.979 -3.671 -8.258 1.00 0.00 O ATOM 0 H SER A 34 15.547 -3.770 -6.576 1.00 0.00 H new ATOM 0 HA SER A 34 14.745 -6.110 -8.141 1.00 0.00 H new ATOM 0 HB2 SER A 34 16.953 -5.451 -9.302 1.00 0.00 H new ATOM 0 HB3 SER A 34 15.529 -4.450 -9.503 1.00 0.00 H new ATOM 0 HG SER A 34 17.757 -3.489 -8.825 1.00 0.00 H new ATOM 525 N SER A 35 15.899 -7.803 -6.724 1.00 0.00 N ATOM 526 CA SER A 35 16.636 -8.931 -6.174 1.00 0.00 C ATOM 527 C SER A 35 17.597 -9.525 -7.227 1.00 0.00 C ATOM 528 O SER A 35 17.723 -9.021 -8.348 1.00 0.00 O ATOM 529 CB SER A 35 15.599 -9.921 -5.636 1.00 0.00 C ATOM 530 OG SER A 35 14.634 -10.193 -6.636 1.00 0.00 O ATOM 0 H SER A 35 14.916 -8.011 -6.900 1.00 0.00 H new ATOM 0 HA SER A 35 17.287 -8.634 -5.352 1.00 0.00 H new ATOM 0 HB2 SER A 35 16.089 -10.845 -5.329 1.00 0.00 H new ATOM 0 HB3 SER A 35 15.114 -9.509 -4.751 1.00 0.00 H new ATOM 0 HG SER A 35 13.737 -10.019 -6.281 1.00 0.00 H new ATOM 536 N GLY A 36 18.297 -10.602 -6.864 1.00 0.00 N ATOM 537 CA GLY A 36 19.261 -11.310 -7.681 1.00 0.00 C ATOM 538 C GLY A 36 19.658 -12.554 -6.899 1.00 0.00 C ATOM 539 O GLY A 36 19.268 -12.722 -5.742 1.00 0.00 O ATOM 0 H GLY A 36 18.194 -11.020 -5.939 1.00 0.00 H new ATOM 0 HA2 GLY A 36 18.829 -11.579 -8.645 1.00 0.00 H new ATOM 0 HA3 GLY A 36 20.131 -10.685 -7.884 1.00 0.00 H new ATOM 543 N LEU A 37 20.412 -13.444 -7.527 1.00 0.00 N ATOM 544 CA LEU A 37 20.979 -14.632 -6.912 1.00 0.00 C ATOM 545 C LEU A 37 22.483 -14.448 -6.703 1.00 0.00 C ATOM 546 O LEU A 37 23.085 -15.107 -5.856 1.00 0.00 O ATOM 547 CB LEU A 37 20.626 -15.837 -7.791 1.00 0.00 C ATOM 548 CG LEU A 37 19.142 -16.220 -7.627 1.00 0.00 C ATOM 549 CD1 LEU A 37 18.630 -16.963 -8.862 1.00 0.00 C ATOM 550 CD2 LEU A 37 18.921 -17.094 -6.383 1.00 0.00 C ATOM 0 H LEU A 37 20.654 -13.354 -8.514 1.00 0.00 H new ATOM 0 HA LEU A 37 20.561 -14.807 -5.921 1.00 0.00 H new ATOM 0 HB2 LEU A 37 20.832 -15.603 -8.835 1.00 0.00 H new ATOM 0 HB3 LEU A 37 21.257 -16.685 -7.523 1.00 0.00 H new ATOM 0 HG LEU A 37 18.584 -15.291 -7.507 1.00 0.00 H new ATOM 0 HD11 LEU A 37 17.581 -17.222 -8.722 1.00 0.00 H new ATOM 0 HD12 LEU A 37 18.732 -16.324 -9.739 1.00 0.00 H new ATOM 0 HD13 LEU A 37 19.212 -17.873 -9.007 1.00 0.00 H new ATOM 0 HD21 LEU A 37 17.864 -17.345 -6.298 1.00 0.00 H new ATOM 0 HD22 LEU A 37 19.506 -18.010 -6.473 1.00 0.00 H new ATOM 0 HD23 LEU A 37 19.237 -16.548 -5.494 1.00 0.00 H new ATOM 562 N GLU A 38 23.063 -13.507 -7.447 1.00 0.00 N ATOM 563 CA GLU A 38 24.402 -12.972 -7.312 1.00 0.00 C ATOM 564 C GLU A 38 24.280 -11.456 -7.352 1.00 0.00 C ATOM 565 O GLU A 38 23.278 -10.929 -7.847 1.00 0.00 O ATOM 566 CB GLU A 38 25.284 -13.440 -8.472 1.00 0.00 C ATOM 567 CG GLU A 38 25.800 -14.854 -8.219 1.00 0.00 C ATOM 568 CD GLU A 38 26.485 -15.475 -9.455 1.00 0.00 C ATOM 569 OE1 GLU A 38 27.214 -14.758 -10.186 1.00 0.00 O ATOM 570 OE2 GLU A 38 26.302 -16.694 -9.691 1.00 0.00 O ATOM 0 H GLU A 38 22.561 -13.069 -8.220 1.00 0.00 H new ATOM 0 HA GLU A 38 24.856 -13.313 -6.382 1.00 0.00 H new ATOM 0 HB2 GLU A 38 24.715 -13.416 -9.401 1.00 0.00 H new ATOM 0 HB3 GLU A 38 26.125 -12.757 -8.595 1.00 0.00 H new ATOM 0 HG2 GLU A 38 26.507 -14.834 -7.390 1.00 0.00 H new ATOM 0 HG3 GLU A 38 24.969 -15.489 -7.913 1.00 0.00 H new ATOM 577 N SER A 39 25.311 -10.739 -6.903 1.00 0.00 N ATOM 578 CA SER A 39 25.265 -9.289 -6.920 1.00 0.00 C ATOM 579 C SER A 39 26.603 -8.618 -7.200 1.00 0.00 C ATOM 580 O SER A 39 27.685 -9.186 -7.030 1.00 0.00 O ATOM 581 CB SER A 39 24.573 -8.797 -5.646 1.00 0.00 C ATOM 582 OG SER A 39 25.252 -9.220 -4.471 1.00 0.00 O ATOM 0 H SER A 39 26.173 -11.137 -6.530 1.00 0.00 H new ATOM 0 HA SER A 39 24.669 -8.980 -7.779 1.00 0.00 H new ATOM 0 HB2 SER A 39 24.519 -7.708 -5.661 1.00 0.00 H new ATOM 0 HB3 SER A 39 23.548 -9.167 -5.625 1.00 0.00 H new ATOM 0 HG SER A 39 24.779 -8.884 -3.681 1.00 0.00 H new ATOM 588 N SER A 40 26.445 -7.398 -7.703 1.00 0.00 N ATOM 589 CA SER A 40 27.400 -6.477 -8.290 1.00 0.00 C ATOM 590 C SER A 40 26.623 -5.157 -8.399 1.00 0.00 C ATOM 591 O SER A 40 25.434 -5.099 -8.070 1.00 0.00 O ATOM 592 CB SER A 40 27.759 -7.003 -9.691 1.00 0.00 C ATOM 593 OG SER A 40 28.750 -8.018 -9.616 1.00 0.00 O ATOM 0 H SER A 40 25.514 -6.981 -7.706 1.00 0.00 H new ATOM 0 HA SER A 40 28.321 -6.361 -7.719 1.00 0.00 H new ATOM 0 HB2 SER A 40 26.866 -7.397 -10.175 1.00 0.00 H new ATOM 0 HB3 SER A 40 28.121 -6.182 -10.310 1.00 0.00 H new ATOM 0 HG SER A 40 29.075 -8.225 -10.517 1.00 0.00 H new ATOM 599 N ARG A 41 27.234 -4.098 -8.911 1.00 0.00 N ATOM 600 CA ARG A 41 26.513 -2.872 -9.268 1.00 0.00 C ATOM 601 C ARG A 41 26.004 -3.051 -10.694 1.00 0.00 C ATOM 602 O ARG A 41 26.323 -4.027 -11.373 1.00 0.00 O ATOM 603 CB ARG A 41 27.438 -1.642 -9.111 1.00 0.00 C ATOM 604 CG ARG A 41 26.694 -0.359 -8.700 1.00 0.00 C ATOM 605 CD ARG A 41 27.652 0.810 -8.436 1.00 0.00 C ATOM 606 NE ARG A 41 28.371 1.246 -9.654 1.00 0.00 N ATOM 607 CZ ARG A 41 29.291 2.222 -9.701 1.00 0.00 C ATOM 608 NH1 ARG A 41 29.607 2.911 -8.607 1.00 0.00 N ATOM 609 NH2 ARG A 41 29.896 2.511 -10.851 1.00 0.00 N ATOM 0 H ARG A 41 28.237 -4.058 -9.092 1.00 0.00 H new ATOM 0 HA ARG A 41 25.665 -2.694 -8.606 1.00 0.00 H new ATOM 0 HB2 ARG A 41 28.201 -1.864 -8.365 1.00 0.00 H new ATOM 0 HB3 ARG A 41 27.956 -1.465 -10.053 1.00 0.00 H new ATOM 0 HG2 ARG A 41 25.993 -0.081 -9.486 1.00 0.00 H new ATOM 0 HG3 ARG A 41 26.106 -0.554 -7.803 1.00 0.00 H new ATOM 0 HD2 ARG A 41 27.089 1.651 -8.031 1.00 0.00 H new ATOM 0 HD3 ARG A 41 28.377 0.516 -7.677 1.00 0.00 H new ATOM 0 HE ARG A 41 28.150 0.767 -10.527 1.00 0.00 H new ATOM 0 HH11 ARG A 41 29.148 2.699 -7.721 1.00 0.00 H new ATOM 0 HH12 ARG A 41 30.308 3.651 -8.655 1.00 0.00 H new ATOM 0 HH21 ARG A 41 29.660 1.991 -11.696 1.00 0.00 H new ATOM 0 HH22 ARG A 41 30.595 3.253 -10.887 1.00 0.00 H new ATOM 623 N VAL A 42 25.181 -2.114 -11.133 1.00 0.00 N ATOM 624 CA VAL A 42 24.634 -2.116 -12.474 1.00 0.00 C ATOM 625 C VAL A 42 25.755 -1.839 -13.502 1.00 0.00 C ATOM 626 O VAL A 42 26.837 -1.374 -13.128 1.00 0.00 O ATOM 627 CB VAL A 42 23.485 -1.097 -12.525 1.00 0.00 C ATOM 628 CG1 VAL A 42 22.447 -1.309 -11.416 1.00 0.00 C ATOM 629 CG2 VAL A 42 23.996 0.351 -12.474 1.00 0.00 C ATOM 0 H VAL A 42 24.873 -1.326 -10.563 1.00 0.00 H new ATOM 0 HA VAL A 42 24.224 -3.091 -12.737 1.00 0.00 H new ATOM 0 HB VAL A 42 22.995 -1.268 -13.483 1.00 0.00 H new ATOM 0 HG11 VAL A 42 21.661 -0.559 -11.505 1.00 0.00 H new ATOM 0 HG12 VAL A 42 22.012 -2.304 -11.511 1.00 0.00 H new ATOM 0 HG13 VAL A 42 22.930 -1.215 -10.443 1.00 0.00 H new ATOM 0 HG21 VAL A 42 23.150 1.037 -12.513 1.00 0.00 H new ATOM 0 HG22 VAL A 42 24.549 0.509 -11.548 1.00 0.00 H new ATOM 0 HG23 VAL A 42 24.652 0.536 -13.325 1.00 0.00 H new ATOM 639 N HIS A 43 25.504 -2.093 -14.792 1.00 0.00 N ATOM 640 CA HIS A 43 26.469 -1.825 -15.866 1.00 0.00 C ATOM 641 C HIS A 43 26.805 -0.319 -16.000 1.00 0.00 C ATOM 642 O HIS A 43 25.966 0.518 -15.661 1.00 0.00 O ATOM 643 CB HIS A 43 25.935 -2.433 -17.179 1.00 0.00 C ATOM 644 CG HIS A 43 26.030 -3.944 -17.292 1.00 0.00 C ATOM 645 ND1 HIS A 43 25.372 -4.757 -18.200 1.00 0.00 N ATOM 646 CD2 HIS A 43 26.848 -4.766 -16.557 1.00 0.00 C ATOM 647 CE1 HIS A 43 25.793 -6.020 -18.010 1.00 0.00 C ATOM 648 NE2 HIS A 43 26.694 -6.078 -17.014 1.00 0.00 N ATOM 0 H HIS A 43 24.624 -2.491 -15.121 1.00 0.00 H new ATOM 0 HA HIS A 43 27.417 -2.302 -15.617 1.00 0.00 H new ATOM 0 HB2 HIS A 43 24.890 -2.144 -17.293 1.00 0.00 H new ATOM 0 HB3 HIS A 43 26.481 -1.990 -18.012 1.00 0.00 H new ATOM 0 HD1 HIS A 43 24.688 -4.451 -18.892 1.00 0.00 H new ATOM 0 HD2 HIS A 43 27.502 -4.451 -15.758 1.00 0.00 H new ATOM 0 HE1 HIS A 43 25.453 -6.872 -18.580 1.00 0.00 H new ATOM 656 N PRO A 44 28.006 0.058 -16.492 1.00 0.00 N ATOM 657 CA PRO A 44 28.494 1.439 -16.457 1.00 0.00 C ATOM 658 C PRO A 44 27.760 2.393 -17.403 1.00 0.00 C ATOM 659 O PRO A 44 27.226 3.403 -16.940 1.00 0.00 O ATOM 660 CB PRO A 44 29.988 1.365 -16.798 1.00 0.00 C ATOM 661 CG PRO A 44 30.117 0.066 -17.594 1.00 0.00 C ATOM 662 CD PRO A 44 29.072 -0.833 -16.939 1.00 0.00 C ATOM 0 HA PRO A 44 28.310 1.860 -15.468 1.00 0.00 H new ATOM 0 HB2 PRO A 44 30.308 2.227 -17.384 1.00 0.00 H new ATOM 0 HB3 PRO A 44 30.603 1.346 -15.898 1.00 0.00 H new ATOM 0 HG2 PRO A 44 29.913 0.218 -18.654 1.00 0.00 H new ATOM 0 HG3 PRO A 44 31.119 -0.357 -17.520 1.00 0.00 H new ATOM 0 HD2 PRO A 44 28.694 -1.572 -17.645 1.00 0.00 H new ATOM 0 HD3 PRO A 44 29.499 -1.383 -16.101 1.00 0.00 H new ATOM 670 N THR A 45 27.694 2.099 -18.706 1.00 0.00 N ATOM 671 CA THR A 45 27.084 3.006 -19.684 1.00 0.00 C ATOM 672 C THR A 45 25.582 3.137 -19.414 1.00 0.00 C ATOM 673 O THR A 45 24.991 4.172 -19.729 1.00 0.00 O ATOM 674 CB THR A 45 27.424 2.540 -21.107 1.00 0.00 C ATOM 675 OG1 THR A 45 28.831 2.360 -21.218 1.00 0.00 O ATOM 676 CG2 THR A 45 26.958 3.513 -22.202 1.00 0.00 C ATOM 0 H THR A 45 28.058 1.235 -19.109 1.00 0.00 H new ATOM 0 HA THR A 45 27.496 4.010 -19.584 1.00 0.00 H new ATOM 0 HB THR A 45 26.888 1.604 -21.265 1.00 0.00 H new ATOM 0 HG1 THR A 45 29.052 2.061 -22.125 1.00 0.00 H new ATOM 0 HG21 THR A 45 27.232 3.118 -23.180 1.00 0.00 H new ATOM 0 HG22 THR A 45 25.876 3.630 -22.148 1.00 0.00 H new ATOM 0 HG23 THR A 45 27.435 4.482 -22.055 1.00 0.00 H new ATOM 684 N ALA A 46 24.979 2.149 -18.735 1.00 0.00 N ATOM 685 CA ALA A 46 23.620 2.259 -18.238 1.00 0.00 C ATOM 686 C ALA A 46 23.453 3.519 -17.424 1.00 0.00 C ATOM 687 O ALA A 46 22.575 4.306 -17.733 1.00 0.00 O ATOM 688 CB ALA A 46 23.237 1.036 -17.392 1.00 0.00 C ATOM 0 H ALA A 46 25.428 1.258 -18.521 1.00 0.00 H new ATOM 0 HA ALA A 46 22.955 2.302 -19.101 1.00 0.00 H new ATOM 0 HB1 ALA A 46 22.214 1.147 -17.034 1.00 0.00 H new ATOM 0 HB2 ALA A 46 23.312 0.135 -18.000 1.00 0.00 H new ATOM 0 HB3 ALA A 46 23.913 0.957 -16.540 1.00 0.00 H new ATOM 694 N ILE A 47 24.308 3.754 -16.436 1.00 0.00 N ATOM 695 CA ILE A 47 24.111 4.859 -15.507 1.00 0.00 C ATOM 696 C ILE A 47 24.068 6.169 -16.293 1.00 0.00 C ATOM 697 O ILE A 47 23.194 6.991 -16.038 1.00 0.00 O ATOM 698 CB ILE A 47 25.243 4.848 -14.445 1.00 0.00 C ATOM 699 CG1 ILE A 47 25.078 3.633 -13.510 1.00 0.00 C ATOM 700 CG2 ILE A 47 25.290 6.169 -13.657 1.00 0.00 C ATOM 701 CD1 ILE A 47 26.298 3.351 -12.628 1.00 0.00 C ATOM 0 H ILE A 47 25.143 3.195 -16.258 1.00 0.00 H new ATOM 0 HA ILE A 47 23.164 4.755 -14.977 1.00 0.00 H new ATOM 0 HB ILE A 47 26.199 4.756 -14.960 1.00 0.00 H new ATOM 0 HG12 ILE A 47 24.211 3.796 -12.870 1.00 0.00 H new ATOM 0 HG13 ILE A 47 24.868 2.750 -14.113 1.00 0.00 H new ATOM 0 HG21 ILE A 47 26.094 6.126 -12.922 1.00 0.00 H new ATOM 0 HG22 ILE A 47 25.470 6.996 -14.344 1.00 0.00 H new ATOM 0 HG23 ILE A 47 24.339 6.322 -13.146 1.00 0.00 H new ATOM 0 HD11 ILE A 47 26.100 2.482 -12.001 1.00 0.00 H new ATOM 0 HD12 ILE A 47 27.165 3.154 -13.258 1.00 0.00 H new ATOM 0 HD13 ILE A 47 26.498 4.216 -11.996 1.00 0.00 H new ATOM 713 N ALA A 48 24.937 6.331 -17.290 1.00 0.00 N ATOM 714 CA ALA A 48 24.949 7.526 -18.111 1.00 0.00 C ATOM 715 C ALA A 48 23.645 7.664 -18.904 1.00 0.00 C ATOM 716 O ALA A 48 23.015 8.716 -18.864 1.00 0.00 O ATOM 717 CB ALA A 48 26.178 7.504 -19.030 1.00 0.00 C ATOM 0 H ALA A 48 25.644 5.641 -17.544 1.00 0.00 H new ATOM 0 HA ALA A 48 25.017 8.403 -17.467 1.00 0.00 H new ATOM 0 HB1 ALA A 48 26.187 8.402 -19.647 1.00 0.00 H new ATOM 0 HB2 ALA A 48 27.084 7.470 -18.425 1.00 0.00 H new ATOM 0 HB3 ALA A 48 26.137 6.624 -19.671 1.00 0.00 H new ATOM 723 N MET A 49 23.207 6.607 -19.590 1.00 0.00 N ATOM 724 CA MET A 49 21.987 6.644 -20.404 1.00 0.00 C ATOM 725 C MET A 49 20.740 6.850 -19.536 1.00 0.00 C ATOM 726 O MET A 49 19.775 7.527 -19.906 1.00 0.00 O ATOM 727 CB MET A 49 21.881 5.318 -21.175 1.00 0.00 C ATOM 728 CG MET A 49 22.997 5.228 -22.217 1.00 0.00 C ATOM 729 SD MET A 49 22.822 6.435 -23.550 1.00 0.00 S ATOM 730 CE MET A 49 24.498 7.098 -23.471 1.00 0.00 C ATOM 0 H MET A 49 23.684 5.705 -19.599 1.00 0.00 H new ATOM 0 HA MET A 49 22.044 7.485 -21.095 1.00 0.00 H new ATOM 0 HB2 MET A 49 21.950 4.479 -20.483 1.00 0.00 H new ATOM 0 HB3 MET A 49 20.909 5.249 -21.664 1.00 0.00 H new ATOM 0 HG2 MET A 49 23.958 5.376 -21.725 1.00 0.00 H new ATOM 0 HG3 MET A 49 23.008 4.225 -22.643 1.00 0.00 H new ATOM 0 HE1 MET A 49 24.617 7.877 -24.225 1.00 0.00 H new ATOM 0 HE2 MET A 49 24.676 7.520 -22.482 1.00 0.00 H new ATOM 0 HE3 MET A 49 25.215 6.299 -23.659 1.00 0.00 H new ATOM 740 N MET A 50 20.760 6.263 -18.354 1.00 0.00 N ATOM 741 CA MET A 50 19.614 6.247 -17.482 1.00 0.00 C ATOM 742 C MET A 50 19.544 7.602 -16.789 1.00 0.00 C ATOM 743 O MET A 50 18.451 8.143 -16.633 1.00 0.00 O ATOM 744 CB MET A 50 19.660 5.034 -16.545 1.00 0.00 C ATOM 745 CG MET A 50 19.680 3.650 -17.251 1.00 0.00 C ATOM 746 SD MET A 50 19.231 3.534 -19.021 1.00 0.00 S ATOM 747 CE MET A 50 19.665 1.801 -19.421 1.00 0.00 C ATOM 0 H MET A 50 21.577 5.784 -17.976 1.00 0.00 H new ATOM 0 HA MET A 50 18.682 6.116 -18.032 1.00 0.00 H new ATOM 0 HB2 MET A 50 20.546 5.115 -15.916 1.00 0.00 H new ATOM 0 HB3 MET A 50 18.795 5.074 -15.884 1.00 0.00 H new ATOM 0 HG2 MET A 50 20.685 3.242 -17.142 1.00 0.00 H new ATOM 0 HG3 MET A 50 19.008 2.993 -16.700 1.00 0.00 H new ATOM 0 HE1 MET A 50 18.963 1.411 -20.158 1.00 0.00 H new ATOM 0 HE2 MET A 50 20.676 1.764 -19.827 1.00 0.00 H new ATOM 0 HE3 MET A 50 19.615 1.195 -18.516 1.00 0.00 H new ATOM 757 N GLU A 51 20.690 8.229 -16.508 1.00 0.00 N ATOM 758 CA GLU A 51 20.753 9.593 -16.036 1.00 0.00 C ATOM 759 C GLU A 51 20.315 10.551 -17.151 1.00 0.00 C ATOM 760 O GLU A 51 19.761 11.612 -16.857 1.00 0.00 O ATOM 761 CB GLU A 51 22.165 9.903 -15.516 1.00 0.00 C ATOM 762 CG GLU A 51 22.287 11.315 -14.932 1.00 0.00 C ATOM 763 CD GLU A 51 23.664 11.537 -14.276 1.00 0.00 C ATOM 764 OE1 GLU A 51 24.642 11.856 -14.997 1.00 0.00 O ATOM 765 OE2 GLU A 51 23.775 11.416 -13.032 1.00 0.00 O ATOM 0 H GLU A 51 21.605 7.788 -16.607 1.00 0.00 H new ATOM 0 HA GLU A 51 20.065 9.730 -15.202 1.00 0.00 H new ATOM 0 HB2 GLU A 51 22.434 9.174 -14.751 1.00 0.00 H new ATOM 0 HB3 GLU A 51 22.880 9.789 -16.331 1.00 0.00 H new ATOM 0 HG2 GLU A 51 22.136 12.051 -15.722 1.00 0.00 H new ATOM 0 HG3 GLU A 51 21.501 11.474 -14.194 1.00 0.00 H new ATOM 772 N GLU A 52 20.474 10.174 -18.424 1.00 0.00 N ATOM 773 CA GLU A 52 19.972 10.972 -19.533 1.00 0.00 C ATOM 774 C GLU A 52 18.439 10.969 -19.551 1.00 0.00 C ATOM 775 O GLU A 52 17.850 11.970 -19.969 1.00 0.00 O ATOM 776 CB GLU A 52 20.593 10.582 -20.885 1.00 0.00 C ATOM 777 CG GLU A 52 22.034 11.082 -21.042 1.00 0.00 C ATOM 778 CD GLU A 52 22.097 12.593 -21.337 1.00 0.00 C ATOM 779 OE1 GLU A 52 21.992 12.989 -22.524 1.00 0.00 O ATOM 780 OE2 GLU A 52 22.266 13.397 -20.388 1.00 0.00 O ATOM 0 H GLU A 52 20.949 9.317 -18.706 1.00 0.00 H new ATOM 0 HA GLU A 52 20.294 12.000 -19.368 1.00 0.00 H new ATOM 0 HB2 GLU A 52 20.576 9.497 -20.988 1.00 0.00 H new ATOM 0 HB3 GLU A 52 19.982 10.988 -21.691 1.00 0.00 H new ATOM 0 HG2 GLU A 52 22.592 10.868 -20.131 1.00 0.00 H new ATOM 0 HG3 GLU A 52 22.520 10.535 -21.850 1.00 0.00 H new ATOM 787 N VAL A 53 17.791 9.904 -19.051 1.00 0.00 N ATOM 788 CA VAL A 53 16.338 9.911 -18.814 1.00 0.00 C ATOM 789 C VAL A 53 16.005 10.334 -17.362 1.00 0.00 C ATOM 790 O VAL A 53 14.859 10.235 -16.920 1.00 0.00 O ATOM 791 CB VAL A 53 15.679 8.619 -19.349 1.00 0.00 C ATOM 792 CG1 VAL A 53 15.885 7.392 -18.454 1.00 0.00 C ATOM 793 CG2 VAL A 53 14.187 8.797 -19.658 1.00 0.00 C ATOM 0 H VAL A 53 18.250 9.028 -18.803 1.00 0.00 H new ATOM 0 HA VAL A 53 15.862 10.692 -19.407 1.00 0.00 H new ATOM 0 HB VAL A 53 16.207 8.425 -20.283 1.00 0.00 H new ATOM 0 HG11 VAL A 53 15.392 6.529 -18.901 1.00 0.00 H new ATOM 0 HG12 VAL A 53 16.951 7.189 -18.354 1.00 0.00 H new ATOM 0 HG13 VAL A 53 15.459 7.584 -17.469 1.00 0.00 H new ATOM 0 HG21 VAL A 53 13.778 7.858 -20.030 1.00 0.00 H new ATOM 0 HG22 VAL A 53 13.660 9.088 -18.750 1.00 0.00 H new ATOM 0 HG23 VAL A 53 14.062 9.572 -20.414 1.00 0.00 H new ATOM 803 N GLY A 54 16.991 10.854 -16.622 1.00 0.00 N ATOM 804 CA GLY A 54 16.812 11.431 -15.297 1.00 0.00 C ATOM 805 C GLY A 54 16.658 10.394 -14.182 1.00 0.00 C ATOM 806 O GLY A 54 16.174 10.746 -13.106 1.00 0.00 O ATOM 0 H GLY A 54 17.959 10.883 -16.942 1.00 0.00 H new ATOM 0 HA2 GLY A 54 17.667 12.068 -15.071 1.00 0.00 H new ATOM 0 HA3 GLY A 54 15.931 12.072 -15.307 1.00 0.00 H new ATOM 810 N ILE A 55 17.043 9.133 -14.414 1.00 0.00 N ATOM 811 CA ILE A 55 16.907 8.046 -13.447 1.00 0.00 C ATOM 812 C ILE A 55 18.283 7.638 -12.926 1.00 0.00 C ATOM 813 O ILE A 55 19.198 7.360 -13.702 1.00 0.00 O ATOM 814 CB ILE A 55 16.120 6.867 -14.045 1.00 0.00 C ATOM 815 CG1 ILE A 55 14.686 7.327 -14.398 1.00 0.00 C ATOM 816 CG2 ILE A 55 16.110 5.642 -13.103 1.00 0.00 C ATOM 817 CD1 ILE A 55 13.716 6.191 -14.722 1.00 0.00 C ATOM 0 H ILE A 55 17.464 8.838 -15.295 1.00 0.00 H new ATOM 0 HA ILE A 55 16.326 8.395 -12.593 1.00 0.00 H new ATOM 0 HB ILE A 55 16.621 6.546 -14.958 1.00 0.00 H new ATOM 0 HG12 ILE A 55 14.286 7.901 -13.562 1.00 0.00 H new ATOM 0 HG13 ILE A 55 14.735 8.001 -15.253 1.00 0.00 H new ATOM 0 HG21 ILE A 55 15.544 4.833 -13.564 1.00 0.00 H new ATOM 0 HG22 ILE A 55 17.133 5.312 -12.924 1.00 0.00 H new ATOM 0 HG23 ILE A 55 15.646 5.915 -12.155 1.00 0.00 H new ATOM 0 HD11 ILE A 55 12.736 6.606 -14.957 1.00 0.00 H new ATOM 0 HD12 ILE A 55 14.087 5.629 -15.579 1.00 0.00 H new ATOM 0 HD13 ILE A 55 13.632 5.528 -13.861 1.00 0.00 H new ATOM 829 N ASP A 56 18.407 7.532 -11.601 1.00 0.00 N ATOM 830 CA ASP A 56 19.573 6.934 -10.961 1.00 0.00 C ATOM 831 C ASP A 56 19.307 5.434 -10.874 1.00 0.00 C ATOM 832 O ASP A 56 18.296 5.028 -10.290 1.00 0.00 O ATOM 833 CB ASP A 56 19.796 7.522 -9.562 1.00 0.00 C ATOM 834 CG ASP A 56 21.026 6.899 -8.871 1.00 0.00 C ATOM 835 OD1 ASP A 56 20.972 5.713 -8.466 1.00 0.00 O ATOM 836 OD2 ASP A 56 22.037 7.617 -8.704 1.00 0.00 O ATOM 0 H ASP A 56 17.699 7.860 -10.944 1.00 0.00 H new ATOM 0 HA ASP A 56 20.474 7.140 -11.538 1.00 0.00 H new ATOM 0 HB2 ASP A 56 19.929 8.601 -9.638 1.00 0.00 H new ATOM 0 HB3 ASP A 56 18.910 7.352 -8.950 1.00 0.00 H new ATOM 841 N ILE A 57 20.179 4.627 -11.481 1.00 0.00 N ATOM 842 CA ILE A 57 20.189 3.171 -11.293 1.00 0.00 C ATOM 843 C ILE A 57 21.437 2.749 -10.500 1.00 0.00 C ATOM 844 O ILE A 57 21.426 1.725 -9.826 1.00 0.00 O ATOM 845 CB ILE A 57 20.101 2.407 -12.631 1.00 0.00 C ATOM 846 CG1 ILE A 57 21.222 2.868 -13.581 1.00 0.00 C ATOM 847 CG2 ILE A 57 18.739 2.507 -13.339 1.00 0.00 C ATOM 848 CD1 ILE A 57 21.570 1.810 -14.604 1.00 0.00 C ATOM 0 H ILE A 57 20.901 4.963 -12.119 1.00 0.00 H new ATOM 0 HA ILE A 57 19.299 2.906 -10.722 1.00 0.00 H new ATOM 0 HB ILE A 57 20.224 1.355 -12.374 1.00 0.00 H new ATOM 0 HG12 ILE A 57 20.911 3.779 -14.093 1.00 0.00 H new ATOM 0 HG13 ILE A 57 22.110 3.116 -13.000 1.00 0.00 H new ATOM 0 HG21 ILE A 57 18.770 1.940 -14.270 1.00 0.00 H new ATOM 0 HG22 ILE A 57 17.962 2.100 -12.692 1.00 0.00 H new ATOM 0 HG23 ILE A 57 18.518 3.552 -13.558 1.00 0.00 H new ATOM 0 HD11 ILE A 57 22.365 2.178 -15.252 1.00 0.00 H new ATOM 0 HD12 ILE A 57 21.907 0.908 -14.094 1.00 0.00 H new ATOM 0 HD13 ILE A 57 20.689 1.580 -15.204 1.00 0.00 H new ATOM 860 N SER A 58 22.508 3.539 -10.587 1.00 0.00 N ATOM 861 CA SER A 58 23.771 3.490 -9.866 1.00 0.00 C ATOM 862 C SER A 58 23.656 2.972 -8.427 1.00 0.00 C ATOM 863 O SER A 58 24.435 2.109 -8.023 1.00 0.00 O ATOM 864 CB SER A 58 24.328 4.928 -9.861 1.00 0.00 C ATOM 865 OG SER A 58 23.857 5.679 -10.978 1.00 0.00 O ATOM 0 H SER A 58 22.505 4.319 -11.244 1.00 0.00 H new ATOM 0 HA SER A 58 24.428 2.781 -10.369 1.00 0.00 H new ATOM 0 HB2 SER A 58 24.037 5.428 -8.937 1.00 0.00 H new ATOM 0 HB3 SER A 58 25.417 4.897 -9.877 1.00 0.00 H new ATOM 0 HG SER A 58 24.228 6.585 -10.943 1.00 0.00 H new ATOM 871 N GLY A 59 22.677 3.472 -7.671 1.00 0.00 N ATOM 872 CA GLY A 59 22.481 3.144 -6.265 1.00 0.00 C ATOM 873 C GLY A 59 21.914 1.740 -6.022 1.00 0.00 C ATOM 874 O GLY A 59 21.748 1.359 -4.862 1.00 0.00 O ATOM 0 H GLY A 59 21.986 4.130 -8.030 1.00 0.00 H new ATOM 0 HA2 GLY A 59 23.435 3.234 -5.746 1.00 0.00 H new ATOM 0 HA3 GLY A 59 21.807 3.878 -5.822 1.00 0.00 H new ATOM 878 N GLN A 60 21.582 0.975 -7.071 1.00 0.00 N ATOM 879 CA GLN A 60 20.967 -0.329 -6.929 1.00 0.00 C ATOM 880 C GLN A 60 21.988 -1.387 -6.582 1.00 0.00 C ATOM 881 O GLN A 60 22.803 -1.774 -7.425 1.00 0.00 O ATOM 882 CB GLN A 60 20.283 -0.805 -8.218 1.00 0.00 C ATOM 883 CG GLN A 60 18.961 -0.063 -8.473 1.00 0.00 C ATOM 884 CD GLN A 60 18.528 0.043 -9.937 1.00 0.00 C ATOM 885 OE1 GLN A 60 17.866 1.013 -10.292 1.00 0.00 O ATOM 886 NE2 GLN A 60 18.815 -0.916 -10.805 1.00 0.00 N ATOM 0 H GLN A 60 21.738 1.254 -8.040 1.00 0.00 H new ATOM 0 HA GLN A 60 20.232 -0.205 -6.134 1.00 0.00 H new ATOM 0 HB2 GLN A 60 20.954 -0.652 -9.063 1.00 0.00 H new ATOM 0 HB3 GLN A 60 20.092 -1.876 -8.153 1.00 0.00 H new ATOM 0 HG2 GLN A 60 18.171 -0.566 -7.916 1.00 0.00 H new ATOM 0 HG3 GLN A 60 19.047 0.944 -8.065 1.00 0.00 H new ATOM 0 HE21 GLN A 60 19.365 -1.723 -10.510 1.00 0.00 H new ATOM 0 HE22 GLN A 60 18.486 -0.848 -11.768 1.00 0.00 H new ATOM 895 N THR A 61 21.839 -1.926 -5.385 1.00 0.00 N ATOM 896 CA THR A 61 22.499 -3.110 -4.917 1.00 0.00 C ATOM 897 C THR A 61 21.526 -3.743 -3.904 1.00 0.00 C ATOM 898 O THR A 61 20.777 -3.017 -3.236 1.00 0.00 O ATOM 899 CB THR A 61 23.871 -2.787 -4.283 1.00 0.00 C ATOM 900 OG1 THR A 61 23.895 -1.511 -3.649 1.00 0.00 O ATOM 901 CG2 THR A 61 24.994 -2.836 -5.321 1.00 0.00 C ATOM 0 H THR A 61 21.219 -1.520 -4.684 1.00 0.00 H new ATOM 0 HA THR A 61 22.724 -3.797 -5.733 1.00 0.00 H new ATOM 0 HB THR A 61 24.032 -3.556 -3.527 1.00 0.00 H new ATOM 0 HG1 THR A 61 24.782 -1.354 -3.263 1.00 0.00 H new ATOM 0 HG21 THR A 61 25.944 -2.604 -4.840 1.00 0.00 H new ATOM 0 HG22 THR A 61 25.042 -3.833 -5.758 1.00 0.00 H new ATOM 0 HG23 THR A 61 24.796 -2.106 -6.106 1.00 0.00 H new ATOM 909 N SER A 62 21.514 -5.074 -3.783 1.00 0.00 N ATOM 910 CA SER A 62 20.512 -5.804 -3.037 1.00 0.00 C ATOM 911 C SER A 62 21.147 -7.085 -2.505 1.00 0.00 C ATOM 912 O SER A 62 22.133 -7.594 -3.051 1.00 0.00 O ATOM 913 CB SER A 62 19.339 -6.164 -3.962 1.00 0.00 C ATOM 914 OG SER A 62 18.816 -5.029 -4.634 1.00 0.00 O ATOM 0 H SER A 62 22.217 -5.675 -4.212 1.00 0.00 H new ATOM 0 HA SER A 62 20.142 -5.194 -2.213 1.00 0.00 H new ATOM 0 HB2 SER A 62 19.670 -6.898 -4.697 1.00 0.00 H new ATOM 0 HB3 SER A 62 18.548 -6.633 -3.377 1.00 0.00 H new ATOM 0 HG SER A 62 18.305 -5.320 -5.418 1.00 0.00 H new ATOM 920 N ASP A 63 20.549 -7.603 -1.442 1.00 0.00 N ATOM 921 CA ASP A 63 20.831 -8.923 -0.893 1.00 0.00 C ATOM 922 C ASP A 63 20.353 -10.004 -1.883 1.00 0.00 C ATOM 923 O ASP A 63 19.548 -9.699 -2.777 1.00 0.00 O ATOM 924 CB ASP A 63 20.087 -9.039 0.437 1.00 0.00 C ATOM 925 CG ASP A 63 20.978 -8.671 1.635 1.00 0.00 C ATOM 926 OD1 ASP A 63 21.862 -9.476 2.015 1.00 0.00 O ATOM 927 OD2 ASP A 63 20.798 -7.567 2.207 1.00 0.00 O ATOM 0 H ASP A 63 19.831 -7.100 -0.920 1.00 0.00 H new ATOM 0 HA ASP A 63 21.900 -9.062 -0.733 1.00 0.00 H new ATOM 0 HB2 ASP A 63 19.214 -8.386 0.421 1.00 0.00 H new ATOM 0 HB3 ASP A 63 19.720 -10.058 0.559 1.00 0.00 H new ATOM 932 N PRO A 64 20.805 -11.268 -1.747 1.00 0.00 N ATOM 933 CA PRO A 64 20.270 -12.369 -2.536 1.00 0.00 C ATOM 934 C PRO A 64 18.770 -12.541 -2.262 1.00 0.00 C ATOM 935 O PRO A 64 18.302 -12.281 -1.155 1.00 0.00 O ATOM 936 CB PRO A 64 21.073 -13.607 -2.119 1.00 0.00 C ATOM 937 CG PRO A 64 21.495 -13.282 -0.685 1.00 0.00 C ATOM 938 CD PRO A 64 21.735 -11.775 -0.746 1.00 0.00 C ATOM 0 HA PRO A 64 20.363 -12.193 -3.608 1.00 0.00 H new ATOM 0 HB2 PRO A 64 20.469 -14.513 -2.166 1.00 0.00 H new ATOM 0 HB3 PRO A 64 21.935 -13.765 -2.767 1.00 0.00 H new ATOM 0 HG2 PRO A 64 20.719 -13.541 0.035 1.00 0.00 H new ATOM 0 HG3 PRO A 64 22.394 -13.825 -0.393 1.00 0.00 H new ATOM 0 HD2 PRO A 64 21.558 -11.311 0.224 1.00 0.00 H new ATOM 0 HD3 PRO A 64 22.766 -11.554 -1.022 1.00 0.00 H new ATOM 946 N ILE A 65 18.020 -13.051 -3.244 1.00 0.00 N ATOM 947 CA ILE A 65 16.558 -13.170 -3.184 1.00 0.00 C ATOM 948 C ILE A 65 16.093 -14.022 -1.993 1.00 0.00 C ATOM 949 O ILE A 65 14.992 -13.847 -1.473 1.00 0.00 O ATOM 950 CB ILE A 65 16.050 -13.711 -4.539 1.00 0.00 C ATOM 951 CG1 ILE A 65 14.553 -13.404 -4.726 1.00 0.00 C ATOM 952 CG2 ILE A 65 16.359 -15.205 -4.757 1.00 0.00 C ATOM 953 CD1 ILE A 65 14.026 -13.689 -6.140 1.00 0.00 C ATOM 0 H ILE A 65 18.417 -13.398 -4.117 1.00 0.00 H new ATOM 0 HA ILE A 65 16.122 -12.185 -3.013 1.00 0.00 H new ATOM 0 HB ILE A 65 16.608 -13.182 -5.312 1.00 0.00 H new ATOM 0 HG12 ILE A 65 13.980 -13.994 -4.011 1.00 0.00 H new ATOM 0 HG13 ILE A 65 14.376 -12.355 -4.488 1.00 0.00 H new ATOM 0 HG21 ILE A 65 15.974 -15.518 -5.728 1.00 0.00 H new ATOM 0 HG22 ILE A 65 17.437 -15.362 -4.726 1.00 0.00 H new ATOM 0 HG23 ILE A 65 15.884 -15.793 -3.972 1.00 0.00 H new ATOM 0 HD11 ILE A 65 12.964 -13.447 -6.188 1.00 0.00 H new ATOM 0 HD12 ILE A 65 14.571 -13.079 -6.861 1.00 0.00 H new ATOM 0 HD13 ILE A 65 14.169 -14.744 -6.376 1.00 0.00 H new ATOM 965 N GLU A 66 16.954 -14.934 -1.540 1.00 0.00 N ATOM 966 CA GLU A 66 16.702 -15.870 -0.483 1.00 0.00 C ATOM 967 C GLU A 66 16.554 -15.140 0.867 1.00 0.00 C ATOM 968 O GLU A 66 15.912 -15.643 1.794 1.00 0.00 O ATOM 969 CB GLU A 66 17.926 -16.796 -0.537 1.00 0.00 C ATOM 970 CG GLU A 66 18.081 -17.642 0.710 1.00 0.00 C ATOM 971 CD GLU A 66 19.169 -18.721 0.555 1.00 0.00 C ATOM 972 OE1 GLU A 66 20.364 -18.425 0.802 1.00 0.00 O ATOM 973 OE2 GLU A 66 18.834 -19.878 0.200 1.00 0.00 O ATOM 0 H GLU A 66 17.891 -15.031 -1.932 1.00 0.00 H new ATOM 0 HA GLU A 66 15.771 -16.426 -0.593 1.00 0.00 H new ATOM 0 HB2 GLU A 66 17.843 -17.450 -1.405 1.00 0.00 H new ATOM 0 HB3 GLU A 66 18.824 -16.195 -0.676 1.00 0.00 H new ATOM 0 HG2 GLU A 66 18.329 -16.998 1.554 1.00 0.00 H new ATOM 0 HG3 GLU A 66 17.129 -18.120 0.942 1.00 0.00 H new ATOM 980 N ASN A 67 17.163 -13.955 0.979 1.00 0.00 N ATOM 981 CA ASN A 67 17.161 -13.124 2.177 1.00 0.00 C ATOM 982 C ASN A 67 15.750 -12.651 2.553 1.00 0.00 C ATOM 983 O ASN A 67 15.454 -12.465 3.738 1.00 0.00 O ATOM 984 CB ASN A 67 18.053 -11.901 1.926 1.00 0.00 C ATOM 985 CG ASN A 67 18.382 -11.177 3.225 1.00 0.00 C ATOM 986 OD1 ASN A 67 17.679 -10.263 3.651 1.00 0.00 O ATOM 987 ND2 ASN A 67 19.465 -11.573 3.878 1.00 0.00 N ATOM 0 H ASN A 67 17.687 -13.538 0.210 1.00 0.00 H new ATOM 0 HA ASN A 67 17.538 -13.723 3.006 1.00 0.00 H new ATOM 0 HB2 ASN A 67 18.976 -12.216 1.439 1.00 0.00 H new ATOM 0 HB3 ASN A 67 17.550 -11.216 1.243 1.00 0.00 H new ATOM 0 HD21 ASN A 67 19.729 -11.117 4.752 1.00 0.00 H new ATOM 0 HD22 ASN A 67 20.035 -12.334 3.507 1.00 0.00 H new ATOM 994 N PHE A 68 14.887 -12.453 1.552 1.00 0.00 N ATOM 995 CA PHE A 68 13.537 -11.916 1.706 1.00 0.00 C ATOM 996 C PHE A 68 12.512 -13.059 1.772 1.00 0.00 C ATOM 997 O PHE A 68 12.871 -14.236 1.894 1.00 0.00 O ATOM 998 CB PHE A 68 13.221 -10.983 0.522 1.00 0.00 C ATOM 999 CG PHE A 68 14.358 -10.104 0.044 1.00 0.00 C ATOM 1000 CD1 PHE A 68 14.824 -9.037 0.833 1.00 0.00 C ATOM 1001 CD2 PHE A 68 14.958 -10.381 -1.196 1.00 0.00 C ATOM 1002 CE1 PHE A 68 15.896 -8.248 0.378 1.00 0.00 C ATOM 1003 CE2 PHE A 68 16.034 -9.597 -1.649 1.00 0.00 C ATOM 1004 CZ PHE A 68 16.498 -8.526 -0.863 1.00 0.00 C ATOM 0 H PHE A 68 15.119 -12.670 0.583 1.00 0.00 H new ATOM 0 HA PHE A 68 13.479 -11.350 2.636 1.00 0.00 H new ATOM 0 HB2 PHE A 68 12.884 -11.594 -0.316 1.00 0.00 H new ATOM 0 HB3 PHE A 68 12.387 -10.341 0.804 1.00 0.00 H new ATOM 0 HD1 PHE A 68 14.360 -8.824 1.785 1.00 0.00 H new ATOM 0 HD2 PHE A 68 14.592 -11.197 -1.802 1.00 0.00 H new ATOM 0 HE1 PHE A 68 16.257 -7.428 0.982 1.00 0.00 H new ATOM 0 HE2 PHE A 68 16.503 -9.816 -2.597 1.00 0.00 H new ATOM 0 HZ PHE A 68 17.318 -7.916 -1.213 1.00 0.00 H new ATOM 1014 N ASN A 69 11.222 -12.718 1.657 1.00 0.00 N ATOM 1015 CA ASN A 69 10.133 -13.659 1.471 1.00 0.00 C ATOM 1016 C ASN A 69 9.207 -13.074 0.425 1.00 0.00 C ATOM 1017 O ASN A 69 8.890 -11.884 0.491 1.00 0.00 O ATOM 1018 CB ASN A 69 9.349 -13.885 2.767 1.00 0.00 C ATOM 1019 CG ASN A 69 8.353 -15.046 2.710 1.00 0.00 C ATOM 1020 OD1 ASN A 69 7.927 -15.483 1.647 1.00 0.00 O ATOM 1021 ND2 ASN A 69 7.931 -15.551 3.858 1.00 0.00 N ATOM 0 H ASN A 69 10.908 -11.748 1.693 1.00 0.00 H new ATOM 0 HA ASN A 69 10.538 -14.623 1.163 1.00 0.00 H new ATOM 0 HB2 ASN A 69 10.055 -14.068 3.577 1.00 0.00 H new ATOM 0 HB3 ASN A 69 8.809 -12.971 3.015 1.00 0.00 H new ATOM 0 HD21 ASN A 69 7.248 -16.308 3.862 1.00 0.00 H new ATOM 0 HD22 ASN A 69 8.289 -15.183 4.739 1.00 0.00 H new ATOM 1028 N ALA A 70 8.733 -13.890 -0.512 1.00 0.00 N ATOM 1029 CA ALA A 70 7.910 -13.384 -1.575 1.00 0.00 C ATOM 1030 C ALA A 70 6.532 -13.056 -1.033 1.00 0.00 C ATOM 1031 O ALA A 70 5.851 -12.203 -1.598 1.00 0.00 O ATOM 1032 CB ALA A 70 7.824 -14.388 -2.724 1.00 0.00 C ATOM 0 H ALA A 70 8.910 -14.894 -0.546 1.00 0.00 H new ATOM 0 HA ALA A 70 8.360 -12.474 -1.972 1.00 0.00 H new ATOM 0 HB1 ALA A 70 7.195 -13.981 -3.516 1.00 0.00 H new ATOM 0 HB2 ALA A 70 8.823 -14.579 -3.116 1.00 0.00 H new ATOM 0 HB3 ALA A 70 7.392 -15.321 -2.361 1.00 0.00 H new ATOM 1038 N ASP A 71 6.140 -13.713 0.063 1.00 0.00 N ATOM 1039 CA ASP A 71 4.850 -13.499 0.673 1.00 0.00 C ATOM 1040 C ASP A 71 4.723 -12.083 1.260 1.00 0.00 C ATOM 1041 O ASP A 71 3.611 -11.568 1.398 1.00 0.00 O ATOM 1042 CB ASP A 71 4.613 -14.548 1.765 1.00 0.00 C ATOM 1043 CG ASP A 71 3.227 -14.383 2.410 1.00 0.00 C ATOM 1044 OD1 ASP A 71 2.208 -14.659 1.734 1.00 0.00 O ATOM 1045 OD2 ASP A 71 3.155 -14.024 3.611 1.00 0.00 O ATOM 0 H ASP A 71 6.717 -14.405 0.542 1.00 0.00 H new ATOM 0 HA ASP A 71 4.091 -13.601 -0.103 1.00 0.00 H new ATOM 0 HB2 ASP A 71 4.700 -15.547 1.337 1.00 0.00 H new ATOM 0 HB3 ASP A 71 5.385 -14.460 2.530 1.00 0.00 H new ATOM 1050 N ASP A 72 5.852 -11.439 1.592 1.00 0.00 N ATOM 1051 CA ASP A 72 5.872 -10.061 2.068 1.00 0.00 C ATOM 1052 C ASP A 72 5.662 -9.068 0.915 1.00 0.00 C ATOM 1053 O ASP A 72 5.126 -7.973 1.105 1.00 0.00 O ATOM 1054 CB ASP A 72 7.203 -9.761 2.755 1.00 0.00 C ATOM 1055 CG ASP A 72 7.187 -8.352 3.378 1.00 0.00 C ATOM 1056 OD1 ASP A 72 6.448 -8.137 4.370 1.00 0.00 O ATOM 1057 OD2 ASP A 72 7.935 -7.463 2.908 1.00 0.00 O ATOM 0 H ASP A 72 6.776 -11.867 1.535 1.00 0.00 H new ATOM 0 HA ASP A 72 5.054 -9.945 2.779 1.00 0.00 H new ATOM 0 HB2 ASP A 72 7.395 -10.504 3.529 1.00 0.00 H new ATOM 0 HB3 ASP A 72 8.016 -9.836 2.033 1.00 0.00 H new ATOM 1062 N TYR A 73 6.083 -9.473 -0.284 1.00 0.00 N ATOM 1063 CA TYR A 73 5.956 -8.733 -1.524 1.00 0.00 C ATOM 1064 C TYR A 73 4.569 -8.956 -2.139 1.00 0.00 C ATOM 1065 O TYR A 73 3.798 -9.812 -1.693 1.00 0.00 O ATOM 1066 CB TYR A 73 7.119 -9.099 -2.467 1.00 0.00 C ATOM 1067 CG TYR A 73 8.397 -8.364 -2.107 1.00 0.00 C ATOM 1068 CD1 TYR A 73 9.064 -8.656 -0.902 1.00 0.00 C ATOM 1069 CD2 TYR A 73 8.867 -7.321 -2.928 1.00 0.00 C ATOM 1070 CE1 TYR A 73 10.149 -7.872 -0.477 1.00 0.00 C ATOM 1071 CE2 TYR A 73 9.955 -6.534 -2.511 1.00 0.00 C ATOM 1072 CZ TYR A 73 10.587 -6.792 -1.271 1.00 0.00 C ATOM 1073 OH TYR A 73 11.618 -6.004 -0.852 1.00 0.00 O ATOM 0 H TYR A 73 6.544 -10.373 -0.415 1.00 0.00 H new ATOM 0 HA TYR A 73 6.031 -7.662 -1.335 1.00 0.00 H new ATOM 0 HB2 TYR A 73 7.295 -10.174 -2.425 1.00 0.00 H new ATOM 0 HB3 TYR A 73 6.841 -8.861 -3.494 1.00 0.00 H new ATOM 0 HD1 TYR A 73 8.738 -9.491 -0.299 1.00 0.00 H new ATOM 0 HD2 TYR A 73 8.392 -7.126 -3.878 1.00 0.00 H new ATOM 0 HE1 TYR A 73 10.646 -8.096 0.455 1.00 0.00 H new ATOM 0 HE2 TYR A 73 10.310 -5.730 -3.139 1.00 0.00 H new ATOM 0 HH TYR A 73 12.230 -6.533 -0.299 1.00 0.00 H new ATOM 1083 N ASP A 74 4.234 -8.154 -3.153 1.00 0.00 N ATOM 1084 CA ASP A 74 2.959 -8.257 -3.868 1.00 0.00 C ATOM 1085 C ASP A 74 3.171 -8.666 -5.321 1.00 0.00 C ATOM 1086 O ASP A 74 2.395 -9.456 -5.861 1.00 0.00 O ATOM 1087 CB ASP A 74 2.209 -6.928 -3.792 1.00 0.00 C ATOM 1088 CG ASP A 74 0.859 -7.024 -4.526 1.00 0.00 C ATOM 1089 OD1 ASP A 74 -0.118 -7.511 -3.907 1.00 0.00 O ATOM 1090 OD2 ASP A 74 0.763 -6.562 -5.688 1.00 0.00 O ATOM 0 H ASP A 74 4.841 -7.413 -3.502 1.00 0.00 H new ATOM 0 HA ASP A 74 2.361 -9.032 -3.389 1.00 0.00 H new ATOM 0 HB2 ASP A 74 2.044 -6.657 -2.749 1.00 0.00 H new ATOM 0 HB3 ASP A 74 2.814 -6.137 -4.235 1.00 0.00 H new ATOM 1095 N VAL A 75 4.250 -8.184 -5.947 1.00 0.00 N ATOM 1096 CA VAL A 75 4.485 -8.341 -7.371 1.00 0.00 C ATOM 1097 C VAL A 75 5.968 -8.621 -7.619 1.00 0.00 C ATOM 1098 O VAL A 75 6.846 -8.008 -7.007 1.00 0.00 O ATOM 1099 CB VAL A 75 3.928 -7.103 -8.117 1.00 0.00 C ATOM 1100 CG1 VAL A 75 3.940 -5.765 -7.356 1.00 0.00 C ATOM 1101 CG2 VAL A 75 4.558 -6.929 -9.507 1.00 0.00 C ATOM 0 H VAL A 75 4.988 -7.669 -5.466 1.00 0.00 H new ATOM 0 HA VAL A 75 3.952 -9.203 -7.772 1.00 0.00 H new ATOM 0 HB VAL A 75 2.871 -7.352 -8.214 1.00 0.00 H new ATOM 0 HG11 VAL A 75 3.524 -4.982 -7.990 1.00 0.00 H new ATOM 0 HG12 VAL A 75 3.340 -5.856 -6.451 1.00 0.00 H new ATOM 0 HG13 VAL A 75 4.965 -5.508 -7.087 1.00 0.00 H new ATOM 0 HG21 VAL A 75 4.135 -6.048 -9.990 1.00 0.00 H new ATOM 0 HG22 VAL A 75 5.636 -6.805 -9.405 1.00 0.00 H new ATOM 0 HG23 VAL A 75 4.350 -7.810 -10.114 1.00 0.00 H new ATOM 1111 N VAL A 76 6.257 -9.540 -8.538 1.00 0.00 N ATOM 1112 CA VAL A 76 7.609 -9.961 -8.862 1.00 0.00 C ATOM 1113 C VAL A 76 7.653 -10.139 -10.378 1.00 0.00 C ATOM 1114 O VAL A 76 6.694 -10.635 -10.976 1.00 0.00 O ATOM 1115 CB VAL A 76 7.928 -11.261 -8.099 1.00 0.00 C ATOM 1116 CG1 VAL A 76 9.298 -11.849 -8.483 1.00 0.00 C ATOM 1117 CG2 VAL A 76 7.897 -11.088 -6.566 1.00 0.00 C ATOM 0 H VAL A 76 5.542 -10.019 -9.086 1.00 0.00 H new ATOM 0 HA VAL A 76 8.363 -9.233 -8.564 1.00 0.00 H new ATOM 0 HB VAL A 76 7.135 -11.947 -8.397 1.00 0.00 H new ATOM 0 HG11 VAL A 76 9.473 -12.764 -7.917 1.00 0.00 H new ATOM 0 HG12 VAL A 76 9.311 -12.074 -9.549 1.00 0.00 H new ATOM 0 HG13 VAL A 76 10.081 -11.126 -8.255 1.00 0.00 H new ATOM 0 HG21 VAL A 76 8.130 -12.039 -6.088 1.00 0.00 H new ATOM 0 HG22 VAL A 76 8.635 -10.342 -6.269 1.00 0.00 H new ATOM 0 HG23 VAL A 76 6.905 -10.760 -6.257 1.00 0.00 H new ATOM 1127 N ILE A 77 8.753 -9.723 -11.001 1.00 0.00 N ATOM 1128 CA ILE A 77 8.935 -9.712 -12.440 1.00 0.00 C ATOM 1129 C ILE A 77 10.278 -10.357 -12.715 1.00 0.00 C ATOM 1130 O ILE A 77 11.295 -9.941 -12.146 1.00 0.00 O ATOM 1131 CB ILE A 77 8.934 -8.255 -12.954 1.00 0.00 C ATOM 1132 CG1 ILE A 77 7.650 -7.481 -12.589 1.00 0.00 C ATOM 1133 CG2 ILE A 77 9.246 -8.158 -14.460 1.00 0.00 C ATOM 1134 CD1 ILE A 77 6.371 -7.996 -13.256 1.00 0.00 C ATOM 0 H ILE A 77 9.567 -9.373 -10.495 1.00 0.00 H new ATOM 0 HA ILE A 77 8.132 -10.250 -12.944 1.00 0.00 H new ATOM 0 HB ILE A 77 9.750 -7.764 -12.424 1.00 0.00 H new ATOM 0 HG12 ILE A 77 7.517 -7.517 -11.508 1.00 0.00 H new ATOM 0 HG13 ILE A 77 7.786 -6.434 -12.859 1.00 0.00 H new ATOM 0 HG21 ILE A 77 9.232 -7.112 -14.768 1.00 0.00 H new ATOM 0 HG22 ILE A 77 10.231 -8.581 -14.655 1.00 0.00 H new ATOM 0 HG23 ILE A 77 8.495 -8.712 -15.024 1.00 0.00 H new ATOM 0 HD11 ILE A 77 5.524 -7.388 -12.937 1.00 0.00 H new ATOM 0 HD12 ILE A 77 6.475 -7.934 -14.339 1.00 0.00 H new ATOM 0 HD13 ILE A 77 6.202 -9.033 -12.967 1.00 0.00 H new ATOM 1146 N SER A 78 10.298 -11.348 -13.594 1.00 0.00 N ATOM 1147 CA SER A 78 11.540 -11.871 -14.104 1.00 0.00 C ATOM 1148 C SER A 78 11.920 -11.005 -15.302 1.00 0.00 C ATOM 1149 O SER A 78 11.105 -10.696 -16.173 1.00 0.00 O ATOM 1150 CB SER A 78 11.406 -13.356 -14.420 1.00 0.00 C ATOM 1151 OG SER A 78 11.466 -14.094 -13.208 1.00 0.00 O ATOM 0 H SER A 78 9.463 -11.801 -13.964 1.00 0.00 H new ATOM 0 HA SER A 78 12.345 -11.821 -13.371 1.00 0.00 H new ATOM 0 HB2 SER A 78 10.463 -13.548 -14.932 1.00 0.00 H new ATOM 0 HB3 SER A 78 12.204 -13.671 -15.093 1.00 0.00 H new ATOM 0 HG SER A 78 10.615 -14.558 -13.065 1.00 0.00 H new ATOM 1157 N LEU A 79 13.169 -10.546 -15.320 1.00 0.00 N ATOM 1158 CA LEU A 79 13.767 -9.893 -16.474 1.00 0.00 C ATOM 1159 C LEU A 79 14.522 -10.919 -17.312 1.00 0.00 C ATOM 1160 O LEU A 79 15.032 -10.563 -18.374 1.00 0.00 O ATOM 1161 CB LEU A 79 14.677 -8.736 -16.032 1.00 0.00 C ATOM 1162 CG LEU A 79 13.930 -7.521 -15.458 1.00 0.00 C ATOM 1163 CD1 LEU A 79 14.961 -6.562 -14.853 1.00 0.00 C ATOM 1164 CD2 LEU A 79 13.141 -6.774 -16.536 1.00 0.00 C ATOM 0 H LEU A 79 13.800 -10.620 -14.522 1.00 0.00 H new ATOM 0 HA LEU A 79 12.979 -9.463 -17.093 1.00 0.00 H new ATOM 0 HB2 LEU A 79 15.375 -9.106 -15.281 1.00 0.00 H new ATOM 0 HB3 LEU A 79 15.271 -8.411 -16.886 1.00 0.00 H new ATOM 0 HG LEU A 79 13.224 -7.876 -14.708 1.00 0.00 H new ATOM 0 HD11 LEU A 79 14.450 -5.692 -14.440 1.00 0.00 H new ATOM 0 HD12 LEU A 79 15.510 -7.071 -14.061 1.00 0.00 H new ATOM 0 HD13 LEU A 79 15.657 -6.240 -15.628 1.00 0.00 H new ATOM 0 HD21 LEU A 79 12.628 -5.923 -16.088 1.00 0.00 H new ATOM 0 HD22 LEU A 79 13.825 -6.420 -17.308 1.00 0.00 H new ATOM 0 HD23 LEU A 79 12.407 -7.446 -16.981 1.00 0.00 H new ATOM 1176 N CYS A 80 14.657 -12.156 -16.830 1.00 0.00 N ATOM 1177 CA CYS A 80 15.147 -13.287 -17.583 1.00 0.00 C ATOM 1178 C CYS A 80 14.729 -14.579 -16.863 1.00 0.00 C ATOM 1179 O CYS A 80 14.518 -14.571 -15.644 1.00 0.00 O ATOM 1180 CB CYS A 80 16.685 -13.217 -17.700 1.00 0.00 C ATOM 1181 SG CYS A 80 17.612 -13.555 -16.168 1.00 0.00 S ATOM 0 H CYS A 80 14.416 -12.395 -15.868 1.00 0.00 H new ATOM 0 HA CYS A 80 14.724 -13.274 -18.587 1.00 0.00 H new ATOM 0 HB2 CYS A 80 17.006 -13.929 -18.461 1.00 0.00 H new ATOM 0 HB3 CYS A 80 16.959 -12.224 -18.057 1.00 0.00 H new ATOM 1186 N GLY A 81 14.698 -15.694 -17.601 1.00 0.00 N ATOM 1187 CA GLY A 81 14.545 -17.033 -17.045 1.00 0.00 C ATOM 1188 C GLY A 81 13.194 -17.310 -16.372 1.00 0.00 C ATOM 1189 O GLY A 81 12.194 -16.626 -16.608 1.00 0.00 O ATOM 0 H GLY A 81 14.780 -15.686 -18.618 1.00 0.00 H new ATOM 0 HA2 GLY A 81 14.691 -17.760 -17.844 1.00 0.00 H new ATOM 0 HA3 GLY A 81 15.337 -17.199 -16.315 1.00 0.00 H new ATOM 1193 N SER A 82 13.197 -18.356 -15.545 1.00 0.00 N ATOM 1194 CA SER A 82 12.037 -18.956 -14.885 1.00 0.00 C ATOM 1195 C SER A 82 12.474 -19.383 -13.471 1.00 0.00 C ATOM 1196 O SER A 82 13.513 -18.931 -12.987 1.00 0.00 O ATOM 1197 CB SER A 82 11.551 -20.145 -15.747 1.00 0.00 C ATOM 1198 OG SER A 82 11.362 -19.780 -17.112 1.00 0.00 O ATOM 0 H SER A 82 14.063 -18.837 -15.303 1.00 0.00 H new ATOM 0 HA SER A 82 11.203 -18.261 -14.786 1.00 0.00 H new ATOM 0 HB2 SER A 82 12.277 -20.956 -15.687 1.00 0.00 H new ATOM 0 HB3 SER A 82 10.614 -20.526 -15.342 1.00 0.00 H new ATOM 0 HG SER A 82 11.057 -20.560 -17.620 1.00 0.00 H new ATOM 1204 N GLY A 83 11.738 -20.281 -12.804 1.00 0.00 N ATOM 1205 CA GLY A 83 12.137 -20.883 -11.529 1.00 0.00 C ATOM 1206 C GLY A 83 13.272 -21.900 -11.713 1.00 0.00 C ATOM 1207 O GLY A 83 13.079 -23.091 -11.466 1.00 0.00 O ATOM 0 H GLY A 83 10.835 -20.614 -13.142 1.00 0.00 H new ATOM 0 HA2 GLY A 83 12.457 -20.100 -10.841 1.00 0.00 H new ATOM 0 HA3 GLY A 83 11.277 -21.375 -11.074 1.00 0.00 H new ATOM 1211 N VAL A 84 14.432 -21.454 -12.207 1.00 0.00 N ATOM 1212 CA VAL A 84 15.533 -22.321 -12.637 1.00 0.00 C ATOM 1213 C VAL A 84 16.324 -22.842 -11.425 1.00 0.00 C ATOM 1214 O VAL A 84 16.439 -24.051 -11.215 1.00 0.00 O ATOM 1215 CB VAL A 84 16.391 -21.609 -13.714 1.00 0.00 C ATOM 1216 CG1 VAL A 84 15.627 -21.581 -15.046 1.00 0.00 C ATOM 1217 CG2 VAL A 84 16.840 -20.170 -13.385 1.00 0.00 C ATOM 0 H VAL A 84 14.635 -20.461 -12.321 1.00 0.00 H new ATOM 0 HA VAL A 84 15.136 -23.213 -13.121 1.00 0.00 H new ATOM 0 HB VAL A 84 17.305 -22.200 -13.763 1.00 0.00 H new ATOM 0 HG11 VAL A 84 16.232 -21.080 -15.802 1.00 0.00 H new ATOM 0 HG12 VAL A 84 15.417 -22.601 -15.367 1.00 0.00 H new ATOM 0 HG13 VAL A 84 14.689 -21.042 -14.916 1.00 0.00 H new ATOM 0 HG21 VAL A 84 17.433 -19.776 -14.211 1.00 0.00 H new ATOM 0 HG22 VAL A 84 15.963 -19.540 -13.235 1.00 0.00 H new ATOM 0 HG23 VAL A 84 17.442 -20.175 -12.476 1.00 0.00 H new ATOM 1227 N ASN A 85 16.820 -21.920 -10.598 1.00 0.00 N ATOM 1228 CA ASN A 85 17.418 -22.146 -9.278 1.00 0.00 C ATOM 1229 C ASN A 85 16.977 -20.938 -8.448 1.00 0.00 C ATOM 1230 O ASN A 85 17.776 -20.194 -7.881 1.00 0.00 O ATOM 1231 CB ASN A 85 18.948 -22.291 -9.373 1.00 0.00 C ATOM 1232 CG ASN A 85 19.589 -22.608 -8.017 1.00 0.00 C ATOM 1233 OD1 ASN A 85 18.935 -23.063 -7.079 1.00 0.00 O ATOM 1234 ND2 ASN A 85 20.893 -22.413 -7.890 1.00 0.00 N ATOM 0 H ASN A 85 16.815 -20.931 -10.847 1.00 0.00 H new ATOM 0 HA ASN A 85 17.091 -23.078 -8.818 1.00 0.00 H new ATOM 0 HB2 ASN A 85 19.192 -23.083 -10.081 1.00 0.00 H new ATOM 0 HB3 ASN A 85 19.374 -21.368 -9.767 1.00 0.00 H new ATOM 0 HD21 ASN A 85 21.360 -22.640 -7.012 1.00 0.00 H new ATOM 0 HD22 ASN A 85 21.431 -22.036 -8.670 1.00 0.00 H new ATOM 1241 N LEU A 86 15.669 -20.676 -8.526 1.00 0.00 N ATOM 1242 CA LEU A 86 14.977 -19.487 -8.059 1.00 0.00 C ATOM 1243 C LEU A 86 13.625 -19.999 -7.543 1.00 0.00 C ATOM 1244 O LEU A 86 12.912 -20.619 -8.334 1.00 0.00 O ATOM 1245 CB LEU A 86 14.878 -18.568 -9.299 1.00 0.00 C ATOM 1246 CG LEU A 86 14.253 -17.166 -9.155 1.00 0.00 C ATOM 1247 CD1 LEU A 86 14.598 -16.388 -10.432 1.00 0.00 C ATOM 1248 CD2 LEU A 86 12.733 -17.212 -9.008 1.00 0.00 C ATOM 0 H LEU A 86 15.025 -21.344 -8.950 1.00 0.00 H new ATOM 0 HA LEU A 86 15.453 -18.920 -7.259 1.00 0.00 H new ATOM 0 HB2 LEU A 86 15.887 -18.438 -9.691 1.00 0.00 H new ATOM 0 HB3 LEU A 86 14.308 -19.104 -10.058 1.00 0.00 H new ATOM 0 HG LEU A 86 14.649 -16.696 -8.255 1.00 0.00 H new ATOM 0 HD11 LEU A 86 14.174 -15.386 -10.373 1.00 0.00 H new ATOM 0 HD12 LEU A 86 15.681 -16.318 -10.534 1.00 0.00 H new ATOM 0 HD13 LEU A 86 14.185 -16.907 -11.297 1.00 0.00 H new ATOM 0 HD21 LEU A 86 12.346 -16.198 -8.910 1.00 0.00 H new ATOM 0 HD22 LEU A 86 12.296 -17.684 -9.888 1.00 0.00 H new ATOM 0 HD23 LEU A 86 12.471 -17.788 -8.120 1.00 0.00 H new ATOM 1260 N PRO A 87 13.275 -19.824 -6.252 1.00 0.00 N ATOM 1261 CA PRO A 87 12.101 -20.476 -5.677 1.00 0.00 C ATOM 1262 C PRO A 87 10.805 -20.074 -6.389 1.00 0.00 C ATOM 1263 O PRO A 87 10.603 -18.885 -6.645 1.00 0.00 O ATOM 1264 CB PRO A 87 12.084 -20.097 -4.194 1.00 0.00 C ATOM 1265 CG PRO A 87 13.556 -19.839 -3.887 1.00 0.00 C ATOM 1266 CD PRO A 87 14.096 -19.251 -5.191 1.00 0.00 C ATOM 0 HA PRO A 87 12.161 -21.557 -5.802 1.00 0.00 H new ATOM 0 HB2 PRO A 87 11.473 -19.213 -4.011 1.00 0.00 H new ATOM 0 HB3 PRO A 87 11.678 -20.899 -3.577 1.00 0.00 H new ATOM 0 HG2 PRO A 87 13.677 -19.146 -3.054 1.00 0.00 H new ATOM 0 HG3 PRO A 87 14.076 -20.758 -3.615 1.00 0.00 H new ATOM 0 HD2 PRO A 87 14.028 -18.163 -5.188 1.00 0.00 H new ATOM 0 HD3 PRO A 87 15.147 -19.504 -5.329 1.00 0.00 H new ATOM 1274 N PRO A 88 9.877 -21.008 -6.659 1.00 0.00 N ATOM 1275 CA PRO A 88 8.677 -20.705 -7.432 1.00 0.00 C ATOM 1276 C PRO A 88 7.703 -19.789 -6.692 1.00 0.00 C ATOM 1277 O PRO A 88 6.850 -19.173 -7.323 1.00 0.00 O ATOM 1278 CB PRO A 88 8.061 -22.063 -7.781 1.00 0.00 C ATOM 1279 CG PRO A 88 8.523 -22.961 -6.632 1.00 0.00 C ATOM 1280 CD PRO A 88 9.923 -22.427 -6.332 1.00 0.00 C ATOM 0 HA PRO A 88 8.925 -20.139 -8.330 1.00 0.00 H new ATOM 0 HB2 PRO A 88 6.974 -22.009 -7.838 1.00 0.00 H new ATOM 0 HB3 PRO A 88 8.413 -22.429 -8.745 1.00 0.00 H new ATOM 0 HG2 PRO A 88 7.865 -22.882 -5.766 1.00 0.00 H new ATOM 0 HG3 PRO A 88 8.544 -24.012 -6.922 1.00 0.00 H new ATOM 0 HD2 PRO A 88 10.185 -22.580 -5.285 1.00 0.00 H new ATOM 0 HD3 PRO A 88 10.676 -22.943 -6.928 1.00 0.00 H new ATOM 1288 N GLU A 89 7.871 -19.611 -5.381 1.00 0.00 N ATOM 1289 CA GLU A 89 7.163 -18.661 -4.565 1.00 0.00 C ATOM 1290 C GLU A 89 7.368 -17.228 -5.088 1.00 0.00 C ATOM 1291 O GLU A 89 6.486 -16.383 -4.927 1.00 0.00 O ATOM 1292 CB GLU A 89 7.735 -18.949 -3.168 1.00 0.00 C ATOM 1293 CG GLU A 89 7.542 -17.837 -2.171 1.00 0.00 C ATOM 1294 CD GLU A 89 7.814 -18.319 -0.736 1.00 0.00 C ATOM 1295 OE1 GLU A 89 8.988 -18.279 -0.292 1.00 0.00 O ATOM 1296 OE2 GLU A 89 6.858 -18.759 -0.052 1.00 0.00 O ATOM 0 H GLU A 89 8.543 -20.161 -4.845 1.00 0.00 H new ATOM 0 HA GLU A 89 6.077 -18.752 -4.567 1.00 0.00 H new ATOM 0 HB2 GLU A 89 7.269 -19.854 -2.778 1.00 0.00 H new ATOM 0 HB3 GLU A 89 8.801 -19.155 -3.262 1.00 0.00 H new ATOM 0 HG2 GLU A 89 8.210 -17.010 -2.412 1.00 0.00 H new ATOM 0 HG3 GLU A 89 6.524 -17.455 -2.242 1.00 0.00 H new ATOM 1303 N TRP A 90 8.476 -16.967 -5.790 1.00 0.00 N ATOM 1304 CA TRP A 90 8.726 -15.701 -6.465 1.00 0.00 C ATOM 1305 C TRP A 90 7.971 -15.605 -7.787 1.00 0.00 C ATOM 1306 O TRP A 90 7.387 -14.566 -8.089 1.00 0.00 O ATOM 1307 CB TRP A 90 10.238 -15.526 -6.639 1.00 0.00 C ATOM 1308 CG TRP A 90 10.943 -15.352 -5.333 1.00 0.00 C ATOM 1309 CD1 TRP A 90 11.656 -16.285 -4.670 1.00 0.00 C ATOM 1310 CD2 TRP A 90 10.918 -14.191 -4.462 1.00 0.00 C ATOM 1311 NE1 TRP A 90 12.024 -15.800 -3.428 1.00 0.00 N ATOM 1312 CE2 TRP A 90 11.561 -14.513 -3.233 1.00 0.00 C ATOM 1313 CE3 TRP A 90 10.367 -12.906 -4.586 1.00 0.00 C ATOM 1314 CZ2 TRP A 90 11.634 -13.598 -2.172 1.00 0.00 C ATOM 1315 CZ3 TRP A 90 10.387 -11.999 -3.516 1.00 0.00 C ATOM 1316 CH2 TRP A 90 11.030 -12.336 -2.315 1.00 0.00 C ATOM 0 H TRP A 90 9.232 -17.643 -5.903 1.00 0.00 H new ATOM 0 HA TRP A 90 8.347 -14.882 -5.854 1.00 0.00 H new ATOM 0 HB2 TRP A 90 10.645 -16.395 -7.156 1.00 0.00 H new ATOM 0 HB3 TRP A 90 10.431 -14.660 -7.272 1.00 0.00 H new ATOM 0 HD1 TRP A 90 11.903 -17.265 -5.052 1.00 0.00 H new ATOM 0 HE1 TRP A 90 12.568 -16.325 -2.743 1.00 0.00 H new ATOM 0 HE3 TRP A 90 9.919 -12.610 -5.523 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 12.147 -13.859 -1.258 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 9.906 -11.037 -3.617 1.00 0.00 H new ATOM 0 HH2 TRP A 90 11.061 -11.627 -1.501 1.00 0.00 H new ATOM 1327 N VAL A 91 7.932 -16.688 -8.561 1.00 0.00 N ATOM 1328 CA VAL A 91 7.334 -16.701 -9.891 1.00 0.00 C ATOM 1329 C VAL A 91 5.797 -16.809 -9.841 1.00 0.00 C ATOM 1330 O VAL A 91 5.152 -16.851 -10.887 1.00 0.00 O ATOM 1331 CB VAL A 91 8.014 -17.737 -10.814 1.00 0.00 C ATOM 1332 CG1 VAL A 91 9.540 -17.771 -10.632 1.00 0.00 C ATOM 1333 CG2 VAL A 91 7.457 -19.167 -10.719 1.00 0.00 C ATOM 0 H VAL A 91 8.319 -17.589 -8.278 1.00 0.00 H new ATOM 0 HA VAL A 91 7.529 -15.732 -10.351 1.00 0.00 H new ATOM 0 HB VAL A 91 7.769 -17.375 -11.813 1.00 0.00 H new ATOM 0 HG11 VAL A 91 9.970 -18.515 -11.303 1.00 0.00 H new ATOM 0 HG12 VAL A 91 9.956 -16.790 -10.863 1.00 0.00 H new ATOM 0 HG13 VAL A 91 9.778 -18.032 -9.601 1.00 0.00 H new ATOM 0 HG21 VAL A 91 8.001 -19.816 -11.405 1.00 0.00 H new ATOM 0 HG22 VAL A 91 7.575 -19.536 -9.700 1.00 0.00 H new ATOM 0 HG23 VAL A 91 6.400 -19.164 -10.984 1.00 0.00 H new ATOM 1343 N THR A 92 5.197 -16.876 -8.645 1.00 0.00 N ATOM 1344 CA THR A 92 3.757 -17.071 -8.483 1.00 0.00 C ATOM 1345 C THR A 92 3.137 -16.091 -7.461 1.00 0.00 C ATOM 1346 O THR A 92 2.204 -16.429 -6.727 1.00 0.00 O ATOM 1347 CB THR A 92 3.504 -18.587 -8.276 1.00 0.00 C ATOM 1348 OG1 THR A 92 2.199 -18.984 -8.672 1.00 0.00 O ATOM 1349 CG2 THR A 92 3.772 -19.072 -6.845 1.00 0.00 C ATOM 0 H THR A 92 5.702 -16.796 -7.762 1.00 0.00 H new ATOM 0 HA THR A 92 3.205 -16.795 -9.381 1.00 0.00 H new ATOM 0 HB THR A 92 4.233 -19.066 -8.929 1.00 0.00 H new ATOM 0 HG1 THR A 92 2.091 -19.947 -8.523 1.00 0.00 H new ATOM 0 HG21 THR A 92 3.573 -20.142 -6.780 1.00 0.00 H new ATOM 0 HG22 THR A 92 4.813 -18.880 -6.585 1.00 0.00 H new ATOM 0 HG23 THR A 92 3.121 -18.539 -6.152 1.00 0.00 H new ATOM 1357 N GLN A 93 3.653 -14.852 -7.405 1.00 0.00 N ATOM 1358 CA GLN A 93 3.009 -13.779 -6.655 1.00 0.00 C ATOM 1359 C GLN A 93 1.723 -13.326 -7.378 1.00 0.00 C ATOM 1360 O GLN A 93 1.358 -13.904 -8.407 1.00 0.00 O ATOM 1361 CB GLN A 93 4.021 -12.654 -6.345 1.00 0.00 C ATOM 1362 CG GLN A 93 5.014 -13.087 -5.251 1.00 0.00 C ATOM 1363 CD GLN A 93 4.300 -13.556 -3.974 1.00 0.00 C ATOM 1364 OE1 GLN A 93 3.387 -12.902 -3.475 1.00 0.00 O ATOM 1365 NE2 GLN A 93 4.633 -14.737 -3.470 1.00 0.00 N ATOM 0 H GLN A 93 4.516 -14.576 -7.873 1.00 0.00 H new ATOM 0 HA GLN A 93 2.680 -14.136 -5.679 1.00 0.00 H new ATOM 0 HB2 GLN A 93 4.566 -12.391 -7.252 1.00 0.00 H new ATOM 0 HB3 GLN A 93 3.488 -11.760 -6.023 1.00 0.00 H new ATOM 0 HG2 GLN A 93 5.642 -13.893 -5.631 1.00 0.00 H new ATOM 0 HG3 GLN A 93 5.674 -12.254 -5.011 1.00 0.00 H new ATOM 0 HE21 GLN A 93 5.392 -15.275 -3.889 1.00 0.00 H new ATOM 0 HE22 GLN A 93 4.130 -15.107 -2.664 1.00 0.00 H new ATOM 1374 N GLU A 94 1.014 -12.322 -6.839 1.00 0.00 N ATOM 1375 CA GLU A 94 -0.335 -11.951 -7.298 1.00 0.00 C ATOM 1376 C GLU A 94 -0.357 -11.606 -8.797 1.00 0.00 C ATOM 1377 O GLU A 94 -1.366 -11.810 -9.476 1.00 0.00 O ATOM 1378 CB GLU A 94 -0.889 -10.781 -6.466 1.00 0.00 C ATOM 1379 CG GLU A 94 -1.087 -11.111 -4.979 1.00 0.00 C ATOM 1380 CD GLU A 94 -2.101 -12.250 -4.760 1.00 0.00 C ATOM 1381 OE1 GLU A 94 -3.328 -11.996 -4.845 1.00 0.00 O ATOM 1382 OE2 GLU A 94 -1.684 -13.404 -4.494 1.00 0.00 O ATOM 0 H GLU A 94 1.359 -11.744 -6.073 1.00 0.00 H new ATOM 0 HA GLU A 94 -0.977 -12.820 -7.153 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -0.209 -9.933 -6.552 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -1.844 -10.468 -6.889 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -0.129 -11.392 -4.541 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -1.428 -10.219 -4.454 1.00 0.00 H new ATOM 1389 N ILE A 95 0.769 -11.112 -9.308 1.00 0.00 N ATOM 1390 CA ILE A 95 1.064 -10.937 -10.717 1.00 0.00 C ATOM 1391 C ILE A 95 2.506 -11.426 -10.867 1.00 0.00 C ATOM 1392 O ILE A 95 3.363 -11.141 -10.019 1.00 0.00 O ATOM 1393 CB ILE A 95 0.830 -9.482 -11.197 1.00 0.00 C ATOM 1394 CG1 ILE A 95 1.405 -9.259 -12.618 1.00 0.00 C ATOM 1395 CG2 ILE A 95 1.424 -8.478 -10.199 1.00 0.00 C ATOM 1396 CD1 ILE A 95 0.901 -7.994 -13.331 1.00 0.00 C ATOM 0 H ILE A 95 1.539 -10.808 -8.712 1.00 0.00 H new ATOM 0 HA ILE A 95 0.393 -11.506 -11.361 1.00 0.00 H new ATOM 0 HB ILE A 95 -0.246 -9.315 -11.247 1.00 0.00 H new ATOM 0 HG12 ILE A 95 2.492 -9.211 -12.551 1.00 0.00 H new ATOM 0 HG13 ILE A 95 1.161 -10.126 -13.232 1.00 0.00 H new ATOM 0 HG21 ILE A 95 1.248 -7.463 -10.556 1.00 0.00 H new ATOM 0 HG22 ILE A 95 0.950 -8.608 -9.226 1.00 0.00 H new ATOM 0 HG23 ILE A 95 2.496 -8.649 -10.105 1.00 0.00 H new ATOM 0 HD11 ILE A 95 1.359 -7.925 -14.318 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -0.183 -8.043 -13.437 1.00 0.00 H new ATOM 0 HD13 ILE A 95 1.168 -7.115 -12.745 1.00 0.00 H new ATOM 1408 N PHE A 96 2.761 -12.156 -11.946 1.00 0.00 N ATOM 1409 CA PHE A 96 4.091 -12.526 -12.382 1.00 0.00 C ATOM 1410 C PHE A 96 4.156 -12.219 -13.876 1.00 0.00 C ATOM 1411 O PHE A 96 3.167 -12.428 -14.588 1.00 0.00 O ATOM 1412 CB PHE A 96 4.391 -13.996 -12.099 1.00 0.00 C ATOM 1413 CG PHE A 96 5.741 -14.414 -12.648 1.00 0.00 C ATOM 1414 CD1 PHE A 96 6.921 -13.907 -12.071 1.00 0.00 C ATOM 1415 CD2 PHE A 96 5.819 -15.269 -13.765 1.00 0.00 C ATOM 1416 CE1 PHE A 96 8.170 -14.261 -12.605 1.00 0.00 C ATOM 1417 CE2 PHE A 96 7.071 -15.621 -14.300 1.00 0.00 C ATOM 1418 CZ PHE A 96 8.246 -15.120 -13.716 1.00 0.00 C ATOM 0 H PHE A 96 2.025 -12.514 -12.554 1.00 0.00 H new ATOM 0 HA PHE A 96 4.847 -11.963 -11.835 1.00 0.00 H new ATOM 0 HB2 PHE A 96 4.367 -14.171 -11.023 1.00 0.00 H new ATOM 0 HB3 PHE A 96 3.612 -14.617 -12.541 1.00 0.00 H new ATOM 0 HD1 PHE A 96 6.865 -13.246 -11.218 1.00 0.00 H new ATOM 0 HD2 PHE A 96 4.915 -15.655 -14.212 1.00 0.00 H new ATOM 0 HE1 PHE A 96 9.075 -13.873 -12.162 1.00 0.00 H new ATOM 0 HE2 PHE A 96 7.129 -16.275 -15.158 1.00 0.00 H new ATOM 0 HZ PHE A 96 9.209 -15.395 -14.121 1.00 0.00 H new ATOM 1428 N GLU A 97 5.301 -11.737 -14.346 1.00 0.00 N ATOM 1429 CA GLU A 97 5.603 -11.558 -15.758 1.00 0.00 C ATOM 1430 C GLU A 97 7.070 -11.937 -15.943 1.00 0.00 C ATOM 1431 O GLU A 97 7.872 -11.780 -15.015 1.00 0.00 O ATOM 1432 CB GLU A 97 5.407 -10.100 -16.219 1.00 0.00 C ATOM 1433 CG GLU A 97 4.010 -9.485 -16.010 1.00 0.00 C ATOM 1434 CD GLU A 97 2.934 -9.944 -17.018 1.00 0.00 C ATOM 1435 OE1 GLU A 97 3.078 -10.991 -17.696 1.00 0.00 O ATOM 1436 OE2 GLU A 97 1.905 -9.226 -17.132 1.00 0.00 O ATOM 0 H GLU A 97 6.067 -11.452 -13.735 1.00 0.00 H new ATOM 0 HA GLU A 97 4.929 -12.176 -16.350 1.00 0.00 H new ATOM 0 HB2 GLU A 97 6.133 -9.478 -15.696 1.00 0.00 H new ATOM 0 HB3 GLU A 97 5.647 -10.045 -17.281 1.00 0.00 H new ATOM 0 HG2 GLU A 97 3.670 -9.728 -15.003 1.00 0.00 H new ATOM 0 HG3 GLU A 97 4.096 -8.400 -16.064 1.00 0.00 H new ATOM 1443 N ASP A 98 7.430 -12.401 -17.139 1.00 0.00 N ATOM 1444 CA ASP A 98 8.817 -12.590 -17.546 1.00 0.00 C ATOM 1445 C ASP A 98 9.015 -11.821 -18.844 1.00 0.00 C ATOM 1446 O ASP A 98 8.221 -11.992 -19.779 1.00 0.00 O ATOM 1447 CB ASP A 98 9.210 -14.055 -17.716 1.00 0.00 C ATOM 1448 CG ASP A 98 10.604 -14.125 -18.373 1.00 0.00 C ATOM 1449 OD1 ASP A 98 11.584 -13.610 -17.783 1.00 0.00 O ATOM 1450 OD2 ASP A 98 10.702 -14.679 -19.497 1.00 0.00 O ATOM 0 H ASP A 98 6.756 -12.659 -17.860 1.00 0.00 H new ATOM 0 HA ASP A 98 9.467 -12.215 -16.756 1.00 0.00 H new ATOM 0 HB2 ASP A 98 9.224 -14.556 -16.748 1.00 0.00 H new ATOM 0 HB3 ASP A 98 8.476 -14.573 -18.333 1.00 0.00 H new ATOM 1455 N TRP A 99 10.033 -10.962 -18.899 1.00 0.00 N ATOM 1456 CA TRP A 99 10.277 -10.049 -20.012 1.00 0.00 C ATOM 1457 C TRP A 99 11.603 -10.388 -20.702 1.00 0.00 C ATOM 1458 O TRP A 99 12.505 -10.967 -20.093 1.00 0.00 O ATOM 1459 CB TRP A 99 10.273 -8.586 -19.537 1.00 0.00 C ATOM 1460 CG TRP A 99 9.066 -8.021 -18.838 1.00 0.00 C ATOM 1461 CD1 TRP A 99 9.134 -7.123 -17.828 1.00 0.00 C ATOM 1462 CD2 TRP A 99 7.636 -8.176 -19.117 1.00 0.00 C ATOM 1463 NE1 TRP A 99 7.869 -6.715 -17.465 1.00 0.00 N ATOM 1464 CE2 TRP A 99 6.907 -7.312 -18.243 1.00 0.00 C ATOM 1465 CE3 TRP A 99 6.871 -8.913 -20.049 1.00 0.00 C ATOM 1466 CZ2 TRP A 99 5.513 -7.173 -18.298 1.00 0.00 C ATOM 1467 CZ3 TRP A 99 5.467 -8.804 -20.096 1.00 0.00 C ATOM 1468 CH2 TRP A 99 4.787 -7.929 -19.232 1.00 0.00 C ATOM 0 H TRP A 99 10.725 -10.881 -18.154 1.00 0.00 H new ATOM 0 HA TRP A 99 9.469 -10.171 -20.733 1.00 0.00 H new ATOM 0 HB2 TRP A 99 11.123 -8.462 -18.866 1.00 0.00 H new ATOM 0 HB3 TRP A 99 10.462 -7.962 -20.410 1.00 0.00 H new ATOM 0 HD1 TRP A 99 10.049 -6.776 -17.372 1.00 0.00 H new ATOM 0 HE1 TRP A 99 7.672 -6.054 -16.714 1.00 0.00 H new ATOM 0 HE3 TRP A 99 7.373 -9.574 -20.740 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 5.004 -6.493 -17.631 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 4.908 -9.399 -20.803 1.00 0.00 H new ATOM 0 HH2 TRP A 99 3.712 -7.839 -19.286 1.00 0.00 H new ATOM 1479 N GLN A 100 11.744 -9.963 -21.965 1.00 0.00 N ATOM 1480 CA GLN A 100 12.907 -10.240 -22.809 1.00 0.00 C ATOM 1481 C GLN A 100 13.564 -8.938 -23.298 1.00 0.00 C ATOM 1482 O GLN A 100 13.972 -8.835 -24.456 1.00 0.00 O ATOM 1483 CB GLN A 100 12.544 -11.261 -23.910 1.00 0.00 C ATOM 1484 CG GLN A 100 11.422 -10.822 -24.875 1.00 0.00 C ATOM 1485 CD GLN A 100 11.144 -11.838 -25.995 1.00 0.00 C ATOM 1486 OE1 GLN A 100 11.736 -12.916 -26.071 1.00 0.00 O ATOM 1487 NE2 GLN A 100 10.223 -11.524 -26.896 1.00 0.00 N ATOM 0 H GLN A 100 11.033 -9.404 -22.437 1.00 0.00 H new ATOM 0 HA GLN A 100 13.687 -10.725 -22.222 1.00 0.00 H new ATOM 0 HB2 GLN A 100 13.439 -11.474 -24.494 1.00 0.00 H new ATOM 0 HB3 GLN A 100 12.245 -12.194 -23.432 1.00 0.00 H new ATOM 0 HG2 GLN A 100 10.506 -10.661 -24.306 1.00 0.00 H new ATOM 0 HG3 GLN A 100 11.692 -9.865 -25.322 1.00 0.00 H new ATOM 0 HE21 GLN A 100 9.732 -10.632 -26.834 1.00 0.00 H new ATOM 0 HE22 GLN A 100 10.005 -12.175 -27.651 1.00 0.00 H new ATOM 1496 N LEU A 101 13.642 -7.922 -22.422 1.00 0.00 N ATOM 1497 CA LEU A 101 14.371 -6.689 -22.735 1.00 0.00 C ATOM 1498 C LEU A 101 15.850 -7.049 -22.896 1.00 0.00 C ATOM 1499 O LEU A 101 16.404 -7.738 -22.038 1.00 0.00 O ATOM 1500 CB LEU A 101 14.236 -5.608 -21.640 1.00 0.00 C ATOM 1501 CG LEU A 101 12.855 -4.978 -21.354 1.00 0.00 C ATOM 1502 CD1 LEU A 101 11.825 -5.061 -22.490 1.00 0.00 C ATOM 1503 CD2 LEU A 101 12.277 -5.531 -20.044 1.00 0.00 C ATOM 0 H LEU A 101 13.211 -7.933 -21.498 1.00 0.00 H new ATOM 0 HA LEU A 101 13.945 -6.269 -23.646 1.00 0.00 H new ATOM 0 HB2 LEU A 101 14.595 -6.042 -20.707 1.00 0.00 H new ATOM 0 HB3 LEU A 101 14.917 -4.797 -21.897 1.00 0.00 H new ATOM 0 HG LEU A 101 13.054 -3.910 -21.261 1.00 0.00 H new ATOM 0 HD11 LEU A 101 10.896 -4.587 -22.174 1.00 0.00 H new ATOM 0 HD12 LEU A 101 12.213 -4.549 -23.371 1.00 0.00 H new ATOM 0 HD13 LEU A 101 11.634 -6.106 -22.733 1.00 0.00 H new ATOM 0 HD21 LEU A 101 11.304 -5.078 -19.856 1.00 0.00 H new ATOM 0 HD22 LEU A 101 12.164 -6.612 -20.124 1.00 0.00 H new ATOM 0 HD23 LEU A 101 12.952 -5.296 -19.221 1.00 0.00 H new ATOM 1515 N GLU A 102 16.495 -6.565 -23.951 1.00 0.00 N ATOM 1516 CA GLU A 102 17.929 -6.700 -24.159 1.00 0.00 C ATOM 1517 C GLU A 102 18.691 -5.941 -23.069 1.00 0.00 C ATOM 1518 O GLU A 102 18.195 -4.936 -22.558 1.00 0.00 O ATOM 1519 CB GLU A 102 18.355 -6.121 -25.527 1.00 0.00 C ATOM 1520 CG GLU A 102 17.635 -6.662 -26.770 1.00 0.00 C ATOM 1521 CD GLU A 102 16.399 -5.821 -27.157 1.00 0.00 C ATOM 1522 OE1 GLU A 102 15.409 -5.798 -26.389 1.00 0.00 O ATOM 1523 OE2 GLU A 102 16.418 -5.184 -28.237 1.00 0.00 O ATOM 0 H GLU A 102 16.025 -6.057 -24.700 1.00 0.00 H new ATOM 0 HA GLU A 102 18.163 -7.764 -24.125 1.00 0.00 H new ATOM 0 HB2 GLU A 102 18.212 -5.041 -25.497 1.00 0.00 H new ATOM 0 HB3 GLU A 102 19.423 -6.298 -25.651 1.00 0.00 H new ATOM 0 HG2 GLU A 102 18.332 -6.683 -27.608 1.00 0.00 H new ATOM 0 HG3 GLU A 102 17.326 -7.691 -26.587 1.00 0.00 H new ATOM 1530 N ASP A 103 19.912 -6.376 -22.737 1.00 0.00 N ATOM 1531 CA ASP A 103 20.811 -5.593 -21.905 1.00 0.00 C ATOM 1532 C ASP A 103 21.638 -4.750 -22.874 1.00 0.00 C ATOM 1533 O ASP A 103 22.377 -5.318 -23.686 1.00 0.00 O ATOM 1534 CB ASP A 103 21.732 -6.437 -21.022 1.00 0.00 C ATOM 1535 CG ASP A 103 22.541 -5.487 -20.136 1.00 0.00 C ATOM 1536 OD1 ASP A 103 23.551 -4.901 -20.578 1.00 0.00 O ATOM 1537 OD2 ASP A 103 22.095 -5.248 -18.995 1.00 0.00 O ATOM 0 H ASP A 103 20.295 -7.272 -23.038 1.00 0.00 H new ATOM 0 HA ASP A 103 20.227 -4.995 -21.205 1.00 0.00 H new ATOM 0 HB2 ASP A 103 21.148 -7.124 -20.410 1.00 0.00 H new ATOM 0 HB3 ASP A 103 22.397 -7.044 -21.636 1.00 0.00 H new ATOM 1542 N PRO A 104 21.499 -3.421 -22.880 1.00 0.00 N ATOM 1543 CA PRO A 104 22.144 -2.588 -23.881 1.00 0.00 C ATOM 1544 C PRO A 104 23.646 -2.381 -23.653 1.00 0.00 C ATOM 1545 O PRO A 104 24.301 -1.857 -24.552 1.00 0.00 O ATOM 1546 CB PRO A 104 21.351 -1.285 -23.857 1.00 0.00 C ATOM 1547 CG PRO A 104 20.861 -1.199 -22.415 1.00 0.00 C ATOM 1548 CD PRO A 104 20.547 -2.650 -22.098 1.00 0.00 C ATOM 0 HA PRO A 104 22.126 -3.066 -24.861 1.00 0.00 H new ATOM 0 HB2 PRO A 104 21.973 -0.430 -24.122 1.00 0.00 H new ATOM 0 HB3 PRO A 104 20.521 -1.306 -24.563 1.00 0.00 H new ATOM 0 HG2 PRO A 104 21.622 -0.792 -21.750 1.00 0.00 H new ATOM 0 HG3 PRO A 104 19.982 -0.562 -22.321 1.00 0.00 H new ATOM 0 HD2 PRO A 104 20.655 -2.853 -21.033 1.00 0.00 H new ATOM 0 HD3 PRO A 104 19.521 -2.900 -22.368 1.00 0.00 H new ATOM 1556 N ASP A 105 24.225 -2.796 -22.515 1.00 0.00 N ATOM 1557 CA ASP A 105 25.595 -2.400 -22.189 1.00 0.00 C ATOM 1558 C ASP A 105 26.634 -2.993 -23.132 1.00 0.00 C ATOM 1559 O ASP A 105 27.567 -2.305 -23.557 1.00 0.00 O ATOM 1560 CB ASP A 105 25.976 -2.729 -20.756 1.00 0.00 C ATOM 1561 CG ASP A 105 27.333 -2.074 -20.443 1.00 0.00 C ATOM 1562 OD1 ASP A 105 27.342 -0.846 -20.181 1.00 0.00 O ATOM 1563 OD2 ASP A 105 28.368 -2.785 -20.428 1.00 0.00 O ATOM 0 H ASP A 105 23.774 -3.393 -21.822 1.00 0.00 H new ATOM 0 HA ASP A 105 25.599 -1.317 -22.314 1.00 0.00 H new ATOM 0 HB2 ASP A 105 25.213 -2.364 -20.069 1.00 0.00 H new ATOM 0 HB3 ASP A 105 26.037 -3.809 -20.620 1.00 0.00 H new ATOM 1568 N GLY A 106 26.454 -4.268 -23.486 1.00 0.00 N ATOM 1569 CA GLY A 106 27.399 -5.011 -24.314 1.00 0.00 C ATOM 1570 C GLY A 106 27.279 -4.704 -25.811 1.00 0.00 C ATOM 1571 O GLY A 106 27.894 -5.410 -26.614 1.00 0.00 O ATOM 0 H GLY A 106 25.641 -4.815 -23.202 1.00 0.00 H new ATOM 0 HA2 GLY A 106 28.413 -4.784 -23.986 1.00 0.00 H new ATOM 0 HA3 GLY A 106 27.245 -6.079 -24.157 1.00 0.00 H new ATOM 1575 N GLN A 107 26.461 -3.721 -26.207 1.00 0.00 N ATOM 1576 CA GLN A 107 26.096 -3.469 -27.597 1.00 0.00 C ATOM 1577 C GLN A 107 25.848 -1.969 -27.843 1.00 0.00 C ATOM 1578 O GLN A 107 26.258 -1.119 -27.048 1.00 0.00 O ATOM 1579 CB GLN A 107 24.925 -4.394 -27.989 1.00 0.00 C ATOM 1580 CG GLN A 107 23.665 -4.235 -27.135 1.00 0.00 C ATOM 1581 CD GLN A 107 22.677 -5.373 -27.420 1.00 0.00 C ATOM 1582 OE1 GLN A 107 22.389 -5.702 -28.569 1.00 0.00 O ATOM 1583 NE2 GLN A 107 22.144 -6.027 -26.398 1.00 0.00 N ATOM 0 H GLN A 107 26.028 -3.068 -25.553 1.00 0.00 H new ATOM 0 HA GLN A 107 26.923 -3.718 -28.262 1.00 0.00 H new ATOM 0 HB2 GLN A 107 24.666 -4.207 -29.031 1.00 0.00 H new ATOM 0 HB3 GLN A 107 25.261 -5.429 -27.925 1.00 0.00 H new ATOM 0 HG2 GLN A 107 23.932 -4.233 -26.078 1.00 0.00 H new ATOM 0 HG3 GLN A 107 23.194 -3.275 -27.346 1.00 0.00 H new ATOM 0 HE21 GLN A 107 22.379 -5.759 -25.442 1.00 0.00 H new ATOM 0 HE22 GLN A 107 21.499 -6.799 -26.567 1.00 0.00 H new ATOM 1592 N SER A 108 25.227 -1.649 -28.980 1.00 0.00 N ATOM 1593 CA SER A 108 25.118 -0.296 -29.506 1.00 0.00 C ATOM 1594 C SER A 108 24.216 0.664 -28.721 1.00 0.00 C ATOM 1595 O SER A 108 23.250 0.256 -28.078 1.00 0.00 O ATOM 1596 CB SER A 108 24.702 -0.373 -30.990 1.00 0.00 C ATOM 1597 OG SER A 108 25.383 -1.434 -31.658 1.00 0.00 O ATOM 0 H SER A 108 24.776 -2.346 -29.573 1.00 0.00 H new ATOM 0 HA SER A 108 26.106 0.150 -29.394 1.00 0.00 H new ATOM 0 HB2 SER A 108 23.625 -0.525 -31.062 1.00 0.00 H new ATOM 0 HB3 SER A 108 24.924 0.573 -31.483 1.00 0.00 H new ATOM 0 HG SER A 108 25.102 -1.464 -32.596 1.00 0.00 H new ATOM 1603 N LEU A 109 24.481 1.968 -28.886 1.00 0.00 N ATOM 1604 CA LEU A 109 23.693 3.086 -28.361 1.00 0.00 C ATOM 1605 C LEU A 109 22.240 3.046 -28.828 1.00 0.00 C ATOM 1606 O LEU A 109 21.345 3.442 -28.087 1.00 0.00 O ATOM 1607 CB LEU A 109 24.392 4.377 -28.828 1.00 0.00 C ATOM 1608 CG LEU A 109 23.837 5.675 -28.219 1.00 0.00 C ATOM 1609 CD1 LEU A 109 24.010 5.696 -26.699 1.00 0.00 C ATOM 1610 CD2 LEU A 109 24.588 6.865 -28.827 1.00 0.00 C ATOM 0 H LEU A 109 25.293 2.285 -29.417 1.00 0.00 H new ATOM 0 HA LEU A 109 23.648 3.031 -27.273 1.00 0.00 H new ATOM 0 HB2 LEU A 109 25.453 4.305 -28.587 1.00 0.00 H new ATOM 0 HB3 LEU A 109 24.315 4.441 -29.913 1.00 0.00 H new ATOM 0 HG LEU A 109 22.772 5.735 -28.441 1.00 0.00 H new ATOM 0 HD11 LEU A 109 23.607 6.627 -26.300 1.00 0.00 H new ATOM 0 HD12 LEU A 109 23.477 4.853 -26.260 1.00 0.00 H new ATOM 0 HD13 LEU A 109 25.069 5.623 -26.452 1.00 0.00 H new ATOM 0 HD21 LEU A 109 24.204 7.793 -28.403 1.00 0.00 H new ATOM 0 HD22 LEU A 109 25.651 6.777 -28.603 1.00 0.00 H new ATOM 0 HD23 LEU A 109 24.444 6.873 -29.907 1.00 0.00 H new ATOM 1622 N GLU A 110 21.985 2.504 -30.019 1.00 0.00 N ATOM 1623 CA GLU A 110 20.634 2.284 -30.536 1.00 0.00 C ATOM 1624 C GLU A 110 19.835 1.379 -29.591 1.00 0.00 C ATOM 1625 O GLU A 110 18.640 1.589 -29.392 1.00 0.00 O ATOM 1626 CB GLU A 110 20.751 1.698 -31.951 1.00 0.00 C ATOM 1627 CG GLU A 110 19.389 1.467 -32.618 1.00 0.00 C ATOM 1628 CD GLU A 110 19.548 1.046 -34.089 1.00 0.00 C ATOM 1629 OE1 GLU A 110 19.711 -0.168 -34.367 1.00 0.00 O ATOM 1630 OE2 GLU A 110 19.500 1.927 -34.981 1.00 0.00 O ATOM 0 H GLU A 110 22.719 2.202 -30.659 1.00 0.00 H new ATOM 0 HA GLU A 110 20.086 3.225 -30.592 1.00 0.00 H new ATOM 0 HB2 GLU A 110 21.343 2.372 -32.570 1.00 0.00 H new ATOM 0 HB3 GLU A 110 21.291 0.752 -31.903 1.00 0.00 H new ATOM 0 HG2 GLU A 110 18.842 0.696 -32.075 1.00 0.00 H new ATOM 0 HG3 GLU A 110 18.795 2.379 -32.561 1.00 0.00 H new ATOM 1637 N VAL A 111 20.492 0.408 -28.954 1.00 0.00 N ATOM 1638 CA VAL A 111 19.845 -0.528 -28.051 1.00 0.00 C ATOM 1639 C VAL A 111 19.551 0.162 -26.718 1.00 0.00 C ATOM 1640 O VAL A 111 18.466 -0.038 -26.193 1.00 0.00 O ATOM 1641 CB VAL A 111 20.654 -1.836 -27.905 1.00 0.00 C ATOM 1642 CG1 VAL A 111 19.784 -2.955 -27.307 1.00 0.00 C ATOM 1643 CG2 VAL A 111 21.212 -2.331 -29.255 1.00 0.00 C ATOM 0 H VAL A 111 21.495 0.253 -29.055 1.00 0.00 H new ATOM 0 HA VAL A 111 18.889 -0.834 -28.475 1.00 0.00 H new ATOM 0 HB VAL A 111 21.486 -1.605 -27.240 1.00 0.00 H new ATOM 0 HG11 VAL A 111 20.376 -3.866 -27.214 1.00 0.00 H new ATOM 0 HG12 VAL A 111 19.427 -2.652 -26.323 1.00 0.00 H new ATOM 0 HG13 VAL A 111 18.931 -3.141 -27.960 1.00 0.00 H new ATOM 0 HG21 VAL A 111 21.773 -3.253 -29.101 1.00 0.00 H new ATOM 0 HG22 VAL A 111 20.387 -2.519 -29.943 1.00 0.00 H new ATOM 0 HG23 VAL A 111 21.871 -1.572 -29.677 1.00 0.00 H new ATOM 1653 N PHE A 112 20.422 1.032 -26.191 1.00 0.00 N ATOM 1654 CA PHE A 112 20.088 1.878 -25.030 1.00 0.00 C ATOM 1655 C PHE A 112 18.847 2.722 -25.329 1.00 0.00 C ATOM 1656 O PHE A 112 17.880 2.705 -24.568 1.00 0.00 O ATOM 1657 CB PHE A 112 21.269 2.800 -24.675 1.00 0.00 C ATOM 1658 CG PHE A 112 22.323 2.147 -23.812 1.00 0.00 C ATOM 1659 CD1 PHE A 112 22.024 1.880 -22.464 1.00 0.00 C ATOM 1660 CD2 PHE A 112 23.594 1.826 -24.324 1.00 0.00 C ATOM 1661 CE1 PHE A 112 22.981 1.269 -21.643 1.00 0.00 C ATOM 1662 CE2 PHE A 112 24.552 1.219 -23.497 1.00 0.00 C ATOM 1663 CZ PHE A 112 24.240 0.932 -22.158 1.00 0.00 C ATOM 0 H PHE A 112 21.367 1.171 -26.549 1.00 0.00 H new ATOM 0 HA PHE A 112 19.882 1.227 -24.181 1.00 0.00 H new ATOM 0 HB2 PHE A 112 21.734 3.148 -25.597 1.00 0.00 H new ATOM 0 HB3 PHE A 112 20.886 3.680 -24.159 1.00 0.00 H new ATOM 0 HD1 PHE A 112 21.057 2.146 -22.062 1.00 0.00 H new ATOM 0 HD2 PHE A 112 23.832 2.047 -25.354 1.00 0.00 H new ATOM 0 HE1 PHE A 112 22.748 1.057 -20.610 1.00 0.00 H new ATOM 0 HE2 PHE A 112 25.528 0.973 -23.890 1.00 0.00 H new ATOM 0 HZ PHE A 112 24.971 0.451 -21.525 1.00 0.00 H new ATOM 1673 N ARG A 113 18.843 3.410 -26.474 1.00 0.00 N ATOM 1674 CA ARG A 113 17.734 4.277 -26.891 1.00 0.00 C ATOM 1675 C ARG A 113 16.436 3.473 -27.032 1.00 0.00 C ATOM 1676 O ARG A 113 15.382 3.935 -26.598 1.00 0.00 O ATOM 1677 CB ARG A 113 18.130 4.973 -28.207 1.00 0.00 C ATOM 1678 CG ARG A 113 19.205 6.053 -27.978 1.00 0.00 C ATOM 1679 CD ARG A 113 19.909 6.428 -29.286 1.00 0.00 C ATOM 1680 NE ARG A 113 20.718 7.653 -29.126 1.00 0.00 N ATOM 1681 CZ ARG A 113 21.368 8.303 -30.102 1.00 0.00 C ATOM 1682 NH1 ARG A 113 21.370 7.834 -31.350 1.00 0.00 N ATOM 1683 NH2 ARG A 113 22.024 9.428 -29.823 1.00 0.00 N ATOM 0 H ARG A 113 19.613 3.382 -27.143 1.00 0.00 H new ATOM 0 HA ARG A 113 17.544 5.036 -26.133 1.00 0.00 H new ATOM 0 HB2 ARG A 113 18.504 4.231 -28.913 1.00 0.00 H new ATOM 0 HB3 ARG A 113 17.248 5.427 -28.659 1.00 0.00 H new ATOM 0 HG2 ARG A 113 18.745 6.940 -27.544 1.00 0.00 H new ATOM 0 HG3 ARG A 113 19.939 5.691 -27.259 1.00 0.00 H new ATOM 0 HD2 ARG A 113 20.549 5.606 -29.606 1.00 0.00 H new ATOM 0 HD3 ARG A 113 19.168 6.579 -30.071 1.00 0.00 H new ATOM 0 HE ARG A 113 20.789 8.041 -28.185 1.00 0.00 H new ATOM 0 HH11 ARG A 113 20.873 6.971 -31.571 1.00 0.00 H new ATOM 0 HH12 ARG A 113 21.868 8.338 -32.083 1.00 0.00 H new ATOM 0 HH21 ARG A 113 22.030 9.792 -28.870 1.00 0.00 H new ATOM 0 HH22 ARG A 113 22.520 9.926 -30.562 1.00 0.00 H new ATOM 1697 N THR A 114 16.512 2.253 -27.564 1.00 0.00 N ATOM 1698 CA THR A 114 15.393 1.342 -27.700 1.00 0.00 C ATOM 1699 C THR A 114 14.922 0.854 -26.328 1.00 0.00 C ATOM 1700 O THR A 114 13.735 0.935 -26.019 1.00 0.00 O ATOM 1701 CB THR A 114 15.886 0.201 -28.613 1.00 0.00 C ATOM 1702 OG1 THR A 114 16.015 0.651 -29.952 1.00 0.00 O ATOM 1703 CG2 THR A 114 15.003 -1.038 -28.569 1.00 0.00 C ATOM 0 H THR A 114 17.386 1.866 -27.921 1.00 0.00 H new ATOM 0 HA THR A 114 14.520 1.821 -28.143 1.00 0.00 H new ATOM 0 HB THR A 114 16.861 -0.092 -28.224 1.00 0.00 H new ATOM 0 HG1 THR A 114 16.897 1.060 -30.076 1.00 0.00 H new ATOM 0 HG21 THR A 114 15.410 -1.799 -29.235 1.00 0.00 H new ATOM 0 HG22 THR A 114 14.971 -1.426 -27.551 1.00 0.00 H new ATOM 0 HG23 THR A 114 13.994 -0.777 -28.889 1.00 0.00 H new ATOM 1711 N VAL A 115 15.826 0.362 -25.477 1.00 0.00 N ATOM 1712 CA VAL A 115 15.463 -0.330 -24.247 1.00 0.00 C ATOM 1713 C VAL A 115 14.817 0.627 -23.258 1.00 0.00 C ATOM 1714 O VAL A 115 13.866 0.211 -22.607 1.00 0.00 O ATOM 1715 CB VAL A 115 16.664 -1.141 -23.700 1.00 0.00 C ATOM 1716 CG1 VAL A 115 16.426 -1.710 -22.293 1.00 0.00 C ATOM 1717 CG2 VAL A 115 16.936 -2.337 -24.627 1.00 0.00 C ATOM 0 H VAL A 115 16.832 0.435 -25.626 1.00 0.00 H new ATOM 0 HA VAL A 115 14.694 -1.075 -24.452 1.00 0.00 H new ATOM 0 HB VAL A 115 17.502 -0.446 -23.655 1.00 0.00 H new ATOM 0 HG11 VAL A 115 17.307 -2.266 -21.972 1.00 0.00 H new ATOM 0 HG12 VAL A 115 16.239 -0.892 -21.597 1.00 0.00 H new ATOM 0 HG13 VAL A 115 15.563 -2.376 -22.311 1.00 0.00 H new ATOM 0 HG21 VAL A 115 17.781 -2.909 -24.244 1.00 0.00 H new ATOM 0 HG22 VAL A 115 16.053 -2.975 -24.666 1.00 0.00 H new ATOM 0 HG23 VAL A 115 17.167 -1.976 -25.629 1.00 0.00 H new ATOM 1727 N ARG A 116 15.208 1.902 -23.200 1.00 0.00 N ATOM 1728 CA ARG A 116 14.495 2.861 -22.349 1.00 0.00 C ATOM 1729 C ARG A 116 13.008 2.919 -22.741 1.00 0.00 C ATOM 1730 O ARG A 116 12.149 2.881 -21.864 1.00 0.00 O ATOM 1731 CB ARG A 116 15.167 4.249 -22.394 1.00 0.00 C ATOM 1732 CG ARG A 116 16.513 4.268 -21.644 1.00 0.00 C ATOM 1733 CD ARG A 116 17.034 5.689 -21.382 1.00 0.00 C ATOM 1734 NE ARG A 116 17.745 6.279 -22.539 1.00 0.00 N ATOM 1735 CZ ARG A 116 17.277 7.145 -23.454 1.00 0.00 C ATOM 1736 NH1 ARG A 116 16.001 7.522 -23.469 1.00 0.00 N ATOM 1737 NH2 ARG A 116 18.104 7.638 -24.369 1.00 0.00 N ATOM 0 H ARG A 116 15.996 2.290 -23.719 1.00 0.00 H new ATOM 0 HA ARG A 116 14.549 2.521 -21.315 1.00 0.00 H new ATOM 0 HB2 ARG A 116 15.327 4.540 -23.432 1.00 0.00 H new ATOM 0 HB3 ARG A 116 14.498 4.989 -21.955 1.00 0.00 H new ATOM 0 HG2 ARG A 116 16.400 3.747 -20.693 1.00 0.00 H new ATOM 0 HG3 ARG A 116 17.253 3.717 -22.224 1.00 0.00 H new ATOM 0 HD2 ARG A 116 16.195 6.332 -21.115 1.00 0.00 H new ATOM 0 HD3 ARG A 116 17.706 5.669 -20.524 1.00 0.00 H new ATOM 0 HE ARG A 116 18.716 5.991 -22.657 1.00 0.00 H new ATOM 0 HH11 ARG A 116 15.352 7.152 -22.775 1.00 0.00 H new ATOM 0 HH12 ARG A 116 15.672 8.181 -24.175 1.00 0.00 H new ATOM 0 HH21 ARG A 116 19.085 7.359 -24.373 1.00 0.00 H new ATOM 0 HH22 ARG A 116 17.758 8.296 -25.068 1.00 0.00 H new ATOM 1751 N GLY A 117 12.701 2.915 -24.041 1.00 0.00 N ATOM 1752 CA GLY A 117 11.331 2.915 -24.557 1.00 0.00 C ATOM 1753 C GLY A 117 10.601 1.611 -24.235 1.00 0.00 C ATOM 1754 O GLY A 117 9.513 1.654 -23.660 1.00 0.00 O ATOM 0 H GLY A 117 13.409 2.912 -24.775 1.00 0.00 H new ATOM 0 HA2 GLY A 117 10.782 3.754 -24.129 1.00 0.00 H new ATOM 0 HA3 GLY A 117 11.350 3.064 -25.637 1.00 0.00 H new ATOM 1758 N GLN A 118 11.218 0.458 -24.538 1.00 0.00 N ATOM 1759 CA GLN A 118 10.641 -0.863 -24.249 1.00 0.00 C ATOM 1760 C GLN A 118 10.293 -0.973 -22.771 1.00 0.00 C ATOM 1761 O GLN A 118 9.192 -1.369 -22.397 1.00 0.00 O ATOM 1762 CB GLN A 118 11.590 -1.999 -24.649 1.00 0.00 C ATOM 1763 CG GLN A 118 11.967 -2.024 -26.142 1.00 0.00 C ATOM 1764 CD GLN A 118 12.602 -3.350 -26.553 1.00 0.00 C ATOM 1765 OE1 GLN A 118 12.206 -3.976 -27.532 1.00 0.00 O ATOM 1766 NE2 GLN A 118 13.608 -3.790 -25.814 1.00 0.00 N ATOM 0 H GLN A 118 12.131 0.416 -24.990 1.00 0.00 H new ATOM 0 HA GLN A 118 9.733 -0.962 -24.844 1.00 0.00 H new ATOM 0 HB2 GLN A 118 12.503 -1.917 -24.059 1.00 0.00 H new ATOM 0 HB3 GLN A 118 11.126 -2.951 -24.389 1.00 0.00 H new ATOM 0 HG2 GLN A 118 11.075 -1.848 -26.743 1.00 0.00 H new ATOM 0 HG3 GLN A 118 12.660 -1.210 -26.354 1.00 0.00 H new ATOM 0 HE21 GLN A 118 13.920 -3.253 -25.005 1.00 0.00 H new ATOM 0 HE22 GLN A 118 14.072 -4.666 -26.054 1.00 0.00 H new ATOM 1775 N VAL A 119 11.241 -0.579 -21.930 1.00 0.00 N ATOM 1776 CA VAL A 119 11.097 -0.675 -20.490 1.00 0.00 C ATOM 1777 C VAL A 119 9.971 0.239 -20.017 1.00 0.00 C ATOM 1778 O VAL A 119 9.121 -0.226 -19.264 1.00 0.00 O ATOM 1779 CB VAL A 119 12.431 -0.349 -19.805 1.00 0.00 C ATOM 1780 CG1 VAL A 119 12.220 -0.186 -18.305 1.00 0.00 C ATOM 1781 CG2 VAL A 119 13.429 -1.494 -20.026 1.00 0.00 C ATOM 0 H VAL A 119 12.132 -0.184 -22.232 1.00 0.00 H new ATOM 0 HA VAL A 119 10.829 -1.695 -20.215 1.00 0.00 H new ATOM 0 HB VAL A 119 12.819 0.575 -20.233 1.00 0.00 H new ATOM 0 HG11 VAL A 119 13.172 0.045 -17.827 1.00 0.00 H new ATOM 0 HG12 VAL A 119 11.516 0.626 -18.123 1.00 0.00 H new ATOM 0 HG13 VAL A 119 11.821 -1.112 -17.891 1.00 0.00 H new ATOM 0 HG21 VAL A 119 14.373 -1.254 -19.536 1.00 0.00 H new ATOM 0 HG22 VAL A 119 13.026 -2.415 -19.604 1.00 0.00 H new ATOM 0 HG23 VAL A 119 13.598 -1.628 -21.094 1.00 0.00 H new ATOM 1791 N LYS A 120 9.941 1.509 -20.441 1.00 0.00 N ATOM 1792 CA LYS A 120 8.962 2.468 -19.934 1.00 0.00 C ATOM 1793 C LYS A 120 7.564 1.917 -20.158 1.00 0.00 C ATOM 1794 O LYS A 120 6.751 1.918 -19.241 1.00 0.00 O ATOM 1795 CB LYS A 120 9.122 3.801 -20.679 1.00 0.00 C ATOM 1796 CG LYS A 120 8.192 4.891 -20.123 1.00 0.00 C ATOM 1797 CD LYS A 120 8.516 6.246 -20.777 1.00 0.00 C ATOM 1798 CE LYS A 120 7.628 7.397 -20.278 1.00 0.00 C ATOM 1799 NZ LYS A 120 6.247 7.354 -20.831 1.00 0.00 N ATOM 0 H LYS A 120 10.585 1.892 -21.133 1.00 0.00 H new ATOM 0 HA LYS A 120 9.121 2.632 -18.868 1.00 0.00 H new ATOM 0 HB2 LYS A 120 10.157 4.135 -20.604 1.00 0.00 H new ATOM 0 HB3 LYS A 120 8.911 3.651 -21.738 1.00 0.00 H new ATOM 0 HG2 LYS A 120 7.152 4.625 -20.314 1.00 0.00 H new ATOM 0 HG3 LYS A 120 8.309 4.963 -19.042 1.00 0.00 H new ATOM 0 HD2 LYS A 120 9.560 6.493 -20.584 1.00 0.00 H new ATOM 0 HD3 LYS A 120 8.405 6.154 -21.857 1.00 0.00 H new ATOM 0 HE2 LYS A 120 7.578 7.363 -19.190 1.00 0.00 H new ATOM 0 HE3 LYS A 120 8.091 8.347 -20.546 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 5.735 8.216 -20.554 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 6.290 7.295 -21.868 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 5.749 6.521 -20.458 1.00 0.00 H new ATOM 1813 N GLU A 121 7.315 1.396 -21.355 1.00 0.00 N ATOM 1814 CA GLU A 121 6.019 0.889 -21.738 1.00 0.00 C ATOM 1815 C GLU A 121 5.640 -0.332 -20.890 1.00 0.00 C ATOM 1816 O GLU A 121 4.522 -0.393 -20.379 1.00 0.00 O ATOM 1817 CB GLU A 121 6.089 0.592 -23.240 1.00 0.00 C ATOM 1818 CG GLU A 121 4.756 0.077 -23.794 1.00 0.00 C ATOM 1819 CD GLU A 121 4.807 -0.074 -25.327 1.00 0.00 C ATOM 1820 OE1 GLU A 121 5.175 -1.167 -25.824 1.00 0.00 O ATOM 1821 OE2 GLU A 121 4.459 0.892 -26.051 1.00 0.00 O ATOM 0 H GLU A 121 8.020 1.317 -22.088 1.00 0.00 H new ATOM 0 HA GLU A 121 5.227 1.615 -21.554 1.00 0.00 H new ATOM 0 HB2 GLU A 121 6.376 1.498 -23.774 1.00 0.00 H new ATOM 0 HB3 GLU A 121 6.867 -0.148 -23.426 1.00 0.00 H new ATOM 0 HG2 GLU A 121 4.518 -0.885 -23.340 1.00 0.00 H new ATOM 0 HG3 GLU A 121 3.956 0.765 -23.521 1.00 0.00 H new ATOM 1828 N ARG A 122 6.569 -1.271 -20.665 1.00 0.00 N ATOM 1829 CA ARG A 122 6.283 -2.462 -19.856 1.00 0.00 C ATOM 1830 C ARG A 122 6.063 -2.108 -18.391 1.00 0.00 C ATOM 1831 O ARG A 122 5.134 -2.625 -17.776 1.00 0.00 O ATOM 1832 CB ARG A 122 7.369 -3.533 -20.029 1.00 0.00 C ATOM 1833 CG ARG A 122 7.342 -4.115 -21.453 1.00 0.00 C ATOM 1834 CD ARG A 122 7.857 -5.549 -21.449 1.00 0.00 C ATOM 1835 NE ARG A 122 7.977 -6.065 -22.829 1.00 0.00 N ATOM 1836 CZ ARG A 122 7.053 -6.752 -23.518 1.00 0.00 C ATOM 1837 NH1 ARG A 122 5.916 -7.130 -22.941 1.00 0.00 N ATOM 1838 NH2 ARG A 122 7.269 -7.060 -24.792 1.00 0.00 N ATOM 0 H ARG A 122 7.520 -1.229 -21.030 1.00 0.00 H new ATOM 0 HA ARG A 122 5.349 -2.888 -20.223 1.00 0.00 H new ATOM 0 HB2 ARG A 122 8.349 -3.100 -19.827 1.00 0.00 H new ATOM 0 HB3 ARG A 122 7.218 -4.331 -19.302 1.00 0.00 H new ATOM 0 HG2 ARG A 122 6.325 -4.088 -21.845 1.00 0.00 H new ATOM 0 HG3 ARG A 122 7.955 -3.503 -22.115 1.00 0.00 H new ATOM 0 HD2 ARG A 122 8.827 -5.591 -20.954 1.00 0.00 H new ATOM 0 HD3 ARG A 122 7.180 -6.182 -20.876 1.00 0.00 H new ATOM 0 HE ARG A 122 8.857 -5.879 -23.309 1.00 0.00 H new ATOM 0 HH11 ARG A 122 5.738 -6.898 -21.964 1.00 0.00 H new ATOM 0 HH12 ARG A 122 5.222 -7.652 -23.476 1.00 0.00 H new ATOM 0 HH21 ARG A 122 8.137 -6.774 -25.246 1.00 0.00 H new ATOM 0 HH22 ARG A 122 6.567 -7.582 -25.317 1.00 0.00 H new ATOM 1852 N VAL A 123 6.885 -1.225 -17.828 1.00 0.00 N ATOM 1853 CA VAL A 123 6.753 -0.808 -16.436 1.00 0.00 C ATOM 1854 C VAL A 123 5.441 -0.026 -16.286 1.00 0.00 C ATOM 1855 O VAL A 123 4.692 -0.299 -15.353 1.00 0.00 O ATOM 1856 CB VAL A 123 7.994 -0.029 -15.980 1.00 0.00 C ATOM 1857 CG1 VAL A 123 7.865 0.450 -14.535 1.00 0.00 C ATOM 1858 CG2 VAL A 123 9.285 -0.859 -16.064 1.00 0.00 C ATOM 0 H VAL A 123 7.658 -0.780 -18.323 1.00 0.00 H new ATOM 0 HA VAL A 123 6.701 -1.673 -15.775 1.00 0.00 H new ATOM 0 HB VAL A 123 8.055 0.817 -16.665 1.00 0.00 H new ATOM 0 HG11 VAL A 123 8.764 0.997 -14.251 1.00 0.00 H new ATOM 0 HG12 VAL A 123 6.998 1.105 -14.445 1.00 0.00 H new ATOM 0 HG13 VAL A 123 7.740 -0.410 -13.876 1.00 0.00 H new ATOM 0 HG21 VAL A 123 10.128 -0.255 -15.729 1.00 0.00 H new ATOM 0 HG22 VAL A 123 9.194 -1.739 -15.428 1.00 0.00 H new ATOM 0 HG23 VAL A 123 9.450 -1.172 -17.095 1.00 0.00 H new ATOM 1868 N GLU A 124 5.103 0.891 -17.200 1.00 0.00 N ATOM 1869 CA GLU A 124 3.854 1.643 -17.114 1.00 0.00 C ATOM 1870 C GLU A 124 2.658 0.697 -17.181 1.00 0.00 C ATOM 1871 O GLU A 124 1.728 0.837 -16.388 1.00 0.00 O ATOM 1872 CB GLU A 124 3.743 2.726 -18.205 1.00 0.00 C ATOM 1873 CG GLU A 124 4.446 4.031 -17.818 1.00 0.00 C ATOM 1874 CD GLU A 124 4.020 5.184 -18.741 1.00 0.00 C ATOM 1875 OE1 GLU A 124 4.635 5.370 -19.818 1.00 0.00 O ATOM 1876 OE2 GLU A 124 3.075 5.929 -18.385 1.00 0.00 O ATOM 0 H GLU A 124 5.680 1.128 -18.007 1.00 0.00 H new ATOM 0 HA GLU A 124 3.854 2.156 -16.152 1.00 0.00 H new ATOM 0 HB2 GLU A 124 4.174 2.347 -19.132 1.00 0.00 H new ATOM 0 HB3 GLU A 124 2.691 2.930 -18.403 1.00 0.00 H new ATOM 0 HG2 GLU A 124 4.209 4.282 -16.784 1.00 0.00 H new ATOM 0 HG3 GLU A 124 5.526 3.896 -17.874 1.00 0.00 H new ATOM 1883 N ASN A 125 2.695 -0.293 -18.073 1.00 0.00 N ATOM 1884 CA ASN A 125 1.630 -1.280 -18.204 1.00 0.00 C ATOM 1885 C ASN A 125 1.478 -2.090 -16.916 1.00 0.00 C ATOM 1886 O ASN A 125 0.366 -2.260 -16.430 1.00 0.00 O ATOM 1887 CB ASN A 125 1.892 -2.208 -19.397 1.00 0.00 C ATOM 1888 CG ASN A 125 0.803 -3.272 -19.503 1.00 0.00 C ATOM 1889 OD1 ASN A 125 0.981 -4.399 -19.052 1.00 0.00 O ATOM 1890 ND2 ASN A 125 -0.346 -2.936 -20.075 1.00 0.00 N ATOM 0 H ASN A 125 3.467 -0.431 -18.725 1.00 0.00 H new ATOM 0 HA ASN A 125 0.696 -0.747 -18.384 1.00 0.00 H new ATOM 0 HB2 ASN A 125 1.928 -1.624 -20.317 1.00 0.00 H new ATOM 0 HB3 ASN A 125 2.865 -2.686 -19.285 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -1.100 -3.620 -20.145 1.00 0.00 H new ATOM 0 HD22 ASN A 125 -0.476 -1.994 -20.444 1.00 0.00 H new ATOM 1897 N LEU A 126 2.583 -2.537 -16.318 1.00 0.00 N ATOM 1898 CA LEU A 126 2.594 -3.273 -15.064 1.00 0.00 C ATOM 1899 C LEU A 126 1.983 -2.445 -13.937 1.00 0.00 C ATOM 1900 O LEU A 126 1.136 -2.950 -13.207 1.00 0.00 O ATOM 1901 CB LEU A 126 4.049 -3.656 -14.759 1.00 0.00 C ATOM 1902 CG LEU A 126 4.269 -4.257 -13.366 1.00 0.00 C ATOM 1903 CD1 LEU A 126 3.459 -5.542 -13.185 1.00 0.00 C ATOM 1904 CD2 LEU A 126 5.757 -4.540 -13.198 1.00 0.00 C ATOM 0 H LEU A 126 3.515 -2.391 -16.706 1.00 0.00 H new ATOM 0 HA LEU A 126 1.986 -4.174 -15.148 1.00 0.00 H new ATOM 0 HB2 LEU A 126 4.388 -4.372 -15.508 1.00 0.00 H new ATOM 0 HB3 LEU A 126 4.674 -2.769 -14.861 1.00 0.00 H new ATOM 0 HG LEU A 126 3.931 -3.551 -12.608 1.00 0.00 H new ATOM 0 HD11 LEU A 126 3.635 -5.946 -12.188 1.00 0.00 H new ATOM 0 HD12 LEU A 126 2.398 -5.323 -13.306 1.00 0.00 H new ATOM 0 HD13 LEU A 126 3.766 -6.274 -13.932 1.00 0.00 H new ATOM 0 HD21 LEU A 126 5.937 -4.969 -12.212 1.00 0.00 H new ATOM 0 HD22 LEU A 126 6.082 -5.243 -13.964 1.00 0.00 H new ATOM 0 HD23 LEU A 126 6.318 -3.610 -13.297 1.00 0.00 H new ATOM 1916 N ILE A 127 2.379 -1.179 -13.798 1.00 0.00 N ATOM 1917 CA ILE A 127 1.851 -0.266 -12.791 1.00 0.00 C ATOM 1918 C ILE A 127 0.351 -0.093 -13.048 1.00 0.00 C ATOM 1919 O ILE A 127 -0.434 -0.225 -12.118 1.00 0.00 O ATOM 1920 CB ILE A 127 2.656 1.046 -12.869 1.00 0.00 C ATOM 1921 CG1 ILE A 127 4.099 0.756 -12.397 1.00 0.00 C ATOM 1922 CG2 ILE A 127 2.029 2.138 -11.990 1.00 0.00 C ATOM 1923 CD1 ILE A 127 5.056 1.941 -12.521 1.00 0.00 C ATOM 0 H ILE A 127 3.089 -0.754 -14.395 1.00 0.00 H new ATOM 0 HA ILE A 127 1.957 -0.644 -11.774 1.00 0.00 H new ATOM 0 HB ILE A 127 2.653 1.409 -13.897 1.00 0.00 H new ATOM 0 HG12 ILE A 127 4.070 0.436 -11.355 1.00 0.00 H new ATOM 0 HG13 ILE A 127 4.496 -0.078 -12.976 1.00 0.00 H new ATOM 0 HG21 ILE A 127 2.620 3.051 -12.067 1.00 0.00 H new ATOM 0 HG22 ILE A 127 1.011 2.335 -12.326 1.00 0.00 H new ATOM 0 HG23 ILE A 127 2.010 1.804 -10.953 1.00 0.00 H new ATOM 0 HD11 ILE A 127 6.045 1.649 -12.168 1.00 0.00 H new ATOM 0 HD12 ILE A 127 5.120 2.249 -13.565 1.00 0.00 H new ATOM 0 HD13 ILE A 127 4.687 2.771 -11.919 1.00 0.00 H new ATOM 1935 N ALA A 128 -0.057 0.123 -14.301 1.00 0.00 N ATOM 1936 CA ALA A 128 -1.457 0.266 -14.671 1.00 0.00 C ATOM 1937 C ALA A 128 -2.272 -1.005 -14.370 1.00 0.00 C ATOM 1938 O ALA A 128 -3.467 -0.896 -14.084 1.00 0.00 O ATOM 1939 CB ALA A 128 -1.544 0.653 -16.152 1.00 0.00 C ATOM 0 H ALA A 128 0.585 0.203 -15.090 1.00 0.00 H new ATOM 0 HA ALA A 128 -1.899 1.056 -14.064 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -2.590 0.762 -16.439 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -1.023 1.597 -16.313 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -1.081 -0.125 -16.759 1.00 0.00 H new ATOM 1945 N LYS A 129 -1.659 -2.198 -14.404 1.00 0.00 N ATOM 1946 CA LYS A 129 -2.310 -3.425 -13.962 1.00 0.00 C ATOM 1947 C LYS A 129 -2.516 -3.394 -12.451 1.00 0.00 C ATOM 1948 O LYS A 129 -3.644 -3.561 -11.981 1.00 0.00 O ATOM 1949 CB LYS A 129 -1.532 -4.691 -14.362 1.00 0.00 C ATOM 1950 CG LYS A 129 -1.635 -5.046 -15.852 1.00 0.00 C ATOM 1951 CD LYS A 129 -0.898 -6.367 -16.123 1.00 0.00 C ATOM 1952 CE LYS A 129 -1.001 -6.766 -17.604 1.00 0.00 C ATOM 1953 NZ LYS A 129 -0.546 -8.162 -17.856 1.00 0.00 N ATOM 0 H LYS A 129 -0.704 -2.331 -14.738 1.00 0.00 H new ATOM 0 HA LYS A 129 -3.275 -3.472 -14.467 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -0.482 -4.556 -14.104 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -1.899 -5.531 -13.773 1.00 0.00 H new ATOM 0 HG2 LYS A 129 -2.682 -5.136 -16.142 1.00 0.00 H new ATOM 0 HG3 LYS A 129 -1.204 -4.248 -16.456 1.00 0.00 H new ATOM 0 HD2 LYS A 129 0.150 -6.266 -15.843 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -1.320 -7.156 -15.501 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -2.035 -6.660 -17.934 1.00 0.00 H new ATOM 0 HE3 LYS A 129 -0.403 -6.079 -18.203 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 -0.507 -8.335 -18.881 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 0.400 -8.298 -17.446 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -1.213 -8.829 -17.417 1.00 0.00 H new ATOM 1967 N ILE A 130 -1.437 -3.214 -11.688 1.00 0.00 N ATOM 1968 CA ILE A 130 -1.485 -3.396 -10.246 1.00 0.00 C ATOM 1969 C ILE A 130 -2.205 -2.271 -9.494 1.00 0.00 C ATOM 1970 O ILE A 130 -2.933 -2.558 -8.538 1.00 0.00 O ATOM 1971 CB ILE A 130 -0.085 -3.700 -9.685 1.00 0.00 C ATOM 1972 CG1 ILE A 130 0.887 -2.520 -9.838 1.00 0.00 C ATOM 1973 CG2 ILE A 130 0.460 -4.988 -10.322 1.00 0.00 C ATOM 1974 CD1 ILE A 130 2.324 -2.810 -9.409 1.00 0.00 C ATOM 0 H ILE A 130 -0.522 -2.943 -12.049 1.00 0.00 H new ATOM 0 HA ILE A 130 -2.110 -4.270 -10.066 1.00 0.00 H new ATOM 0 HB ILE A 130 -0.180 -3.856 -8.610 1.00 0.00 H new ATOM 0 HG12 ILE A 130 0.891 -2.205 -10.881 1.00 0.00 H new ATOM 0 HG13 ILE A 130 0.511 -1.680 -9.253 1.00 0.00 H new ATOM 0 HG21 ILE A 130 1.452 -5.200 -9.922 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -0.209 -5.818 -10.094 1.00 0.00 H new ATOM 0 HG23 ILE A 130 0.524 -4.861 -11.403 1.00 0.00 H new ATOM 0 HD11 ILE A 130 2.934 -1.918 -9.554 1.00 0.00 H new ATOM 0 HD12 ILE A 130 2.339 -3.093 -8.357 1.00 0.00 H new ATOM 0 HD13 ILE A 130 2.726 -3.626 -10.010 1.00 0.00 H new ATOM 1986 N SER A 131 -1.998 -1.020 -9.893 1.00 0.00 N ATOM 1987 CA SER A 131 -2.411 0.176 -9.196 1.00 0.00 C ATOM 1988 C SER A 131 -3.642 0.768 -9.887 1.00 0.00 C ATOM 1989 O SER A 131 -4.767 0.546 -9.382 1.00 0.00 O ATOM 1990 CB SER A 131 -1.229 1.131 -9.108 1.00 0.00 C ATOM 1991 OG SER A 131 -0.223 0.535 -8.293 1.00 0.00 O ATOM 1992 OXT SER A 131 -3.495 1.434 -10.940 1.00 0.00 O ATOM 0 H SER A 131 -1.508 -0.810 -10.763 1.00 0.00 H new ATOM 0 HA SER A 131 -2.713 -0.042 -8.172 1.00 0.00 H new ATOM 0 HB2 SER A 131 -0.836 1.339 -10.103 1.00 0.00 H new ATOM 0 HB3 SER A 131 -1.544 2.085 -8.684 1.00 0.00 H new ATOM 0 HG SER A 131 0.546 1.139 -8.229 1.00 0.00 H new TER 1998 SER A 131