USER MOD reduce.3.24.130724 H: found=0, std=0, add=666, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 667 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 7 LYS NZ :NH3+ 174:sc= -0.9 (180deg=-0.98) USER MOD Single : A 10 HIS : no HE2:sc= -1.74 K(o=-1.7,f=-0.88) USER MOD Single : A 11 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 TYR OH : rot 67:sc= 0.0409 USER MOD Single : A 30 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 THR OG1 : rot 76:sc= 0.4 USER MOD Single : A 34 THR OG1 : rot 78:sc= 1.03 USER MOD Single : A 38 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 43 HIS : no HD1:sc= -2.49! C(o=-2.5!,f=-3.6!) USER MOD Single : A 44 TYR OH : rot -85:sc= -0.831 USER MOD Single : A 45 MET CE :methyl -171:sc= 0 (180deg=-0.0971) USER MOD Single : A 46 ASN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : A 47 ASN : amide:sc= -0.0189 K(o=-0.019,f=1.1) USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 ASN : amide:sc= -1.08 K(o=-1.1,f=-6.1!) USER MOD Single : A 56 GLN : amide:sc= -0.524 K(o=-0.52,f=-6.1!) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 SER OG : rot -88:sc= 0.858 USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 72 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 28 N ASP A 3 141.907 -7.885 4.161 1.00 0.00 N ATOM 29 CA ASP A 3 142.118 -6.754 3.253 1.00 0.00 C ATOM 30 C ASP A 3 142.600 -5.519 4.014 1.00 0.00 C ATOM 31 O ASP A 3 141.796 -4.754 4.550 1.00 0.00 O ATOM 32 CB ASP A 3 140.834 -6.429 2.485 1.00 0.00 C ATOM 33 CG ASP A 3 140.743 -7.176 1.169 1.00 0.00 C ATOM 34 OD1 ASP A 3 141.256 -6.656 0.155 1.00 0.00 O ATOM 35 OD2 ASP A 3 140.161 -8.281 1.154 1.00 0.00 O ATOM 0 HA ASP A 3 142.891 -7.042 2.540 1.00 0.00 H new ATOM 0 HB2 ASP A 3 139.971 -6.680 3.102 1.00 0.00 H new ATOM 0 HB3 ASP A 3 140.789 -5.357 2.295 1.00 0.00 H new ATOM 40 N VAL A 4 143.916 -5.329 4.056 1.00 0.00 N ATOM 41 CA VAL A 4 144.500 -4.185 4.751 1.00 0.00 C ATOM 42 C VAL A 4 144.322 -2.900 3.941 1.00 0.00 C ATOM 43 O VAL A 4 144.395 -2.914 2.711 1.00 0.00 O ATOM 44 CB VAL A 4 146.004 -4.391 5.043 1.00 0.00 C ATOM 45 CG1 VAL A 4 146.532 -3.278 5.937 1.00 0.00 C ATOM 46 CG2 VAL A 4 146.254 -5.751 5.681 1.00 0.00 C ATOM 0 H VAL A 4 144.597 -5.950 3.619 1.00 0.00 H new ATOM 0 HA VAL A 4 143.970 -4.096 5.699 1.00 0.00 H new ATOM 0 HB VAL A 4 146.540 -4.358 4.094 1.00 0.00 H new ATOM 0 HG11 VAL A 4 147.592 -3.440 6.132 1.00 0.00 H new ATOM 0 HG12 VAL A 4 146.397 -2.317 5.440 1.00 0.00 H new ATOM 0 HG13 VAL A 4 145.986 -3.279 6.880 1.00 0.00 H new ATOM 0 HG21 VAL A 4 147.320 -5.871 5.876 1.00 0.00 H new ATOM 0 HG22 VAL A 4 145.703 -5.820 6.619 1.00 0.00 H new ATOM 0 HG23 VAL A 4 145.918 -6.537 5.005 1.00 0.00 H new ATOM 56 N ARG A 5 144.091 -1.789 4.642 1.00 0.00 N ATOM 57 CA ARG A 5 143.906 -0.494 3.993 1.00 0.00 C ATOM 58 C ARG A 5 145.220 0.284 3.952 1.00 0.00 C ATOM 59 O ARG A 5 145.758 0.663 4.995 1.00 0.00 O ATOM 60 CB ARG A 5 142.837 0.322 4.729 1.00 0.00 C ATOM 61 CG ARG A 5 141.457 0.235 4.091 1.00 0.00 C ATOM 62 CD ARG A 5 140.385 0.848 4.982 1.00 0.00 C ATOM 63 NE ARG A 5 140.780 2.157 5.509 1.00 0.00 N ATOM 64 CZ ARG A 5 140.781 3.284 4.791 1.00 0.00 C ATOM 65 NH1 ARG A 5 140.425 3.269 3.508 1.00 0.00 N ATOM 66 NH2 ARG A 5 141.141 4.431 5.358 1.00 0.00 N ATOM 0 H ARG A 5 144.028 -1.762 5.660 1.00 0.00 H new ATOM 0 HA ARG A 5 143.576 -0.670 2.969 1.00 0.00 H new ATOM 0 HB2 ARG A 5 142.774 -0.024 5.761 1.00 0.00 H new ATOM 0 HB3 ARG A 5 143.148 1.366 4.762 1.00 0.00 H new ATOM 0 HG2 ARG A 5 141.468 0.748 3.129 1.00 0.00 H new ATOM 0 HG3 ARG A 5 141.213 -0.809 3.893 1.00 0.00 H new ATOM 0 HD2 ARG A 5 139.460 0.952 4.415 1.00 0.00 H new ATOM 0 HD3 ARG A 5 140.176 0.173 5.812 1.00 0.00 H new ATOM 0 HE ARG A 5 141.072 2.211 6.485 1.00 0.00 H new ATOM 0 HH11 ARG A 5 140.149 2.392 3.066 1.00 0.00 H new ATOM 0 HH12 ARG A 5 140.429 4.134 2.968 1.00 0.00 H new ATOM 0 HH21 ARG A 5 141.416 4.450 6.340 1.00 0.00 H new ATOM 0 HH22 ARG A 5 141.142 5.292 4.811 1.00 0.00 H new ATOM 80 N ILE A 6 145.733 0.513 2.743 1.00 0.00 N ATOM 81 CA ILE A 6 146.989 1.240 2.565 1.00 0.00 C ATOM 82 C ILE A 6 146.766 2.560 1.825 1.00 0.00 C ATOM 83 O ILE A 6 146.056 2.606 0.817 1.00 0.00 O ATOM 84 CB ILE A 6 148.026 0.393 1.791 1.00 0.00 C ATOM 85 CG1 ILE A 6 148.196 -0.981 2.447 1.00 0.00 C ATOM 86 CG2 ILE A 6 149.364 1.115 1.720 1.00 0.00 C ATOM 87 CD1 ILE A 6 147.220 -2.020 1.940 1.00 0.00 C ATOM 0 H ILE A 6 145.298 0.206 1.873 1.00 0.00 H new ATOM 0 HA ILE A 6 147.376 1.450 3.562 1.00 0.00 H new ATOM 0 HB ILE A 6 147.658 0.249 0.775 1.00 0.00 H new ATOM 0 HG12 ILE A 6 149.212 -1.334 2.273 1.00 0.00 H new ATOM 0 HG13 ILE A 6 148.075 -0.877 3.525 1.00 0.00 H new ATOM 0 HG21 ILE A 6 150.079 0.502 1.172 1.00 0.00 H new ATOM 0 HG22 ILE A 6 149.236 2.069 1.208 1.00 0.00 H new ATOM 0 HG23 ILE A 6 149.736 1.292 2.729 1.00 0.00 H new ATOM 0 HD11 ILE A 6 147.400 -2.967 2.449 1.00 0.00 H new ATOM 0 HD12 ILE A 6 146.201 -1.689 2.139 1.00 0.00 H new ATOM 0 HD13 ILE A 6 147.356 -2.153 0.867 1.00 0.00 H new ATOM 99 N LYS A 7 147.382 3.629 2.333 1.00 0.00 N ATOM 100 CA LYS A 7 147.262 4.952 1.724 1.00 0.00 C ATOM 101 C LYS A 7 148.497 5.277 0.886 1.00 0.00 C ATOM 102 O LYS A 7 149.629 5.181 1.366 1.00 0.00 O ATOM 103 CB LYS A 7 147.065 6.023 2.803 1.00 0.00 C ATOM 104 CG LYS A 7 146.182 7.181 2.361 1.00 0.00 C ATOM 105 CD LYS A 7 144.783 7.076 2.951 1.00 0.00 C ATOM 106 CE LYS A 7 143.723 7.527 1.956 1.00 0.00 C ATOM 107 NZ LYS A 7 142.348 7.425 2.522 1.00 0.00 N ATOM 0 H LYS A 7 147.970 3.603 3.166 1.00 0.00 H new ATOM 0 HA LYS A 7 146.390 4.945 1.070 1.00 0.00 H new ATOM 0 HB2 LYS A 7 146.626 5.560 3.687 1.00 0.00 H new ATOM 0 HB3 LYS A 7 148.039 6.413 3.098 1.00 0.00 H new ATOM 0 HG2 LYS A 7 146.637 8.123 2.667 1.00 0.00 H new ATOM 0 HG3 LYS A 7 146.118 7.196 1.273 1.00 0.00 H new ATOM 0 HD2 LYS A 7 144.589 6.046 3.249 1.00 0.00 H new ATOM 0 HD3 LYS A 7 144.720 7.686 3.852 1.00 0.00 H new ATOM 0 HE2 LYS A 7 143.918 8.558 1.661 1.00 0.00 H new ATOM 0 HE3 LYS A 7 143.790 6.919 1.054 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 141.666 7.835 1.853 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 142.113 6.425 2.686 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 142.304 7.943 3.423 1.00 0.00 H new ATOM 121 N PHE A 8 148.271 5.660 -0.370 1.00 0.00 N ATOM 122 CA PHE A 8 149.360 5.999 -1.284 1.00 0.00 C ATOM 123 C PHE A 8 149.422 7.505 -1.529 1.00 0.00 C ATOM 124 O PHE A 8 148.389 8.157 -1.696 1.00 0.00 O ATOM 125 CB PHE A 8 149.183 5.261 -2.615 1.00 0.00 C ATOM 126 CG PHE A 8 149.708 3.851 -2.596 1.00 0.00 C ATOM 127 CD1 PHE A 8 149.105 2.882 -1.810 1.00 0.00 C ATOM 128 CD2 PHE A 8 150.804 3.496 -3.366 1.00 0.00 C ATOM 129 CE1 PHE A 8 149.585 1.587 -1.792 1.00 0.00 C ATOM 130 CE2 PHE A 8 151.289 2.202 -3.352 1.00 0.00 C ATOM 131 CZ PHE A 8 150.678 1.246 -2.564 1.00 0.00 C ATOM 0 H PHE A 8 147.340 5.743 -0.779 1.00 0.00 H new ATOM 0 HA PHE A 8 150.297 5.687 -0.823 1.00 0.00 H new ATOM 0 HB2 PHE A 8 148.124 5.242 -2.872 1.00 0.00 H new ATOM 0 HB3 PHE A 8 149.692 5.819 -3.401 1.00 0.00 H new ATOM 0 HD1 PHE A 8 148.250 3.142 -1.204 1.00 0.00 H new ATOM 0 HD2 PHE A 8 151.285 4.239 -3.984 1.00 0.00 H new ATOM 0 HE1 PHE A 8 149.106 0.842 -1.175 1.00 0.00 H new ATOM 0 HE2 PHE A 8 152.144 1.939 -3.956 1.00 0.00 H new ATOM 0 HZ PHE A 8 151.054 0.234 -2.552 1.00 0.00 H new ATOM 141 N GLU A 9 150.638 8.051 -1.552 1.00 0.00 N ATOM 142 CA GLU A 9 150.834 9.480 -1.778 1.00 0.00 C ATOM 143 C GLU A 9 151.883 9.727 -2.862 1.00 0.00 C ATOM 144 O GLU A 9 153.018 9.255 -2.763 1.00 0.00 O ATOM 145 CB GLU A 9 151.246 10.171 -0.475 1.00 0.00 C ATOM 146 CG GLU A 9 150.069 10.719 0.318 1.00 0.00 C ATOM 147 CD GLU A 9 150.491 11.378 1.618 1.00 0.00 C ATOM 148 OE1 GLU A 9 150.946 12.540 1.574 1.00 0.00 O ATOM 149 OE2 GLU A 9 150.362 10.733 2.680 1.00 0.00 O ATOM 0 H GLU A 9 151.501 7.524 -1.417 1.00 0.00 H new ATOM 0 HA GLU A 9 149.889 9.901 -2.119 1.00 0.00 H new ATOM 0 HB2 GLU A 9 151.794 9.462 0.146 1.00 0.00 H new ATOM 0 HB3 GLU A 9 151.930 10.987 -0.706 1.00 0.00 H new ATOM 0 HG2 GLU A 9 149.531 11.444 -0.293 1.00 0.00 H new ATOM 0 HG3 GLU A 9 149.375 9.908 0.536 1.00 0.00 H new ATOM 156 N HIS A 10 151.491 10.475 -3.896 1.00 0.00 N ATOM 157 CA HIS A 10 152.388 10.795 -5.005 1.00 0.00 C ATOM 158 C HIS A 10 152.077 12.181 -5.566 1.00 0.00 C ATOM 159 O HIS A 10 150.929 12.480 -5.896 1.00 0.00 O ATOM 160 CB HIS A 10 152.262 9.746 -6.115 1.00 0.00 C ATOM 161 CG HIS A 10 153.539 9.494 -6.860 1.00 0.00 C ATOM 162 ND1 HIS A 10 153.572 9.006 -8.150 1.00 0.00 N ATOM 163 CD2 HIS A 10 154.833 9.659 -6.491 1.00 0.00 C ATOM 164 CE1 HIS A 10 154.828 8.881 -8.541 1.00 0.00 C ATOM 165 NE2 HIS A 10 155.612 9.272 -7.553 1.00 0.00 N ATOM 0 H HIS A 10 150.555 10.871 -3.987 1.00 0.00 H new ATOM 0 HA HIS A 10 153.410 10.790 -4.627 1.00 0.00 H new ATOM 0 HB2 HIS A 10 151.916 8.809 -5.678 1.00 0.00 H new ATOM 0 HB3 HIS A 10 151.498 10.069 -6.822 1.00 0.00 H new ATOM 0 HD1 HIS A 10 152.754 8.777 -8.714 1.00 0.00 H new ATOM 0 HD2 HIS A 10 155.185 10.027 -5.539 1.00 0.00 H new ATOM 0 HE1 HIS A 10 155.157 8.521 -9.504 1.00 0.00 H new ATOM 174 N ASN A 11 153.110 13.020 -5.670 1.00 0.00 N ATOM 175 CA ASN A 11 152.960 14.382 -6.189 1.00 0.00 C ATOM 176 C ASN A 11 151.967 15.197 -5.350 1.00 0.00 C ATOM 177 O ASN A 11 151.327 16.120 -5.857 1.00 0.00 O ATOM 178 CB ASN A 11 152.506 14.347 -7.653 1.00 0.00 C ATOM 179 CG ASN A 11 153.272 15.332 -8.516 1.00 0.00 C ATOM 180 OD1 ASN A 11 152.797 16.433 -8.792 1.00 0.00 O ATOM 181 ND2 ASN A 11 154.468 14.941 -8.945 1.00 0.00 N ATOM 0 H ASN A 11 154.064 12.779 -5.400 1.00 0.00 H new ATOM 0 HA ASN A 11 153.933 14.869 -6.127 1.00 0.00 H new ATOM 0 HB2 ASN A 11 152.639 13.340 -8.049 1.00 0.00 H new ATOM 0 HB3 ASN A 11 151.441 14.572 -7.706 1.00 0.00 H new ATOM 0 HD21 ASN A 11 155.030 15.563 -9.527 1.00 0.00 H new ATOM 0 HD22 ASN A 11 154.824 14.019 -8.693 1.00 0.00 H new ATOM 188 N GLY A 12 151.841 14.850 -4.065 1.00 0.00 N ATOM 189 CA GLY A 12 150.922 15.558 -3.187 1.00 0.00 C ATOM 190 C GLY A 12 149.513 14.973 -3.197 1.00 0.00 C ATOM 191 O GLY A 12 148.703 15.293 -2.324 1.00 0.00 O ATOM 0 H GLY A 12 152.359 14.092 -3.620 1.00 0.00 H new ATOM 0 HA2 GLY A 12 151.311 15.535 -2.169 1.00 0.00 H new ATOM 0 HA3 GLY A 12 150.876 16.605 -3.487 1.00 0.00 H new ATOM 195 N GLU A 13 149.219 14.115 -4.179 1.00 0.00 N ATOM 196 CA GLU A 13 147.904 13.488 -4.291 1.00 0.00 C ATOM 197 C GLU A 13 147.800 12.262 -3.386 1.00 0.00 C ATOM 198 O GLU A 13 148.812 11.731 -2.922 1.00 0.00 O ATOM 199 CB GLU A 13 147.632 13.086 -5.742 1.00 0.00 C ATOM 200 CG GLU A 13 147.154 14.235 -6.617 1.00 0.00 C ATOM 201 CD GLU A 13 147.431 14.003 -8.090 1.00 0.00 C ATOM 202 OE1 GLU A 13 146.626 13.304 -8.743 1.00 0.00 O ATOM 203 OE2 GLU A 13 148.452 14.518 -8.591 1.00 0.00 O ATOM 0 H GLU A 13 149.878 13.840 -4.908 1.00 0.00 H new ATOM 0 HA GLU A 13 147.157 14.215 -3.972 1.00 0.00 H new ATOM 0 HB2 GLU A 13 148.543 12.669 -6.171 1.00 0.00 H new ATOM 0 HB3 GLU A 13 146.883 12.295 -5.756 1.00 0.00 H new ATOM 0 HG2 GLU A 13 146.083 14.377 -6.471 1.00 0.00 H new ATOM 0 HG3 GLU A 13 147.644 15.156 -6.300 1.00 0.00 H new ATOM 210 N ARG A 14 146.567 11.815 -3.141 1.00 0.00 N ATOM 211 CA ARG A 14 146.324 10.650 -2.294 1.00 0.00 C ATOM 212 C ARG A 14 145.585 9.551 -3.061 1.00 0.00 C ATOM 213 O ARG A 14 144.849 9.828 -4.010 1.00 0.00 O ATOM 214 CB ARG A 14 145.514 11.050 -1.057 1.00 0.00 C ATOM 215 CG ARG A 14 146.372 11.443 0.136 1.00 0.00 C ATOM 216 CD ARG A 14 145.523 11.692 1.373 1.00 0.00 C ATOM 217 NE ARG A 14 146.293 12.305 2.454 1.00 0.00 N ATOM 218 CZ ARG A 14 145.748 12.946 3.492 1.00 0.00 C ATOM 219 NH1 ARG A 14 144.425 13.052 3.602 1.00 0.00 N ATOM 220 NH2 ARG A 14 146.528 13.480 4.425 1.00 0.00 N ATOM 0 H ARG A 14 145.722 12.244 -3.518 1.00 0.00 H new ATOM 0 HA ARG A 14 147.292 10.260 -1.981 1.00 0.00 H new ATOM 0 HB2 ARG A 14 144.862 11.885 -1.315 1.00 0.00 H new ATOM 0 HB3 ARG A 14 144.869 10.219 -0.771 1.00 0.00 H new ATOM 0 HG2 ARG A 14 147.095 10.653 0.342 1.00 0.00 H new ATOM 0 HG3 ARG A 14 146.941 12.341 -0.103 1.00 0.00 H new ATOM 0 HD2 ARG A 14 144.685 12.339 1.113 1.00 0.00 H new ATOM 0 HD3 ARG A 14 145.101 10.748 1.719 1.00 0.00 H new ATOM 0 HE ARG A 14 147.310 12.239 2.413 1.00 0.00 H new ATOM 0 HH11 ARG A 14 143.820 12.642 2.891 1.00 0.00 H new ATOM 0 HH12 ARG A 14 144.017 13.543 4.398 1.00 0.00 H new ATOM 0 HH21 ARG A 14 147.542 13.401 4.349 1.00 0.00 H new ATOM 0 HH22 ARG A 14 146.113 13.970 5.218 1.00 0.00 H new ATOM 234 N ARG A 15 145.787 8.302 -2.638 1.00 0.00 N ATOM 235 CA ARG A 15 145.142 7.157 -3.276 1.00 0.00 C ATOM 236 C ARG A 15 144.798 6.078 -2.248 1.00 0.00 C ATOM 237 O ARG A 15 145.571 5.822 -1.323 1.00 0.00 O ATOM 238 CB ARG A 15 146.048 6.572 -4.364 1.00 0.00 C ATOM 239 CG ARG A 15 145.635 6.956 -5.777 1.00 0.00 C ATOM 240 CD ARG A 15 145.072 5.764 -6.539 1.00 0.00 C ATOM 241 NE ARG A 15 143.923 6.132 -7.368 1.00 0.00 N ATOM 242 CZ ARG A 15 143.459 5.390 -8.379 1.00 0.00 C ATOM 243 NH1 ARG A 15 144.037 4.233 -8.694 1.00 0.00 N ATOM 244 NH2 ARG A 15 142.409 5.807 -9.079 1.00 0.00 N ATOM 0 H ARG A 15 146.394 8.059 -1.855 1.00 0.00 H new ATOM 0 HA ARG A 15 144.216 7.505 -3.733 1.00 0.00 H new ATOM 0 HB2 ARG A 15 147.071 6.906 -4.191 1.00 0.00 H new ATOM 0 HB3 ARG A 15 146.049 5.485 -4.278 1.00 0.00 H new ATOM 0 HG2 ARG A 15 144.888 7.748 -5.736 1.00 0.00 H new ATOM 0 HG3 ARG A 15 146.496 7.357 -6.312 1.00 0.00 H new ATOM 0 HD2 ARG A 15 145.851 5.337 -7.170 1.00 0.00 H new ATOM 0 HD3 ARG A 15 144.775 4.990 -5.832 1.00 0.00 H new ATOM 0 HE ARG A 15 143.446 7.010 -7.161 1.00 0.00 H new ATOM 0 HH11 ARG A 15 144.843 3.904 -8.162 1.00 0.00 H new ATOM 0 HH12 ARG A 15 143.674 3.676 -9.467 1.00 0.00 H new ATOM 0 HH21 ARG A 15 141.959 6.692 -8.845 1.00 0.00 H new ATOM 0 HH22 ARG A 15 142.054 5.242 -9.851 1.00 0.00 H new ATOM 258 N ILE A 16 143.634 5.451 -2.421 1.00 0.00 N ATOM 259 CA ILE A 16 143.183 4.399 -1.513 1.00 0.00 C ATOM 260 C ILE A 16 143.175 3.041 -2.214 1.00 0.00 C ATOM 261 O ILE A 16 142.462 2.850 -3.202 1.00 0.00 O ATOM 262 CB ILE A 16 141.767 4.688 -0.965 1.00 0.00 C ATOM 263 CG1 ILE A 16 141.678 6.117 -0.420 1.00 0.00 C ATOM 264 CG2 ILE A 16 141.400 3.684 0.119 1.00 0.00 C ATOM 265 CD1 ILE A 16 140.494 6.895 -0.952 1.00 0.00 C ATOM 0 H ILE A 16 142.987 5.654 -3.183 1.00 0.00 H new ATOM 0 HA ILE A 16 143.886 4.378 -0.680 1.00 0.00 H new ATOM 0 HB ILE A 16 141.057 4.589 -1.786 1.00 0.00 H new ATOM 0 HG12 ILE A 16 141.618 6.079 0.668 1.00 0.00 H new ATOM 0 HG13 ILE A 16 142.595 6.650 -0.671 1.00 0.00 H new ATOM 0 HG21 ILE A 16 140.400 3.902 0.494 1.00 0.00 H new ATOM 0 HG22 ILE A 16 141.420 2.676 -0.296 1.00 0.00 H new ATOM 0 HG23 ILE A 16 142.117 3.753 0.937 1.00 0.00 H new ATOM 0 HD11 ILE A 16 140.495 7.897 -0.523 1.00 0.00 H new ATOM 0 HD12 ILE A 16 140.562 6.964 -2.038 1.00 0.00 H new ATOM 0 HD13 ILE A 16 139.571 6.384 -0.679 1.00 0.00 H new ATOM 277 N ILE A 17 143.968 2.102 -1.697 1.00 0.00 N ATOM 278 CA ILE A 17 144.047 0.763 -2.275 1.00 0.00 C ATOM 279 C ILE A 17 144.100 -0.309 -1.184 1.00 0.00 C ATOM 280 O ILE A 17 144.896 -0.220 -0.246 1.00 0.00 O ATOM 281 CB ILE A 17 145.274 0.622 -3.207 1.00 0.00 C ATOM 282 CG1 ILE A 17 145.264 -0.738 -3.915 1.00 0.00 C ATOM 283 CG2 ILE A 17 146.568 0.814 -2.428 1.00 0.00 C ATOM 284 CD1 ILE A 17 144.756 -0.677 -5.340 1.00 0.00 C ATOM 0 H ILE A 17 144.563 2.245 -0.881 1.00 0.00 H new ATOM 0 HA ILE A 17 143.143 0.617 -2.866 1.00 0.00 H new ATOM 0 HB ILE A 17 145.215 1.402 -3.966 1.00 0.00 H new ATOM 0 HG12 ILE A 17 146.275 -1.145 -3.916 1.00 0.00 H new ATOM 0 HG13 ILE A 17 144.643 -1.430 -3.346 1.00 0.00 H new ATOM 0 HG21 ILE A 17 147.418 0.711 -3.103 1.00 0.00 H new ATOM 0 HG22 ILE A 17 146.579 1.808 -1.980 1.00 0.00 H new ATOM 0 HG23 ILE A 17 146.635 0.061 -1.642 1.00 0.00 H new ATOM 0 HD11 ILE A 17 144.778 -1.675 -5.777 1.00 0.00 H new ATOM 0 HD12 ILE A 17 143.733 -0.300 -5.346 1.00 0.00 H new ATOM 0 HD13 ILE A 17 145.391 -0.011 -5.924 1.00 0.00 H new ATOM 296 N ALA A 18 143.242 -1.322 -1.318 1.00 0.00 N ATOM 297 CA ALA A 18 143.183 -2.416 -0.352 1.00 0.00 C ATOM 298 C ALA A 18 143.943 -3.639 -0.861 1.00 0.00 C ATOM 299 O ALA A 18 143.815 -4.017 -2.028 1.00 0.00 O ATOM 300 CB ALA A 18 141.733 -2.777 -0.053 1.00 0.00 C ATOM 0 H ALA A 18 142.578 -1.406 -2.088 1.00 0.00 H new ATOM 0 HA ALA A 18 143.660 -2.083 0.570 1.00 0.00 H new ATOM 0 HB1 ALA A 18 141.703 -3.594 0.668 1.00 0.00 H new ATOM 0 HB2 ALA A 18 141.220 -1.909 0.360 1.00 0.00 H new ATOM 0 HB3 ALA A 18 141.238 -3.087 -0.973 1.00 0.00 H new ATOM 306 N PHE A 19 144.733 -4.252 0.020 1.00 0.00 N ATOM 307 CA PHE A 19 145.516 -5.433 -0.340 1.00 0.00 C ATOM 308 C PHE A 19 145.183 -6.614 0.573 1.00 0.00 C ATOM 309 O PHE A 19 145.245 -6.500 1.799 1.00 0.00 O ATOM 310 CB PHE A 19 147.015 -5.119 -0.266 1.00 0.00 C ATOM 311 CG PHE A 19 147.536 -4.377 -1.468 1.00 0.00 C ATOM 312 CD1 PHE A 19 147.695 -5.024 -2.683 1.00 0.00 C ATOM 313 CD2 PHE A 19 147.865 -3.033 -1.382 1.00 0.00 C ATOM 314 CE1 PHE A 19 148.173 -4.346 -3.789 1.00 0.00 C ATOM 315 CE2 PHE A 19 148.343 -2.349 -2.484 1.00 0.00 C ATOM 316 CZ PHE A 19 148.497 -3.007 -3.689 1.00 0.00 C ATOM 0 H PHE A 19 144.848 -3.950 0.988 1.00 0.00 H new ATOM 0 HA PHE A 19 145.259 -5.709 -1.363 1.00 0.00 H new ATOM 0 HB2 PHE A 19 147.210 -4.527 0.628 1.00 0.00 H new ATOM 0 HB3 PHE A 19 147.568 -6.052 -0.158 1.00 0.00 H new ATOM 0 HD1 PHE A 19 147.442 -6.071 -2.767 1.00 0.00 H new ATOM 0 HD2 PHE A 19 147.746 -2.514 -0.442 1.00 0.00 H new ATOM 0 HE1 PHE A 19 148.293 -4.863 -4.730 1.00 0.00 H new ATOM 0 HE2 PHE A 19 148.596 -1.302 -2.403 1.00 0.00 H new ATOM 0 HZ PHE A 19 148.870 -2.475 -4.552 1.00 0.00 H new ATOM 326 N SER A 20 144.833 -7.748 -0.038 1.00 0.00 N ATOM 327 CA SER A 20 144.491 -8.958 0.710 1.00 0.00 C ATOM 328 C SER A 20 145.738 -9.592 1.327 1.00 0.00 C ATOM 329 O SER A 20 146.788 -9.664 0.686 1.00 0.00 O ATOM 330 CB SER A 20 143.794 -9.968 -0.204 1.00 0.00 C ATOM 331 OG SER A 20 142.416 -9.667 -0.341 1.00 0.00 O ATOM 0 H SER A 20 144.779 -7.853 -1.051 1.00 0.00 H new ATOM 0 HA SER A 20 143.813 -8.675 1.515 1.00 0.00 H new ATOM 0 HB2 SER A 20 144.269 -9.964 -1.185 1.00 0.00 H new ATOM 0 HB3 SER A 20 143.911 -10.972 0.203 1.00 0.00 H new ATOM 0 HG SER A 20 141.994 -10.326 -0.931 1.00 0.00 H new ATOM 337 N ARG A 21 145.612 -10.055 2.571 1.00 0.00 N ATOM 338 CA ARG A 21 146.727 -10.689 3.273 1.00 0.00 C ATOM 339 C ARG A 21 146.564 -12.212 3.298 1.00 0.00 C ATOM 340 O ARG A 21 145.443 -12.722 3.245 1.00 0.00 O ATOM 341 CB ARG A 21 146.841 -10.143 4.704 1.00 0.00 C ATOM 342 CG ARG A 21 145.625 -10.427 5.577 1.00 0.00 C ATOM 343 CD ARG A 21 144.713 -9.213 5.684 1.00 0.00 C ATOM 344 NE ARG A 21 144.779 -8.592 7.007 1.00 0.00 N ATOM 345 CZ ARG A 21 144.300 -9.151 8.123 1.00 0.00 C ATOM 346 NH1 ARG A 21 143.715 -10.346 8.082 1.00 0.00 N ATOM 347 NH2 ARG A 21 144.410 -8.512 9.283 1.00 0.00 N ATOM 0 H ARG A 21 144.749 -10.003 3.113 1.00 0.00 H new ATOM 0 HA ARG A 21 147.644 -10.452 2.733 1.00 0.00 H new ATOM 0 HB2 ARG A 21 147.723 -10.575 5.177 1.00 0.00 H new ATOM 0 HB3 ARG A 21 146.999 -9.065 4.659 1.00 0.00 H new ATOM 0 HG2 ARG A 21 145.067 -11.266 5.162 1.00 0.00 H new ATOM 0 HG3 ARG A 21 145.953 -10.724 6.573 1.00 0.00 H new ATOM 0 HD2 ARG A 21 144.993 -8.482 4.926 1.00 0.00 H new ATOM 0 HD3 ARG A 21 143.686 -9.512 5.475 1.00 0.00 H new ATOM 0 HE ARG A 21 145.218 -7.675 7.083 1.00 0.00 H new ATOM 0 HH11 ARG A 21 143.630 -10.842 7.195 1.00 0.00 H new ATOM 0 HH12 ARG A 21 143.352 -10.766 8.938 1.00 0.00 H new ATOM 0 HH21 ARG A 21 144.859 -7.597 9.321 1.00 0.00 H new ATOM 0 HH22 ARG A 21 144.045 -8.937 10.136 1.00 0.00 H new ATOM 361 N PRO A 22 147.683 -12.962 3.375 1.00 0.00 N ATOM 362 CA PRO A 22 149.035 -12.389 3.440 1.00 0.00 C ATOM 363 C PRO A 22 149.534 -11.897 2.081 1.00 0.00 C ATOM 364 O PRO A 22 149.437 -12.608 1.078 1.00 0.00 O ATOM 365 CB PRO A 22 149.883 -13.564 3.927 1.00 0.00 C ATOM 366 CG PRO A 22 149.178 -14.774 3.416 1.00 0.00 C ATOM 367 CD PRO A 22 147.709 -14.438 3.409 1.00 0.00 C ATOM 0 HA PRO A 22 149.076 -11.511 4.085 1.00 0.00 H new ATOM 0 HB2 PRO A 22 150.901 -13.505 3.541 1.00 0.00 H new ATOM 0 HB3 PRO A 22 149.955 -13.577 5.015 1.00 0.00 H new ATOM 0 HG2 PRO A 22 149.523 -15.030 2.414 1.00 0.00 H new ATOM 0 HG3 PRO A 22 149.376 -15.637 4.052 1.00 0.00 H new ATOM 0 HD2 PRO A 22 147.205 -14.867 2.543 1.00 0.00 H new ATOM 0 HD3 PRO A 22 147.206 -14.826 4.295 1.00 0.00 H new ATOM 375 N VAL A 23 150.073 -10.678 2.058 1.00 0.00 N ATOM 376 CA VAL A 23 150.594 -10.089 0.827 1.00 0.00 C ATOM 377 C VAL A 23 152.119 -9.977 0.872 1.00 0.00 C ATOM 378 O VAL A 23 152.689 -9.478 1.844 1.00 0.00 O ATOM 379 CB VAL A 23 149.977 -8.696 0.554 1.00 0.00 C ATOM 380 CG1 VAL A 23 150.329 -7.709 1.660 1.00 0.00 C ATOM 381 CG2 VAL A 23 150.424 -8.170 -0.803 1.00 0.00 C ATOM 0 H VAL A 23 150.160 -10.080 2.879 1.00 0.00 H new ATOM 0 HA VAL A 23 150.311 -10.756 0.013 1.00 0.00 H new ATOM 0 HB VAL A 23 148.893 -8.806 0.541 1.00 0.00 H new ATOM 0 HG11 VAL A 23 149.881 -6.740 1.439 1.00 0.00 H new ATOM 0 HG12 VAL A 23 149.946 -8.077 2.612 1.00 0.00 H new ATOM 0 HG13 VAL A 23 151.412 -7.602 1.721 1.00 0.00 H new ATOM 0 HG21 VAL A 23 149.980 -7.190 -0.977 1.00 0.00 H new ATOM 0 HG22 VAL A 23 151.511 -8.085 -0.820 1.00 0.00 H new ATOM 0 HG23 VAL A 23 150.102 -8.858 -1.584 1.00 0.00 H new ATOM 391 N LYS A 24 152.771 -10.451 -0.188 1.00 0.00 N ATOM 392 CA LYS A 24 154.228 -10.411 -0.279 1.00 0.00 C ATOM 393 C LYS A 24 154.702 -9.100 -0.903 1.00 0.00 C ATOM 394 O LYS A 24 154.050 -8.557 -1.796 1.00 0.00 O ATOM 395 CB LYS A 24 154.739 -11.593 -1.107 1.00 0.00 C ATOM 396 CG LYS A 24 155.501 -12.628 -0.294 1.00 0.00 C ATOM 397 CD LYS A 24 154.943 -14.025 -0.513 1.00 0.00 C ATOM 398 CE LYS A 24 155.691 -15.064 0.312 1.00 0.00 C ATOM 399 NZ LYS A 24 154.840 -15.639 1.393 1.00 0.00 N ATOM 0 H LYS A 24 152.311 -10.868 -0.997 1.00 0.00 H new ATOM 0 HA LYS A 24 154.631 -10.478 0.732 1.00 0.00 H new ATOM 0 HB2 LYS A 24 153.892 -12.078 -1.592 1.00 0.00 H new ATOM 0 HB3 LYS A 24 155.387 -11.217 -1.898 1.00 0.00 H new ATOM 0 HG2 LYS A 24 156.555 -12.608 -0.572 1.00 0.00 H new ATOM 0 HG3 LYS A 24 155.446 -12.374 0.765 1.00 0.00 H new ATOM 0 HD2 LYS A 24 153.886 -14.041 -0.247 1.00 0.00 H new ATOM 0 HD3 LYS A 24 155.010 -14.282 -1.570 1.00 0.00 H new ATOM 0 HE2 LYS A 24 156.037 -15.865 -0.341 1.00 0.00 H new ATOM 0 HE3 LYS A 24 156.577 -14.607 0.753 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 155.388 -16.341 1.930 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 154.530 -14.879 2.032 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 154.007 -16.098 0.972 1.00 0.00 H new ATOM 413 N TYR A 25 155.846 -8.604 -0.429 1.00 0.00 N ATOM 414 CA TYR A 25 156.424 -7.358 -0.939 1.00 0.00 C ATOM 415 C TYR A 25 156.605 -7.413 -2.458 1.00 0.00 C ATOM 416 O TYR A 25 156.403 -6.413 -3.147 1.00 0.00 O ATOM 417 CB TYR A 25 157.773 -7.079 -0.264 1.00 0.00 C ATOM 418 CG TYR A 25 158.396 -5.754 -0.653 1.00 0.00 C ATOM 419 CD1 TYR A 25 157.882 -4.554 -0.175 1.00 0.00 C ATOM 420 CD2 TYR A 25 159.502 -5.702 -1.495 1.00 0.00 C ATOM 421 CE1 TYR A 25 158.450 -3.345 -0.523 1.00 0.00 C ATOM 422 CE2 TYR A 25 160.075 -4.495 -1.848 1.00 0.00 C ATOM 423 CZ TYR A 25 159.547 -3.319 -1.359 1.00 0.00 C ATOM 424 OH TYR A 25 160.115 -2.114 -1.707 1.00 0.00 O ATOM 0 H TYR A 25 156.393 -9.047 0.309 1.00 0.00 H new ATOM 0 HA TYR A 25 155.732 -6.549 -0.705 1.00 0.00 H new ATOM 0 HB2 TYR A 25 157.638 -7.101 0.817 1.00 0.00 H new ATOM 0 HB3 TYR A 25 158.466 -7.882 -0.515 1.00 0.00 H new ATOM 0 HD1 TYR A 25 157.023 -4.568 0.480 1.00 0.00 H new ATOM 0 HD2 TYR A 25 159.920 -6.621 -1.879 1.00 0.00 H new ATOM 0 HE1 TYR A 25 158.037 -2.423 -0.142 1.00 0.00 H new ATOM 0 HE2 TYR A 25 160.933 -4.473 -2.504 1.00 0.00 H new ATOM 0 HH TYR A 25 160.516 -1.700 -0.914 1.00 0.00 H new ATOM 434 N GLU A 26 156.984 -8.586 -2.971 1.00 0.00 N ATOM 435 CA GLU A 26 157.188 -8.769 -4.409 1.00 0.00 C ATOM 436 C GLU A 26 155.909 -8.468 -5.187 1.00 0.00 C ATOM 437 O GLU A 26 155.943 -7.783 -6.211 1.00 0.00 O ATOM 438 CB GLU A 26 157.644 -10.199 -4.707 1.00 0.00 C ATOM 439 CG GLU A 26 159.148 -10.393 -4.613 1.00 0.00 C ATOM 440 CD GLU A 26 159.544 -11.856 -4.580 1.00 0.00 C ATOM 441 OE1 GLU A 26 159.510 -12.505 -5.648 1.00 0.00 O ATOM 442 OE2 GLU A 26 159.885 -12.354 -3.487 1.00 0.00 O ATOM 0 H GLU A 26 157.156 -9.422 -2.412 1.00 0.00 H new ATOM 0 HA GLU A 26 157.962 -8.071 -4.726 1.00 0.00 H new ATOM 0 HB2 GLU A 26 157.155 -10.880 -4.010 1.00 0.00 H new ATOM 0 HB3 GLU A 26 157.313 -10.475 -5.708 1.00 0.00 H new ATOM 0 HG2 GLU A 26 159.627 -9.909 -5.464 1.00 0.00 H new ATOM 0 HG3 GLU A 26 159.519 -9.899 -3.715 1.00 0.00 H new ATOM 449 N ASP A 27 154.782 -8.985 -4.695 1.00 0.00 N ATOM 450 CA ASP A 27 153.493 -8.771 -5.346 1.00 0.00 C ATOM 451 C ASP A 27 153.115 -7.292 -5.344 1.00 0.00 C ATOM 452 O ASP A 27 152.661 -6.761 -6.359 1.00 0.00 O ATOM 453 CB ASP A 27 152.398 -9.595 -4.659 1.00 0.00 C ATOM 454 CG ASP A 27 151.082 -9.558 -5.415 1.00 0.00 C ATOM 455 OD1 ASP A 27 151.093 -9.781 -6.645 1.00 0.00 O ATOM 456 OD2 ASP A 27 150.039 -9.307 -4.776 1.00 0.00 O ATOM 0 H ASP A 27 154.738 -9.554 -3.849 1.00 0.00 H new ATOM 0 HA ASP A 27 153.584 -9.100 -6.381 1.00 0.00 H new ATOM 0 HB2 ASP A 27 152.731 -10.629 -4.565 1.00 0.00 H new ATOM 0 HB3 ASP A 27 152.243 -9.217 -3.648 1.00 0.00 H new ATOM 461 N VAL A 28 153.310 -6.629 -4.203 1.00 0.00 N ATOM 462 CA VAL A 28 152.992 -5.208 -4.081 1.00 0.00 C ATOM 463 C VAL A 28 153.895 -4.369 -4.981 1.00 0.00 C ATOM 464 O VAL A 28 153.415 -3.518 -5.731 1.00 0.00 O ATOM 465 CB VAL A 28 153.121 -4.709 -2.625 1.00 0.00 C ATOM 466 CG1 VAL A 28 152.609 -3.279 -2.501 1.00 0.00 C ATOM 467 CG2 VAL A 28 152.374 -5.633 -1.673 1.00 0.00 C ATOM 0 H VAL A 28 153.685 -7.052 -3.354 1.00 0.00 H new ATOM 0 HA VAL A 28 151.954 -5.092 -4.394 1.00 0.00 H new ATOM 0 HB VAL A 28 154.176 -4.719 -2.351 1.00 0.00 H new ATOM 0 HG11 VAL A 28 152.708 -2.945 -1.468 1.00 0.00 H new ATOM 0 HG12 VAL A 28 153.192 -2.626 -3.151 1.00 0.00 H new ATOM 0 HG13 VAL A 28 151.560 -3.241 -2.795 1.00 0.00 H new ATOM 0 HG21 VAL A 28 152.477 -5.264 -0.652 1.00 0.00 H new ATOM 0 HG22 VAL A 28 151.319 -5.659 -1.945 1.00 0.00 H new ATOM 0 HG23 VAL A 28 152.791 -6.638 -1.740 1.00 0.00 H new ATOM 477 N GLU A 29 155.203 -4.622 -4.908 1.00 0.00 N ATOM 478 CA GLU A 29 156.176 -3.896 -5.723 1.00 0.00 C ATOM 479 C GLU A 29 155.846 -4.028 -7.211 1.00 0.00 C ATOM 480 O GLU A 29 155.935 -3.055 -7.961 1.00 0.00 O ATOM 481 CB GLU A 29 157.591 -4.414 -5.451 1.00 0.00 C ATOM 482 CG GLU A 29 158.675 -3.373 -5.686 1.00 0.00 C ATOM 483 CD GLU A 29 160.076 -3.919 -5.473 1.00 0.00 C ATOM 484 OE1 GLU A 29 160.379 -5.012 -5.997 1.00 0.00 O ATOM 485 OE2 GLU A 29 160.873 -3.249 -4.785 1.00 0.00 O ATOM 0 H GLU A 29 155.612 -5.325 -4.292 1.00 0.00 H new ATOM 0 HA GLU A 29 156.127 -2.842 -5.451 1.00 0.00 H new ATOM 0 HB2 GLU A 29 157.650 -4.762 -4.420 1.00 0.00 H new ATOM 0 HB3 GLU A 29 157.782 -5.277 -6.089 1.00 0.00 H new ATOM 0 HG2 GLU A 29 158.590 -2.991 -6.703 1.00 0.00 H new ATOM 0 HG3 GLU A 29 158.513 -2.530 -5.015 1.00 0.00 H new ATOM 492 N HIS A 30 155.455 -5.236 -7.628 1.00 0.00 N ATOM 493 CA HIS A 30 155.103 -5.490 -9.026 1.00 0.00 C ATOM 494 C HIS A 30 153.973 -4.563 -9.477 1.00 0.00 C ATOM 495 O HIS A 30 154.012 -4.017 -10.581 1.00 0.00 O ATOM 496 CB HIS A 30 154.686 -6.953 -9.218 1.00 0.00 C ATOM 497 CG HIS A 30 154.758 -7.418 -10.642 1.00 0.00 C ATOM 498 ND1 HIS A 30 155.947 -7.665 -11.295 1.00 0.00 N ATOM 499 CD2 HIS A 30 153.777 -7.684 -11.539 1.00 0.00 C ATOM 500 CE1 HIS A 30 155.696 -8.062 -12.531 1.00 0.00 C ATOM 501 NE2 HIS A 30 154.387 -8.082 -12.703 1.00 0.00 N ATOM 0 H HIS A 30 155.375 -6.050 -7.019 1.00 0.00 H new ATOM 0 HA HIS A 30 155.983 -5.291 -9.637 1.00 0.00 H new ATOM 0 HB2 HIS A 30 155.326 -7.588 -8.605 1.00 0.00 H new ATOM 0 HB3 HIS A 30 153.667 -7.082 -8.854 1.00 0.00 H new ATOM 0 HD2 HIS A 30 152.714 -7.599 -11.370 1.00 0.00 H new ATOM 0 HE1 HIS A 30 156.435 -8.325 -13.273 1.00 0.00 H new ATOM 0 HE2 HIS A 30 153.906 -8.350 -13.562 1.00 0.00 H new ATOM 510 N LYS A 31 152.972 -4.383 -8.611 1.00 0.00 N ATOM 511 CA LYS A 31 151.836 -3.514 -8.918 1.00 0.00 C ATOM 512 C LYS A 31 152.270 -2.052 -9.010 1.00 0.00 C ATOM 513 O LYS A 31 151.913 -1.354 -9.957 1.00 0.00 O ATOM 514 CB LYS A 31 150.740 -3.660 -7.855 1.00 0.00 C ATOM 515 CG LYS A 31 149.329 -3.590 -8.422 1.00 0.00 C ATOM 516 CD LYS A 31 148.342 -3.048 -7.399 1.00 0.00 C ATOM 517 CE LYS A 31 147.003 -3.770 -7.470 1.00 0.00 C ATOM 518 NZ LYS A 31 146.018 -3.041 -8.318 1.00 0.00 N ATOM 0 H LYS A 31 152.926 -4.827 -7.694 1.00 0.00 H new ATOM 0 HA LYS A 31 151.439 -3.821 -9.885 1.00 0.00 H new ATOM 0 HB2 LYS A 31 150.869 -4.612 -7.340 1.00 0.00 H new ATOM 0 HB3 LYS A 31 150.862 -2.875 -7.109 1.00 0.00 H new ATOM 0 HG2 LYS A 31 149.323 -2.954 -9.307 1.00 0.00 H new ATOM 0 HG3 LYS A 31 149.015 -4.584 -8.741 1.00 0.00 H new ATOM 0 HD2 LYS A 31 148.760 -3.155 -6.398 1.00 0.00 H new ATOM 0 HD3 LYS A 31 148.190 -1.982 -7.569 1.00 0.00 H new ATOM 0 HE2 LYS A 31 147.153 -4.773 -7.870 1.00 0.00 H new ATOM 0 HE3 LYS A 31 146.600 -3.885 -6.464 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 145.121 -3.567 -8.339 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 145.854 -2.093 -7.923 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 146.390 -2.953 -9.285 1.00 0.00 H new ATOM 532 N VAL A 32 153.042 -1.596 -8.020 1.00 0.00 N ATOM 533 CA VAL A 32 153.519 -0.211 -7.994 1.00 0.00 C ATOM 534 C VAL A 32 154.313 0.122 -9.256 1.00 0.00 C ATOM 535 O VAL A 32 154.107 1.171 -9.869 1.00 0.00 O ATOM 536 CB VAL A 32 154.396 0.074 -6.753 1.00 0.00 C ATOM 537 CG1 VAL A 32 154.739 1.555 -6.666 1.00 0.00 C ATOM 538 CG2 VAL A 32 153.700 -0.389 -5.480 1.00 0.00 C ATOM 0 H VAL A 32 153.349 -2.163 -7.229 1.00 0.00 H new ATOM 0 HA VAL A 32 152.632 0.421 -7.946 1.00 0.00 H new ATOM 0 HB VAL A 32 155.324 -0.488 -6.858 1.00 0.00 H new ATOM 0 HG11 VAL A 32 155.357 1.734 -5.786 1.00 0.00 H new ATOM 0 HG12 VAL A 32 155.286 1.855 -7.560 1.00 0.00 H new ATOM 0 HG13 VAL A 32 153.821 2.137 -6.590 1.00 0.00 H new ATOM 0 HG21 VAL A 32 154.336 -0.178 -4.620 1.00 0.00 H new ATOM 0 HG22 VAL A 32 152.754 0.140 -5.370 1.00 0.00 H new ATOM 0 HG23 VAL A 32 153.512 -1.461 -5.538 1.00 0.00 H new ATOM 548 N THR A 33 155.215 -0.783 -9.639 1.00 0.00 N ATOM 549 CA THR A 33 156.036 -0.596 -10.831 1.00 0.00 C ATOM 550 C THR A 33 155.170 -0.533 -12.092 1.00 0.00 C ATOM 551 O THR A 33 155.447 0.249 -12.998 1.00 0.00 O ATOM 552 CB THR A 33 157.068 -1.722 -10.954 1.00 0.00 C ATOM 553 OG1 THR A 33 157.908 -1.760 -9.812 1.00 0.00 O ATOM 554 CG2 THR A 33 157.960 -1.588 -12.171 1.00 0.00 C ATOM 0 H THR A 33 155.394 -1.654 -9.138 1.00 0.00 H new ATOM 0 HA THR A 33 156.561 0.354 -10.730 1.00 0.00 H new ATOM 0 HB THR A 33 156.484 -2.638 -11.048 1.00 0.00 H new ATOM 0 HG1 THR A 33 157.424 -2.166 -9.063 1.00 0.00 H new ATOM 0 HG21 THR A 33 158.667 -2.417 -12.197 1.00 0.00 H new ATOM 0 HG22 THR A 33 157.349 -1.604 -13.073 1.00 0.00 H new ATOM 0 HG23 THR A 33 158.507 -0.647 -12.119 1.00 0.00 H new ATOM 562 N THR A 34 154.124 -1.361 -12.147 1.00 0.00 N ATOM 563 CA THR A 34 153.227 -1.389 -13.305 1.00 0.00 C ATOM 564 C THR A 34 152.352 -0.134 -13.370 1.00 0.00 C ATOM 565 O THR A 34 152.215 0.474 -14.433 1.00 0.00 O ATOM 566 CB THR A 34 152.342 -2.642 -13.276 1.00 0.00 C ATOM 567 OG1 THR A 34 153.133 -3.818 -13.246 1.00 0.00 O ATOM 568 CG2 THR A 34 151.412 -2.746 -14.469 1.00 0.00 C ATOM 0 H THR A 34 153.878 -2.018 -11.407 1.00 0.00 H new ATOM 0 HA THR A 34 153.851 -1.415 -14.198 1.00 0.00 H new ATOM 0 HB THR A 34 151.741 -2.548 -12.372 1.00 0.00 H new ATOM 0 HG1 THR A 34 153.480 -3.956 -12.340 1.00 0.00 H new ATOM 0 HG21 THR A 34 150.815 -3.654 -14.387 1.00 0.00 H new ATOM 0 HG22 THR A 34 150.752 -1.879 -14.493 1.00 0.00 H new ATOM 0 HG23 THR A 34 152.000 -2.780 -15.386 1.00 0.00 H new ATOM 576 N VAL A 35 151.753 0.242 -12.238 1.00 0.00 N ATOM 577 CA VAL A 35 150.882 1.418 -12.185 1.00 0.00 C ATOM 578 C VAL A 35 151.637 2.694 -12.562 1.00 0.00 C ATOM 579 O VAL A 35 151.172 3.472 -13.396 1.00 0.00 O ATOM 580 CB VAL A 35 150.244 1.604 -10.787 1.00 0.00 C ATOM 581 CG1 VAL A 35 149.292 2.793 -10.783 1.00 0.00 C ATOM 582 CG2 VAL A 35 149.519 0.338 -10.347 1.00 0.00 C ATOM 0 H VAL A 35 151.854 -0.248 -11.349 1.00 0.00 H new ATOM 0 HA VAL A 35 150.090 1.241 -12.912 1.00 0.00 H new ATOM 0 HB VAL A 35 151.045 1.802 -10.075 1.00 0.00 H new ATOM 0 HG11 VAL A 35 148.855 2.906 -9.791 1.00 0.00 H new ATOM 0 HG12 VAL A 35 149.840 3.699 -11.043 1.00 0.00 H new ATOM 0 HG13 VAL A 35 148.499 2.627 -11.512 1.00 0.00 H new ATOM 0 HG21 VAL A 35 149.079 0.494 -9.362 1.00 0.00 H new ATOM 0 HG22 VAL A 35 148.731 0.102 -11.063 1.00 0.00 H new ATOM 0 HG23 VAL A 35 150.227 -0.489 -10.301 1.00 0.00 H new ATOM 592 N PHE A 36 152.797 2.909 -11.938 1.00 0.00 N ATOM 593 CA PHE A 36 153.606 4.101 -12.206 1.00 0.00 C ATOM 594 C PHE A 36 154.503 3.932 -13.437 1.00 0.00 C ATOM 595 O PHE A 36 154.937 4.923 -14.027 1.00 0.00 O ATOM 596 CB PHE A 36 154.461 4.449 -10.985 1.00 0.00 C ATOM 597 CG PHE A 36 153.650 4.827 -9.776 1.00 0.00 C ATOM 598 CD1 PHE A 36 152.696 5.830 -9.849 1.00 0.00 C ATOM 599 CD2 PHE A 36 153.841 4.177 -8.569 1.00 0.00 C ATOM 600 CE1 PHE A 36 151.949 6.176 -8.740 1.00 0.00 C ATOM 601 CE2 PHE A 36 153.097 4.519 -7.457 1.00 0.00 C ATOM 602 CZ PHE A 36 152.150 5.520 -7.543 1.00 0.00 C ATOM 0 H PHE A 36 153.197 2.276 -11.246 1.00 0.00 H new ATOM 0 HA PHE A 36 152.913 4.916 -12.414 1.00 0.00 H new ATOM 0 HB2 PHE A 36 155.092 3.596 -10.738 1.00 0.00 H new ATOM 0 HB3 PHE A 36 155.126 5.274 -11.240 1.00 0.00 H new ATOM 0 HD1 PHE A 36 152.535 6.347 -10.784 1.00 0.00 H new ATOM 0 HD2 PHE A 36 154.580 3.393 -8.496 1.00 0.00 H new ATOM 0 HE1 PHE A 36 151.208 6.959 -8.810 1.00 0.00 H new ATOM 0 HE2 PHE A 36 153.256 4.004 -6.521 1.00 0.00 H new ATOM 0 HZ PHE A 36 151.567 5.789 -6.674 1.00 0.00 H new ATOM 612 N GLY A 37 154.791 2.684 -13.815 1.00 0.00 N ATOM 613 CA GLY A 37 155.646 2.434 -14.966 1.00 0.00 C ATOM 614 C GLY A 37 157.096 2.157 -14.584 1.00 0.00 C ATOM 615 O GLY A 37 157.863 1.634 -15.394 1.00 0.00 O ATOM 0 H GLY A 37 154.448 1.846 -13.346 1.00 0.00 H new ATOM 0 HA2 GLY A 37 155.255 1.583 -15.524 1.00 0.00 H new ATOM 0 HA3 GLY A 37 155.610 3.296 -15.632 1.00 0.00 H new ATOM 619 N GLN A 38 157.473 2.508 -13.350 1.00 0.00 N ATOM 620 CA GLN A 38 158.835 2.297 -12.865 1.00 0.00 C ATOM 621 C GLN A 38 158.834 1.972 -11.369 1.00 0.00 C ATOM 622 O GLN A 38 157.883 2.301 -10.659 1.00 0.00 O ATOM 623 CB GLN A 38 159.683 3.546 -13.128 1.00 0.00 C ATOM 624 CG GLN A 38 159.137 4.804 -12.466 1.00 0.00 C ATOM 625 CD GLN A 38 159.622 6.078 -13.133 1.00 0.00 C ATOM 626 OE1 GLN A 38 159.096 6.488 -14.168 1.00 0.00 O ATOM 627 NE2 GLN A 38 160.629 6.713 -12.542 1.00 0.00 N ATOM 0 H GLN A 38 156.849 2.941 -12.669 1.00 0.00 H new ATOM 0 HA GLN A 38 159.265 1.451 -13.401 1.00 0.00 H new ATOM 0 HB2 GLN A 38 160.697 3.368 -12.770 1.00 0.00 H new ATOM 0 HB3 GLN A 38 159.749 3.711 -14.204 1.00 0.00 H new ATOM 0 HG2 GLN A 38 158.048 4.778 -12.491 1.00 0.00 H new ATOM 0 HG3 GLN A 38 159.432 4.814 -11.417 1.00 0.00 H new ATOM 0 HE21 GLN A 38 161.036 6.338 -11.685 1.00 0.00 H new ATOM 0 HE22 GLN A 38 160.995 7.575 -12.945 1.00 0.00 H new ATOM 636 N PRO A 39 159.902 1.322 -10.868 1.00 0.00 N ATOM 637 CA PRO A 39 160.013 0.960 -9.450 1.00 0.00 C ATOM 638 C PRO A 39 160.289 2.172 -8.556 1.00 0.00 C ATOM 639 O PRO A 39 161.198 2.961 -8.827 1.00 0.00 O ATOM 640 CB PRO A 39 161.198 -0.009 -9.427 1.00 0.00 C ATOM 641 CG PRO A 39 162.036 0.388 -10.592 1.00 0.00 C ATOM 642 CD PRO A 39 161.083 0.890 -11.644 1.00 0.00 C ATOM 0 HA PRO A 39 159.088 0.533 -9.063 1.00 0.00 H new ATOM 0 HB2 PRO A 39 161.755 0.070 -8.494 1.00 0.00 H new ATOM 0 HB3 PRO A 39 160.865 -1.043 -9.513 1.00 0.00 H new ATOM 0 HG2 PRO A 39 162.750 1.163 -10.312 1.00 0.00 H new ATOM 0 HG3 PRO A 39 162.614 -0.459 -10.962 1.00 0.00 H new ATOM 0 HD2 PRO A 39 161.512 1.715 -12.213 1.00 0.00 H new ATOM 0 HD3 PRO A 39 160.828 0.108 -12.360 1.00 0.00 H new ATOM 650 N LEU A 40 159.494 2.315 -7.494 1.00 0.00 N ATOM 651 CA LEU A 40 159.645 3.429 -6.559 1.00 0.00 C ATOM 652 C LEU A 40 159.917 2.932 -5.141 1.00 0.00 C ATOM 653 O LEU A 40 159.493 1.838 -4.762 1.00 0.00 O ATOM 654 CB LEU A 40 158.389 4.306 -6.565 1.00 0.00 C ATOM 655 CG LEU A 40 158.207 5.177 -7.811 1.00 0.00 C ATOM 656 CD1 LEU A 40 157.343 4.464 -8.840 1.00 0.00 C ATOM 657 CD2 LEU A 40 157.595 6.518 -7.438 1.00 0.00 C ATOM 0 H LEU A 40 158.738 1.671 -7.261 1.00 0.00 H new ATOM 0 HA LEU A 40 160.500 4.020 -6.886 1.00 0.00 H new ATOM 0 HB2 LEU A 40 157.516 3.662 -6.461 1.00 0.00 H new ATOM 0 HB3 LEU A 40 158.414 4.954 -5.689 1.00 0.00 H new ATOM 0 HG LEU A 40 159.188 5.356 -8.252 1.00 0.00 H new ATOM 0 HD11 LEU A 40 157.225 5.099 -9.718 1.00 0.00 H new ATOM 0 HD12 LEU A 40 157.820 3.528 -9.130 1.00 0.00 H new ATOM 0 HD13 LEU A 40 156.364 4.254 -8.410 1.00 0.00 H new ATOM 0 HD21 LEU A 40 157.473 7.124 -8.335 1.00 0.00 H new ATOM 0 HD22 LEU A 40 156.622 6.357 -6.973 1.00 0.00 H new ATOM 0 HD23 LEU A 40 158.251 7.035 -6.737 1.00 0.00 H new ATOM 669 N ASP A 41 160.619 3.753 -4.361 1.00 0.00 N ATOM 670 CA ASP A 41 160.949 3.416 -2.979 1.00 0.00 C ATOM 671 C ASP A 41 159.828 3.849 -2.038 1.00 0.00 C ATOM 672 O ASP A 41 159.273 4.941 -2.182 1.00 0.00 O ATOM 673 CB ASP A 41 162.266 4.089 -2.571 1.00 0.00 C ATOM 674 CG ASP A 41 163.357 3.101 -2.185 1.00 0.00 C ATOM 675 OD1 ASP A 41 163.213 1.894 -2.477 1.00 0.00 O ATOM 676 OD2 ASP A 41 164.363 3.540 -1.593 1.00 0.00 O ATOM 0 H ASP A 41 160.971 4.660 -4.666 1.00 0.00 H new ATOM 0 HA ASP A 41 161.065 2.335 -2.906 1.00 0.00 H new ATOM 0 HB2 ASP A 41 162.621 4.706 -3.397 1.00 0.00 H new ATOM 0 HB3 ASP A 41 162.078 4.758 -1.731 1.00 0.00 H new ATOM 681 N LEU A 42 159.498 2.986 -1.076 1.00 0.00 N ATOM 682 CA LEU A 42 158.439 3.276 -0.110 1.00 0.00 C ATOM 683 C LEU A 42 159.025 3.788 1.206 1.00 0.00 C ATOM 684 O LEU A 42 159.612 3.024 1.975 1.00 0.00 O ATOM 685 CB LEU A 42 157.592 2.023 0.145 1.00 0.00 C ATOM 686 CG LEU A 42 157.091 1.304 -1.112 1.00 0.00 C ATOM 687 CD1 LEU A 42 157.029 -0.198 -0.877 1.00 0.00 C ATOM 688 CD2 LEU A 42 155.727 1.839 -1.528 1.00 0.00 C ATOM 0 H LEU A 42 159.949 2.081 -0.946 1.00 0.00 H new ATOM 0 HA LEU A 42 157.803 4.055 -0.530 1.00 0.00 H new ATOM 0 HB2 LEU A 42 158.181 1.321 0.735 1.00 0.00 H new ATOM 0 HB3 LEU A 42 156.730 2.304 0.751 1.00 0.00 H new ATOM 0 HG LEU A 42 157.794 1.496 -1.922 1.00 0.00 H new ATOM 0 HD11 LEU A 42 156.671 -0.693 -1.780 1.00 0.00 H new ATOM 0 HD12 LEU A 42 158.024 -0.569 -0.630 1.00 0.00 H new ATOM 0 HD13 LEU A 42 156.348 -0.410 -0.053 1.00 0.00 H new ATOM 0 HD21 LEU A 42 155.388 1.316 -2.422 1.00 0.00 H new ATOM 0 HD22 LEU A 42 155.012 1.679 -0.721 1.00 0.00 H new ATOM 0 HD23 LEU A 42 155.803 2.906 -1.739 1.00 0.00 H new ATOM 700 N HIS A 43 158.865 5.089 1.454 1.00 0.00 N ATOM 701 CA HIS A 43 159.381 5.712 2.672 1.00 0.00 C ATOM 702 C HIS A 43 158.312 5.751 3.764 1.00 0.00 C ATOM 703 O HIS A 43 157.293 6.430 3.624 1.00 0.00 O ATOM 704 CB HIS A 43 159.870 7.134 2.374 1.00 0.00 C ATOM 705 CG HIS A 43 161.172 7.187 1.632 1.00 0.00 C ATOM 706 ND1 HIS A 43 161.547 6.250 0.690 1.00 0.00 N ATOM 707 CD2 HIS A 43 162.189 8.079 1.694 1.00 0.00 C ATOM 708 CE1 HIS A 43 162.736 6.562 0.209 1.00 0.00 C ATOM 709 NE2 HIS A 43 163.147 7.667 0.801 1.00 0.00 N ATOM 0 H HIS A 43 158.382 5.731 0.826 1.00 0.00 H new ATOM 0 HA HIS A 43 160.217 5.111 3.029 1.00 0.00 H new ATOM 0 HB2 HIS A 43 159.110 7.654 1.791 1.00 0.00 H new ATOM 0 HB3 HIS A 43 159.977 7.675 3.314 1.00 0.00 H new ATOM 0 HD2 HIS A 43 162.237 8.952 2.328 1.00 0.00 H new ATOM 0 HE1 HIS A 43 163.280 6.007 -0.541 1.00 0.00 H new ATOM 0 HE2 HIS A 43 164.034 8.139 0.624 1.00 0.00 H new ATOM 718 N TYR A 44 158.556 5.021 4.851 1.00 0.00 N ATOM 719 CA TYR A 44 157.623 4.969 5.972 1.00 0.00 C ATOM 720 C TYR A 44 158.009 5.981 7.052 1.00 0.00 C ATOM 721 O TYR A 44 159.158 6.019 7.495 1.00 0.00 O ATOM 722 CB TYR A 44 157.596 3.561 6.571 1.00 0.00 C ATOM 723 CG TYR A 44 156.213 3.097 6.964 1.00 0.00 C ATOM 724 CD1 TYR A 44 155.295 2.698 6.000 1.00 0.00 C ATOM 725 CD2 TYR A 44 155.824 3.059 8.296 1.00 0.00 C ATOM 726 CE1 TYR A 44 154.028 2.275 6.354 1.00 0.00 C ATOM 727 CE2 TYR A 44 154.559 2.637 8.659 1.00 0.00 C ATOM 728 CZ TYR A 44 153.666 2.246 7.685 1.00 0.00 C ATOM 729 OH TYR A 44 152.406 1.824 8.042 1.00 0.00 O ATOM 0 H TYR A 44 159.396 4.456 4.978 1.00 0.00 H new ATOM 0 HA TYR A 44 156.631 5.222 5.598 1.00 0.00 H new ATOM 0 HB2 TYR A 44 158.014 2.860 5.848 1.00 0.00 H new ATOM 0 HB3 TYR A 44 158.242 3.536 7.449 1.00 0.00 H new ATOM 0 HD1 TYR A 44 155.576 2.719 4.957 1.00 0.00 H new ATOM 0 HD2 TYR A 44 156.522 3.364 9.062 1.00 0.00 H new ATOM 0 HE1 TYR A 44 153.325 1.969 5.593 1.00 0.00 H new ATOM 0 HE2 TYR A 44 154.272 2.614 9.700 1.00 0.00 H new ATOM 0 HH TYR A 44 151.781 2.576 7.985 1.00 0.00 H new ATOM 739 N MET A 45 157.042 6.793 7.474 1.00 0.00 N ATOM 740 CA MET A 45 157.279 7.800 8.508 1.00 0.00 C ATOM 741 C MET A 45 156.258 7.666 9.637 1.00 0.00 C ATOM 742 O MET A 45 155.051 7.755 9.406 1.00 0.00 O ATOM 743 CB MET A 45 157.228 9.213 7.910 1.00 0.00 C ATOM 744 CG MET A 45 155.976 9.499 7.093 1.00 0.00 C ATOM 745 SD MET A 45 155.967 11.162 6.397 1.00 0.00 S ATOM 746 CE MET A 45 155.625 12.144 7.858 1.00 0.00 C ATOM 0 H MET A 45 156.087 6.774 7.116 1.00 0.00 H new ATOM 0 HA MET A 45 158.274 7.634 8.920 1.00 0.00 H new ATOM 0 HB2 MET A 45 157.295 9.941 8.719 1.00 0.00 H new ATOM 0 HB3 MET A 45 158.103 9.359 7.277 1.00 0.00 H new ATOM 0 HG2 MET A 45 155.899 8.771 6.286 1.00 0.00 H new ATOM 0 HG3 MET A 45 155.097 9.369 7.724 1.00 0.00 H new ATOM 0 HE1 MET A 45 155.430 13.176 7.566 1.00 0.00 H new ATOM 0 HE2 MET A 45 154.752 11.741 8.371 1.00 0.00 H new ATOM 0 HE3 MET A 45 156.485 12.113 8.527 1.00 0.00 H new ATOM 756 N ASN A 46 156.749 7.452 10.859 1.00 0.00 N ATOM 757 CA ASN A 46 155.875 7.305 12.022 1.00 0.00 C ATOM 758 C ASN A 46 155.544 8.673 12.614 1.00 0.00 C ATOM 759 O ASN A 46 154.379 9.068 12.674 1.00 0.00 O ATOM 760 CB ASN A 46 156.536 6.417 13.085 1.00 0.00 C ATOM 761 CG ASN A 46 157.009 5.083 12.530 1.00 0.00 C ATOM 762 OD1 ASN A 46 156.483 4.589 11.531 1.00 0.00 O ATOM 763 ND2 ASN A 46 158.006 4.489 13.178 1.00 0.00 N ATOM 0 H ASN A 46 157.745 7.377 11.068 1.00 0.00 H new ATOM 0 HA ASN A 46 154.950 6.829 11.697 1.00 0.00 H new ATOM 0 HB2 ASN A 46 157.385 6.947 13.517 1.00 0.00 H new ATOM 0 HB3 ASN A 46 155.827 6.238 13.893 1.00 0.00 H new ATOM 0 HD21 ASN A 46 158.363 3.591 12.852 1.00 0.00 H new ATOM 0 HD22 ASN A 46 158.414 4.931 14.001 1.00 0.00 H new ATOM 770 N ASN A 47 156.583 9.393 13.036 1.00 0.00 N ATOM 771 CA ASN A 47 156.423 10.724 13.612 1.00 0.00 C ATOM 772 C ASN A 47 157.697 11.543 13.414 1.00 0.00 C ATOM 773 O ASN A 47 157.710 12.513 12.655 1.00 0.00 O ATOM 774 CB ASN A 47 156.077 10.631 15.104 1.00 0.00 C ATOM 775 CG ASN A 47 154.675 11.130 15.406 1.00 0.00 C ATOM 776 OD1 ASN A 47 153.700 10.669 14.813 1.00 0.00 O ATOM 777 ND2 ASN A 47 154.565 12.076 16.331 1.00 0.00 N ATOM 0 H ASN A 47 157.550 9.072 12.988 1.00 0.00 H new ATOM 0 HA ASN A 47 155.601 11.224 13.099 1.00 0.00 H new ATOM 0 HB2 ASN A 47 156.169 9.596 15.432 1.00 0.00 H new ATOM 0 HB3 ASN A 47 156.798 11.213 15.678 1.00 0.00 H new ATOM 0 HD21 ASN A 47 153.647 12.448 16.574 1.00 0.00 H new ATOM 0 HD22 ASN A 47 155.399 12.431 16.799 1.00 0.00 H new ATOM 784 N GLU A 48 158.767 11.137 14.097 1.00 0.00 N ATOM 785 CA GLU A 48 160.055 11.821 13.998 1.00 0.00 C ATOM 786 C GLU A 48 161.098 10.963 13.270 1.00 0.00 C ATOM 787 O GLU A 48 162.087 11.489 12.756 1.00 0.00 O ATOM 788 CB GLU A 48 160.568 12.179 15.395 1.00 0.00 C ATOM 789 CG GLU A 48 160.173 13.575 15.854 1.00 0.00 C ATOM 790 CD GLU A 48 161.369 14.486 16.059 1.00 0.00 C ATOM 791 OE1 GLU A 48 162.276 14.114 16.834 1.00 0.00 O ATOM 792 OE2 GLU A 48 161.397 15.574 15.446 1.00 0.00 O ATOM 0 H GLU A 48 158.766 10.335 14.727 1.00 0.00 H new ATOM 0 HA GLU A 48 159.902 12.731 13.418 1.00 0.00 H new ATOM 0 HB2 GLU A 48 160.187 11.450 16.110 1.00 0.00 H new ATOM 0 HB3 GLU A 48 161.655 12.097 15.405 1.00 0.00 H new ATOM 0 HG2 GLU A 48 159.505 14.020 15.116 1.00 0.00 H new ATOM 0 HG3 GLU A 48 159.614 13.501 16.787 1.00 0.00 H new ATOM 799 N LEU A 49 160.881 9.642 13.232 1.00 0.00 N ATOM 800 CA LEU A 49 161.814 8.730 12.576 1.00 0.00 C ATOM 801 C LEU A 49 161.270 8.252 11.231 1.00 0.00 C ATOM 802 O LEU A 49 160.077 7.967 11.098 1.00 0.00 O ATOM 803 CB LEU A 49 162.097 7.523 13.475 1.00 0.00 C ATOM 804 CG LEU A 49 163.325 7.653 14.381 1.00 0.00 C ATOM 805 CD1 LEU A 49 162.980 8.419 15.651 1.00 0.00 C ATOM 806 CD2 LEU A 49 163.880 6.276 14.719 1.00 0.00 C ATOM 0 H LEU A 49 160.069 9.186 13.648 1.00 0.00 H new ATOM 0 HA LEU A 49 162.741 9.275 12.398 1.00 0.00 H new ATOM 0 HB2 LEU A 49 161.222 7.344 14.100 1.00 0.00 H new ATOM 0 HB3 LEU A 49 162.223 6.643 12.844 1.00 0.00 H new ATOM 0 HG LEU A 49 164.091 8.214 13.845 1.00 0.00 H new ATOM 0 HD11 LEU A 49 163.867 8.499 16.280 1.00 0.00 H new ATOM 0 HD12 LEU A 49 162.629 9.417 15.390 1.00 0.00 H new ATOM 0 HD13 LEU A 49 162.197 7.889 16.194 1.00 0.00 H new ATOM 0 HD21 LEU A 49 164.752 6.384 15.363 1.00 0.00 H new ATOM 0 HD22 LEU A 49 163.117 5.693 15.235 1.00 0.00 H new ATOM 0 HD23 LEU A 49 164.168 5.764 13.801 1.00 0.00 H new ATOM 818 N SER A 50 162.160 8.156 10.242 1.00 0.00 N ATOM 819 CA SER A 50 161.783 7.700 8.907 1.00 0.00 C ATOM 820 C SER A 50 162.445 6.362 8.583 1.00 0.00 C ATOM 821 O SER A 50 163.672 6.244 8.609 1.00 0.00 O ATOM 822 CB SER A 50 162.167 8.744 7.853 1.00 0.00 C ATOM 823 OG SER A 50 161.084 9.004 6.975 1.00 0.00 O ATOM 0 H SER A 50 163.148 8.389 10.343 1.00 0.00 H new ATOM 0 HA SER A 50 160.702 7.565 8.891 1.00 0.00 H new ATOM 0 HB2 SER A 50 162.470 9.668 8.345 1.00 0.00 H new ATOM 0 HB3 SER A 50 163.026 8.390 7.282 1.00 0.00 H new ATOM 0 HG SER A 50 161.353 9.674 6.313 1.00 0.00 H new ATOM 829 N ILE A 51 161.622 5.361 8.275 1.00 0.00 N ATOM 830 CA ILE A 51 162.112 4.025 7.942 1.00 0.00 C ATOM 831 C ILE A 51 161.810 3.683 6.481 1.00 0.00 C ATOM 832 O ILE A 51 160.688 3.872 6.010 1.00 0.00 O ATOM 833 CB ILE A 51 161.480 2.947 8.852 1.00 0.00 C ATOM 834 CG1 ILE A 51 161.582 3.354 10.328 1.00 0.00 C ATOM 835 CG2 ILE A 51 162.145 1.596 8.623 1.00 0.00 C ATOM 836 CD1 ILE A 51 160.604 2.625 11.224 1.00 0.00 C ATOM 0 H ILE A 51 160.606 5.451 8.249 1.00 0.00 H new ATOM 0 HA ILE A 51 163.190 4.033 8.100 1.00 0.00 H new ATOM 0 HB ILE A 51 160.425 2.860 8.594 1.00 0.00 H new ATOM 0 HG12 ILE A 51 162.596 3.164 10.680 1.00 0.00 H new ATOM 0 HG13 ILE A 51 161.411 4.427 10.414 1.00 0.00 H new ATOM 0 HG21 ILE A 51 161.687 0.850 9.272 1.00 0.00 H new ATOM 0 HG22 ILE A 51 162.017 1.299 7.582 1.00 0.00 H new ATOM 0 HG23 ILE A 51 163.208 1.671 8.850 1.00 0.00 H new ATOM 0 HD11 ILE A 51 160.732 2.962 12.253 1.00 0.00 H new ATOM 0 HD12 ILE A 51 159.585 2.835 10.898 1.00 0.00 H new ATOM 0 HD13 ILE A 51 160.789 1.552 11.168 1.00 0.00 H new ATOM 848 N LEU A 52 162.815 3.174 5.771 1.00 0.00 N ATOM 849 CA LEU A 52 162.655 2.802 4.365 1.00 0.00 C ATOM 850 C LEU A 52 162.285 1.323 4.234 1.00 0.00 C ATOM 851 O LEU A 52 162.881 0.467 4.890 1.00 0.00 O ATOM 852 CB LEU A 52 163.943 3.104 3.588 1.00 0.00 C ATOM 853 CG LEU A 52 163.909 2.769 2.091 1.00 0.00 C ATOM 854 CD1 LEU A 52 162.710 3.418 1.415 1.00 0.00 C ATOM 855 CD2 LEU A 52 165.200 3.210 1.416 1.00 0.00 C ATOM 0 H LEU A 52 163.749 3.009 6.146 1.00 0.00 H new ATOM 0 HA LEU A 52 161.843 3.394 3.942 1.00 0.00 H new ATOM 0 HB2 LEU A 52 164.173 4.164 3.700 1.00 0.00 H new ATOM 0 HB3 LEU A 52 164.761 2.550 4.047 1.00 0.00 H new ATOM 0 HG LEU A 52 163.814 1.688 1.989 1.00 0.00 H new ATOM 0 HD11 LEU A 52 162.709 3.165 0.355 1.00 0.00 H new ATOM 0 HD12 LEU A 52 161.792 3.054 1.876 1.00 0.00 H new ATOM 0 HD13 LEU A 52 162.769 4.500 1.530 1.00 0.00 H new ATOM 0 HD21 LEU A 52 165.158 2.964 0.355 1.00 0.00 H new ATOM 0 HD22 LEU A 52 165.323 4.286 1.535 1.00 0.00 H new ATOM 0 HD23 LEU A 52 166.044 2.695 1.874 1.00 0.00 H new ATOM 867 N LEU A 53 161.298 1.034 3.384 1.00 0.00 N ATOM 868 CA LEU A 53 160.843 -0.340 3.163 1.00 0.00 C ATOM 869 C LEU A 53 161.666 -1.020 2.071 1.00 0.00 C ATOM 870 O LEU A 53 161.523 -0.707 0.887 1.00 0.00 O ATOM 871 CB LEU A 53 159.360 -0.357 2.776 1.00 0.00 C ATOM 872 CG LEU A 53 158.386 0.051 3.886 1.00 0.00 C ATOM 873 CD1 LEU A 53 156.946 -0.085 3.410 1.00 0.00 C ATOM 874 CD2 LEU A 53 158.616 -0.788 5.136 1.00 0.00 C ATOM 0 H LEU A 53 160.798 1.734 2.837 1.00 0.00 H new ATOM 0 HA LEU A 53 160.977 -0.890 4.094 1.00 0.00 H new ATOM 0 HB2 LEU A 53 159.216 0.310 1.926 1.00 0.00 H new ATOM 0 HB3 LEU A 53 159.101 -1.361 2.440 1.00 0.00 H new ATOM 0 HG LEU A 53 158.569 1.096 4.135 1.00 0.00 H new ATOM 0 HD11 LEU A 53 156.268 0.209 4.212 1.00 0.00 H new ATOM 0 HD12 LEU A 53 156.786 0.559 2.545 1.00 0.00 H new ATOM 0 HD13 LEU A 53 156.751 -1.121 3.132 1.00 0.00 H new ATOM 0 HD21 LEU A 53 157.915 -0.483 5.913 1.00 0.00 H new ATOM 0 HD22 LEU A 53 158.462 -1.841 4.901 1.00 0.00 H new ATOM 0 HD23 LEU A 53 159.636 -0.641 5.490 1.00 0.00 H new ATOM 886 N LYS A 54 162.524 -1.952 2.477 1.00 0.00 N ATOM 887 CA LYS A 54 163.371 -2.680 1.536 1.00 0.00 C ATOM 888 C LYS A 54 162.915 -4.134 1.387 1.00 0.00 C ATOM 889 O LYS A 54 162.999 -4.708 0.299 1.00 0.00 O ATOM 890 CB LYS A 54 164.833 -2.633 1.993 1.00 0.00 C ATOM 891 CG LYS A 54 165.785 -2.049 0.954 1.00 0.00 C ATOM 892 CD LYS A 54 166.793 -1.097 1.585 1.00 0.00 C ATOM 893 CE LYS A 54 168.208 -1.355 1.081 1.00 0.00 C ATOM 894 NZ LYS A 54 168.975 -0.090 0.892 1.00 0.00 N ATOM 0 H LYS A 54 162.651 -2.221 3.453 1.00 0.00 H new ATOM 0 HA LYS A 54 163.283 -2.196 0.563 1.00 0.00 H new ATOM 0 HB2 LYS A 54 164.900 -2.041 2.906 1.00 0.00 H new ATOM 0 HB3 LYS A 54 165.158 -3.643 2.243 1.00 0.00 H new ATOM 0 HG2 LYS A 54 166.314 -2.858 0.450 1.00 0.00 H new ATOM 0 HG3 LYS A 54 165.212 -1.520 0.192 1.00 0.00 H new ATOM 0 HD2 LYS A 54 166.510 -0.068 1.362 1.00 0.00 H new ATOM 0 HD3 LYS A 54 166.768 -1.207 2.669 1.00 0.00 H new ATOM 0 HE2 LYS A 54 168.734 -1.995 1.790 1.00 0.00 H new ATOM 0 HE3 LYS A 54 168.163 -1.896 0.136 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 169.931 -0.312 0.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 168.488 0.511 0.197 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 169.041 0.415 1.799 1.00 0.00 H new ATOM 908 N ASN A 55 162.443 -4.726 2.486 1.00 0.00 N ATOM 909 CA ASN A 55 161.984 -6.116 2.479 1.00 0.00 C ATOM 910 C ASN A 55 160.678 -6.277 3.263 1.00 0.00 C ATOM 911 O ASN A 55 160.145 -5.307 3.805 1.00 0.00 O ATOM 912 CB ASN A 55 163.068 -7.027 3.069 1.00 0.00 C ATOM 913 CG ASN A 55 163.608 -6.507 4.391 1.00 0.00 C ATOM 914 OD1 ASN A 55 162.850 -6.246 5.324 1.00 0.00 O ATOM 915 ND2 ASN A 55 164.926 -6.346 4.477 1.00 0.00 N ATOM 0 H ASN A 55 162.369 -4.264 3.392 1.00 0.00 H new ATOM 0 HA ASN A 55 161.792 -6.403 1.445 1.00 0.00 H new ATOM 0 HB2 ASN A 55 162.658 -8.026 3.215 1.00 0.00 H new ATOM 0 HB3 ASN A 55 163.888 -7.120 2.357 1.00 0.00 H new ATOM 0 HD21 ASN A 55 165.342 -5.995 5.340 1.00 0.00 H new ATOM 0 HD22 ASN A 55 165.521 -6.574 3.680 1.00 0.00 H new ATOM 922 N GLN A 56 160.170 -7.514 3.319 1.00 0.00 N ATOM 923 CA GLN A 56 158.929 -7.807 4.038 1.00 0.00 C ATOM 924 C GLN A 56 159.087 -7.550 5.538 1.00 0.00 C ATOM 925 O GLN A 56 158.142 -7.124 6.197 1.00 0.00 O ATOM 926 CB GLN A 56 158.496 -9.259 3.802 1.00 0.00 C ATOM 927 CG GLN A 56 157.156 -9.611 4.438 1.00 0.00 C ATOM 928 CD GLN A 56 156.004 -9.586 3.449 1.00 0.00 C ATOM 929 OE1 GLN A 56 156.130 -9.064 2.340 1.00 0.00 O ATOM 930 NE2 GLN A 56 154.869 -10.152 3.846 1.00 0.00 N ATOM 0 H GLN A 56 160.600 -8.325 2.875 1.00 0.00 H new ATOM 0 HA GLN A 56 158.158 -7.140 3.652 1.00 0.00 H new ATOM 0 HB2 GLN A 56 158.438 -9.441 2.729 1.00 0.00 H new ATOM 0 HB3 GLN A 56 159.262 -9.926 4.198 1.00 0.00 H new ATOM 0 HG2 GLN A 56 157.222 -10.603 4.885 1.00 0.00 H new ATOM 0 HG3 GLN A 56 156.949 -8.910 5.246 1.00 0.00 H new ATOM 0 HE21 GLN A 56 154.806 -10.573 4.773 1.00 0.00 H new ATOM 0 HE22 GLN A 56 154.061 -10.165 3.224 1.00 0.00 H new ATOM 939 N ASP A 57 160.283 -7.809 6.070 1.00 0.00 N ATOM 940 CA ASP A 57 160.550 -7.600 7.495 1.00 0.00 C ATOM 941 C ASP A 57 160.243 -6.157 7.913 1.00 0.00 C ATOM 942 O ASP A 57 159.697 -5.922 8.993 1.00 0.00 O ATOM 943 CB ASP A 57 162.010 -7.935 7.821 1.00 0.00 C ATOM 944 CG ASP A 57 162.206 -9.386 8.221 1.00 0.00 C ATOM 945 OD1 ASP A 57 161.728 -10.277 7.487 1.00 0.00 O ATOM 946 OD2 ASP A 57 162.844 -9.631 9.267 1.00 0.00 O ATOM 0 H ASP A 57 161.079 -8.162 5.539 1.00 0.00 H new ATOM 0 HA ASP A 57 159.895 -8.267 8.056 1.00 0.00 H new ATOM 0 HB2 ASP A 57 162.631 -7.715 6.952 1.00 0.00 H new ATOM 0 HB3 ASP A 57 162.354 -7.290 8.630 1.00 0.00 H new ATOM 951 N ASP A 58 160.603 -5.198 7.054 1.00 0.00 N ATOM 952 CA ASP A 58 160.373 -3.778 7.334 1.00 0.00 C ATOM 953 C ASP A 58 158.880 -3.450 7.367 1.00 0.00 C ATOM 954 O ASP A 58 158.399 -2.824 8.312 1.00 0.00 O ATOM 955 CB ASP A 58 161.074 -2.904 6.283 1.00 0.00 C ATOM 956 CG ASP A 58 162.593 -3.002 6.328 1.00 0.00 C ATOM 957 OD1 ASP A 58 163.128 -3.706 7.212 1.00 0.00 O ATOM 958 OD2 ASP A 58 163.248 -2.369 5.473 1.00 0.00 O ATOM 0 H ASP A 58 161.055 -5.380 6.158 1.00 0.00 H new ATOM 0 HA ASP A 58 160.791 -3.564 8.318 1.00 0.00 H new ATOM 0 HB2 ASP A 58 160.728 -3.195 5.291 1.00 0.00 H new ATOM 0 HB3 ASP A 58 160.780 -1.865 6.431 1.00 0.00 H new ATOM 963 N LEU A 59 158.150 -3.875 6.333 1.00 0.00 N ATOM 964 CA LEU A 59 156.710 -3.619 6.261 1.00 0.00 C ATOM 965 C LEU A 59 155.955 -4.440 7.308 1.00 0.00 C ATOM 966 O LEU A 59 154.951 -3.980 7.852 1.00 0.00 O ATOM 967 CB LEU A 59 156.158 -3.922 4.862 1.00 0.00 C ATOM 968 CG LEU A 59 156.419 -5.338 4.341 1.00 0.00 C ATOM 969 CD1 LEU A 59 155.298 -6.289 4.741 1.00 0.00 C ATOM 970 CD2 LEU A 59 156.589 -5.318 2.833 1.00 0.00 C ATOM 0 H LEU A 59 158.528 -4.394 5.540 1.00 0.00 H new ATOM 0 HA LEU A 59 156.558 -2.560 6.469 1.00 0.00 H new ATOM 0 HB2 LEU A 59 155.082 -3.750 4.870 1.00 0.00 H new ATOM 0 HB3 LEU A 59 156.589 -3.210 4.159 1.00 0.00 H new ATOM 0 HG LEU A 59 157.341 -5.702 4.795 1.00 0.00 H new ATOM 0 HD11 LEU A 59 155.512 -7.286 4.356 1.00 0.00 H new ATOM 0 HD12 LEU A 59 155.224 -6.327 5.828 1.00 0.00 H new ATOM 0 HD13 LEU A 59 154.355 -5.935 4.325 1.00 0.00 H new ATOM 0 HD21 LEU A 59 156.774 -6.330 2.474 1.00 0.00 H new ATOM 0 HD22 LEU A 59 155.682 -4.929 2.370 1.00 0.00 H new ATOM 0 HD23 LEU A 59 157.433 -4.680 2.570 1.00 0.00 H new ATOM 982 N ASP A 60 156.446 -5.654 7.584 1.00 0.00 N ATOM 983 CA ASP A 60 155.817 -6.536 8.568 1.00 0.00 C ATOM 984 C ASP A 60 155.823 -5.889 9.952 1.00 0.00 C ATOM 985 O ASP A 60 154.818 -5.918 10.664 1.00 0.00 O ATOM 986 CB ASP A 60 156.546 -7.889 8.618 1.00 0.00 C ATOM 987 CG ASP A 60 155.728 -8.994 9.273 1.00 0.00 C ATOM 988 OD1 ASP A 60 154.792 -8.681 10.038 1.00 0.00 O ATOM 989 OD2 ASP A 60 156.028 -10.179 9.019 1.00 0.00 O ATOM 0 H ASP A 60 157.276 -6.046 7.139 1.00 0.00 H new ATOM 0 HA ASP A 60 154.783 -6.703 8.265 1.00 0.00 H new ATOM 0 HB2 ASP A 60 156.804 -8.192 7.603 1.00 0.00 H new ATOM 0 HB3 ASP A 60 157.482 -7.769 9.163 1.00 0.00 H new ATOM 994 N LYS A 61 156.956 -5.291 10.322 1.00 0.00 N ATOM 995 CA LYS A 61 157.081 -4.624 11.617 1.00 0.00 C ATOM 996 C LYS A 61 156.245 -3.343 11.659 1.00 0.00 C ATOM 997 O LYS A 61 155.717 -2.974 12.708 1.00 0.00 O ATOM 998 CB LYS A 61 158.548 -4.311 11.919 1.00 0.00 C ATOM 999 CG LYS A 61 159.243 -5.404 12.711 1.00 0.00 C ATOM 1000 CD LYS A 61 160.752 -5.336 12.546 1.00 0.00 C ATOM 1001 CE LYS A 61 161.454 -5.155 13.883 1.00 0.00 C ATOM 1002 NZ LYS A 61 162.631 -4.249 13.775 1.00 0.00 N ATOM 0 H LYS A 61 157.797 -5.255 9.746 1.00 0.00 H new ATOM 0 HA LYS A 61 156.703 -5.302 12.382 1.00 0.00 H new ATOM 0 HB2 LYS A 61 159.080 -4.157 10.980 1.00 0.00 H new ATOM 0 HB3 LYS A 61 158.606 -3.376 12.475 1.00 0.00 H new ATOM 0 HG2 LYS A 61 158.986 -5.310 13.766 1.00 0.00 H new ATOM 0 HG3 LYS A 61 158.883 -6.379 12.381 1.00 0.00 H new ATOM 0 HD2 LYS A 61 161.108 -6.249 12.068 1.00 0.00 H new ATOM 0 HD3 LYS A 61 161.009 -4.509 11.884 1.00 0.00 H new ATOM 0 HE2 LYS A 61 160.750 -4.751 14.611 1.00 0.00 H new ATOM 0 HE3 LYS A 61 161.777 -6.126 14.258 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 163.081 -4.152 14.707 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 163.315 -4.647 13.100 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 162.320 -3.314 13.442 1.00 0.00 H new ATOM 1016 N ALA A 62 156.121 -2.675 10.510 1.00 0.00 N ATOM 1017 CA ALA A 62 155.342 -1.442 10.413 1.00 0.00 C ATOM 1018 C ALA A 62 153.862 -1.695 10.704 1.00 0.00 C ATOM 1019 O ALA A 62 153.206 -0.884 11.359 1.00 0.00 O ATOM 1020 CB ALA A 62 155.512 -0.819 9.036 1.00 0.00 C ATOM 0 H ALA A 62 156.551 -2.969 9.633 1.00 0.00 H new ATOM 0 HA ALA A 62 155.716 -0.747 11.165 1.00 0.00 H new ATOM 0 HB1 ALA A 62 154.927 0.099 8.977 1.00 0.00 H new ATOM 0 HB2 ALA A 62 156.564 -0.590 8.868 1.00 0.00 H new ATOM 0 HB3 ALA A 62 155.167 -1.519 8.275 1.00 0.00 H new ATOM 1026 N ILE A 63 153.343 -2.825 10.217 1.00 0.00 N ATOM 1027 CA ILE A 63 151.940 -3.184 10.433 1.00 0.00 C ATOM 1028 C ILE A 63 151.643 -3.332 11.924 1.00 0.00 C ATOM 1029 O ILE A 63 150.653 -2.795 12.424 1.00 0.00 O ATOM 1030 CB ILE A 63 151.561 -4.502 9.718 1.00 0.00 C ATOM 1031 CG1 ILE A 63 151.935 -4.443 8.232 1.00 0.00 C ATOM 1032 CG2 ILE A 63 150.073 -4.783 9.882 1.00 0.00 C ATOM 1033 CD1 ILE A 63 152.485 -5.747 7.692 1.00 0.00 C ATOM 0 H ILE A 63 153.872 -3.505 9.672 1.00 0.00 H new ATOM 0 HA ILE A 63 151.344 -2.375 10.012 1.00 0.00 H new ATOM 0 HB ILE A 63 152.123 -5.315 10.178 1.00 0.00 H new ATOM 0 HG12 ILE A 63 151.053 -4.164 7.655 1.00 0.00 H new ATOM 0 HG13 ILE A 63 152.675 -3.657 8.083 1.00 0.00 H new ATOM 0 HG21 ILE A 63 149.820 -5.714 9.374 1.00 0.00 H new ATOM 0 HG22 ILE A 63 149.834 -4.872 10.942 1.00 0.00 H new ATOM 0 HG23 ILE A 63 149.498 -3.965 9.448 1.00 0.00 H new ATOM 0 HD11 ILE A 63 152.727 -5.630 6.636 1.00 0.00 H new ATOM 0 HD12 ILE A 63 153.386 -6.018 8.243 1.00 0.00 H new ATOM 0 HD13 ILE A 63 151.738 -6.533 7.808 1.00 0.00 H new ATOM 1045 N ASP A 64 152.513 -4.061 12.627 1.00 0.00 N ATOM 1046 CA ASP A 64 152.354 -4.281 14.064 1.00 0.00 C ATOM 1047 C ASP A 64 152.195 -2.956 14.811 1.00 0.00 C ATOM 1048 O ASP A 64 151.424 -2.863 15.768 1.00 0.00 O ATOM 1049 CB ASP A 64 153.555 -5.051 14.620 1.00 0.00 C ATOM 1050 CG ASP A 64 153.214 -5.821 15.881 1.00 0.00 C ATOM 1051 OD1 ASP A 64 152.505 -6.845 15.778 1.00 0.00 O ATOM 1052 OD2 ASP A 64 153.655 -5.401 16.971 1.00 0.00 O ATOM 0 H ASP A 64 153.335 -4.509 12.223 1.00 0.00 H new ATOM 0 HA ASP A 64 151.449 -4.870 14.214 1.00 0.00 H new ATOM 0 HB2 ASP A 64 153.921 -5.744 13.862 1.00 0.00 H new ATOM 0 HB3 ASP A 64 154.365 -4.353 14.832 1.00 0.00 H new ATOM 1057 N ILE A 65 152.925 -1.933 14.363 1.00 0.00 N ATOM 1058 CA ILE A 65 152.860 -0.612 14.984 1.00 0.00 C ATOM 1059 C ILE A 65 151.472 0.009 14.812 1.00 0.00 C ATOM 1060 O ILE A 65 150.961 0.662 15.723 1.00 0.00 O ATOM 1061 CB ILE A 65 153.921 0.351 14.398 1.00 0.00 C ATOM 1062 CG1 ILE A 65 155.315 -0.289 14.430 1.00 0.00 C ATOM 1063 CG2 ILE A 65 153.923 1.666 15.165 1.00 0.00 C ATOM 1064 CD1 ILE A 65 156.266 0.281 13.399 1.00 0.00 C ATOM 0 H ILE A 65 153.567 -1.995 13.573 1.00 0.00 H new ATOM 0 HA ILE A 65 153.065 -0.755 16.045 1.00 0.00 H new ATOM 0 HB ILE A 65 153.663 0.553 13.358 1.00 0.00 H new ATOM 0 HG12 ILE A 65 155.745 -0.155 15.423 1.00 0.00 H new ATOM 0 HG13 ILE A 65 155.217 -1.362 14.268 1.00 0.00 H new ATOM 0 HG21 ILE A 65 154.674 2.333 14.742 1.00 0.00 H new ATOM 0 HG22 ILE A 65 152.940 2.132 15.091 1.00 0.00 H new ATOM 0 HG23 ILE A 65 154.156 1.476 16.213 1.00 0.00 H new ATOM 0 HD11 ILE A 65 157.232 -0.218 13.480 1.00 0.00 H new ATOM 0 HD12 ILE A 65 155.858 0.123 12.401 1.00 0.00 H new ATOM 0 HD13 ILE A 65 156.394 1.349 13.573 1.00 0.00 H new ATOM 1076 N LEU A 66 150.868 -0.200 13.641 1.00 0.00 N ATOM 1077 CA LEU A 66 149.540 0.340 13.355 1.00 0.00 C ATOM 1078 C LEU A 66 148.481 -0.314 14.241 1.00 0.00 C ATOM 1079 O LEU A 66 147.646 0.373 14.830 1.00 0.00 O ATOM 1080 CB LEU A 66 149.177 0.135 11.879 1.00 0.00 C ATOM 1081 CG LEU A 66 150.248 0.561 10.871 1.00 0.00 C ATOM 1082 CD1 LEU A 66 149.964 -0.048 9.507 1.00 0.00 C ATOM 1083 CD2 LEU A 66 150.320 2.080 10.781 1.00 0.00 C ATOM 0 H LEU A 66 151.277 -0.738 12.877 1.00 0.00 H new ATOM 0 HA LEU A 66 149.565 1.408 13.569 1.00 0.00 H new ATOM 0 HB2 LEU A 66 148.954 -0.920 11.721 1.00 0.00 H new ATOM 0 HB3 LEU A 66 148.263 0.690 11.667 1.00 0.00 H new ATOM 0 HG LEU A 66 151.215 0.194 11.214 1.00 0.00 H new ATOM 0 HD11 LEU A 66 150.734 0.264 8.802 1.00 0.00 H new ATOM 0 HD12 LEU A 66 149.964 -1.135 9.587 1.00 0.00 H new ATOM 0 HD13 LEU A 66 148.990 0.290 9.153 1.00 0.00 H new ATOM 0 HD21 LEU A 66 151.086 2.366 10.060 1.00 0.00 H new ATOM 0 HD22 LEU A 66 149.355 2.472 10.459 1.00 0.00 H new ATOM 0 HD23 LEU A 66 150.571 2.491 11.759 1.00 0.00 H new ATOM 1095 N ASP A 67 148.525 -1.646 14.333 1.00 0.00 N ATOM 1096 CA ASP A 67 147.570 -2.398 15.151 1.00 0.00 C ATOM 1097 C ASP A 67 147.670 -2.000 16.624 1.00 0.00 C ATOM 1098 O ASP A 67 146.658 -1.910 17.319 1.00 0.00 O ATOM 1099 CB ASP A 67 147.806 -3.904 15.001 1.00 0.00 C ATOM 1100 CG ASP A 67 147.313 -4.440 13.670 1.00 0.00 C ATOM 1101 OD1 ASP A 67 147.977 -4.185 12.643 1.00 0.00 O ATOM 1102 OD2 ASP A 67 146.263 -5.114 13.655 1.00 0.00 O ATOM 0 H ASP A 67 149.212 -2.226 13.851 1.00 0.00 H new ATOM 0 HA ASP A 67 146.567 -2.157 14.798 1.00 0.00 H new ATOM 0 HB2 ASP A 67 148.871 -4.113 15.101 1.00 0.00 H new ATOM 0 HB3 ASP A 67 147.300 -4.430 15.811 1.00 0.00 H new ATOM 1107 N ARG A 68 148.897 -1.760 17.090 1.00 0.00 N ATOM 1108 CA ARG A 68 149.135 -1.366 18.480 1.00 0.00 C ATOM 1109 C ARG A 68 148.575 0.032 18.771 1.00 0.00 C ATOM 1110 O ARG A 68 148.205 0.331 19.906 1.00 0.00 O ATOM 1111 CB ARG A 68 150.635 -1.395 18.784 1.00 0.00 C ATOM 1112 CG ARG A 68 150.958 -1.636 20.251 1.00 0.00 C ATOM 1113 CD ARG A 68 151.261 -0.335 20.980 1.00 0.00 C ATOM 1114 NE ARG A 68 152.615 -0.319 21.534 1.00 0.00 N ATOM 1115 CZ ARG A 68 152.975 -0.950 22.656 1.00 0.00 C ATOM 1116 NH1 ARG A 68 152.084 -1.656 23.351 1.00 0.00 N ATOM 1117 NH2 ARG A 68 154.232 -0.878 23.084 1.00 0.00 N ATOM 0 H ARG A 68 149.743 -1.832 16.524 1.00 0.00 H new ATOM 0 HA ARG A 68 148.618 -2.079 19.122 1.00 0.00 H new ATOM 0 HB2 ARG A 68 151.103 -2.176 18.185 1.00 0.00 H new ATOM 0 HB3 ARG A 68 151.078 -0.448 18.475 1.00 0.00 H new ATOM 0 HG2 ARG A 68 150.117 -2.136 20.732 1.00 0.00 H new ATOM 0 HG3 ARG A 68 151.814 -2.306 20.330 1.00 0.00 H new ATOM 0 HD2 ARG A 68 151.141 0.502 20.292 1.00 0.00 H new ATOM 0 HD3 ARG A 68 150.539 -0.193 21.784 1.00 0.00 H new ATOM 0 HE ARG A 68 153.330 0.207 21.032 1.00 0.00 H new ATOM 0 HH11 ARG A 68 151.119 -1.718 23.028 1.00 0.00 H new ATOM 0 HH12 ARG A 68 152.367 -2.134 24.206 1.00 0.00 H new ATOM 0 HH21 ARG A 68 154.921 -0.342 22.556 1.00 0.00 H new ATOM 0 HH22 ARG A 68 154.508 -1.359 23.940 1.00 0.00 H new ATOM 1131 N SER A 69 148.526 0.883 17.741 1.00 0.00 N ATOM 1132 CA SER A 69 148.020 2.248 17.888 1.00 0.00 C ATOM 1133 C SER A 69 146.549 2.259 18.307 1.00 0.00 C ATOM 1134 O SER A 69 145.859 1.240 18.227 1.00 0.00 O ATOM 1135 CB SER A 69 148.201 3.022 16.577 1.00 0.00 C ATOM 1136 OG SER A 69 147.050 2.918 15.753 1.00 0.00 O ATOM 0 H SER A 69 148.831 0.649 16.796 1.00 0.00 H new ATOM 0 HA SER A 69 148.595 2.734 18.676 1.00 0.00 H new ATOM 0 HB2 SER A 69 148.400 4.071 16.796 1.00 0.00 H new ATOM 0 HB3 SER A 69 149.070 2.638 16.042 1.00 0.00 H new ATOM 0 HG SER A 69 147.120 2.117 15.193 1.00 0.00 H new ATOM 1142 N SER A 70 146.076 3.424 18.749 1.00 0.00 N ATOM 1143 CA SER A 70 144.688 3.578 19.179 1.00 0.00 C ATOM 1144 C SER A 70 143.759 3.792 17.983 1.00 0.00 C ATOM 1145 O SER A 70 142.669 3.218 17.926 1.00 0.00 O ATOM 1146 CB SER A 70 144.555 4.754 20.152 1.00 0.00 C ATOM 1147 OG SER A 70 143.641 4.454 21.194 1.00 0.00 O ATOM 0 H SER A 70 146.634 4.275 18.818 1.00 0.00 H new ATOM 0 HA SER A 70 144.395 2.658 19.685 1.00 0.00 H new ATOM 0 HB2 SER A 70 145.531 4.991 20.577 1.00 0.00 H new ATOM 0 HB3 SER A 70 144.219 5.640 19.613 1.00 0.00 H new ATOM 0 HG SER A 70 143.575 5.220 21.802 1.00 0.00 H new ATOM 1153 N SER A 71 144.187 4.632 17.037 1.00 0.00 N ATOM 1154 CA SER A 71 143.377 4.930 15.852 1.00 0.00 C ATOM 1155 C SER A 71 144.149 4.724 14.544 1.00 0.00 C ATOM 1156 O SER A 71 143.562 4.317 13.541 1.00 0.00 O ATOM 1157 CB SER A 71 142.856 6.368 15.919 1.00 0.00 C ATOM 1158 OG SER A 71 143.920 7.292 16.074 1.00 0.00 O ATOM 0 H SER A 71 145.085 5.116 17.067 1.00 0.00 H new ATOM 0 HA SER A 71 142.543 4.229 15.853 1.00 0.00 H new ATOM 0 HB2 SER A 71 142.300 6.599 15.010 1.00 0.00 H new ATOM 0 HB3 SER A 71 142.160 6.467 16.752 1.00 0.00 H new ATOM 0 HG SER A 71 143.560 8.203 16.112 1.00 0.00 H new ATOM 1164 N MET A 72 145.452 5.024 14.553 1.00 0.00 N ATOM 1165 CA MET A 72 146.295 4.887 13.361 1.00 0.00 C ATOM 1166 C MET A 72 146.145 3.506 12.708 1.00 0.00 C ATOM 1167 O MET A 72 146.859 2.563 13.055 1.00 0.00 O ATOM 1168 CB MET A 72 147.769 5.137 13.716 1.00 0.00 C ATOM 1169 CG MET A 72 148.250 6.539 13.376 1.00 0.00 C ATOM 1170 SD MET A 72 150.049 6.676 13.356 1.00 0.00 S ATOM 1171 CE MET A 72 150.317 7.412 11.745 1.00 0.00 C ATOM 0 H MET A 72 145.947 5.365 15.377 1.00 0.00 H new ATOM 0 HA MET A 72 145.962 5.635 12.642 1.00 0.00 H new ATOM 0 HB2 MET A 72 147.911 4.962 14.782 1.00 0.00 H new ATOM 0 HB3 MET A 72 148.389 4.412 13.189 1.00 0.00 H new ATOM 0 HG2 MET A 72 147.858 6.826 12.400 1.00 0.00 H new ATOM 0 HG3 MET A 72 147.845 7.243 14.102 1.00 0.00 H new ATOM 0 HE1 MET A 72 151.385 7.559 11.585 1.00 0.00 H new ATOM 0 HE2 MET A 72 149.922 6.751 10.973 1.00 0.00 H new ATOM 0 HE3 MET A 72 149.807 8.374 11.695 1.00 0.00 H new ATOM 1181 N LYS A 73 145.214 3.400 11.755 1.00 0.00 N ATOM 1182 CA LYS A 73 144.971 2.143 11.045 1.00 0.00 C ATOM 1183 C LYS A 73 145.510 2.204 9.611 1.00 0.00 C ATOM 1184 O LYS A 73 145.947 1.190 9.065 1.00 0.00 O ATOM 1185 CB LYS A 73 143.474 1.809 11.028 1.00 0.00 C ATOM 1186 CG LYS A 73 143.051 0.821 12.107 1.00 0.00 C ATOM 1187 CD LYS A 73 143.676 -0.552 11.891 1.00 0.00 C ATOM 1188 CE LYS A 73 142.680 -1.673 12.163 1.00 0.00 C ATOM 1189 NZ LYS A 73 141.989 -2.128 10.922 1.00 0.00 N ATOM 0 H LYS A 73 144.616 4.171 11.458 1.00 0.00 H new ATOM 0 HA LYS A 73 145.502 1.355 11.579 1.00 0.00 H new ATOM 0 HB2 LYS A 73 142.905 2.730 11.149 1.00 0.00 H new ATOM 0 HB3 LYS A 73 143.214 1.400 10.052 1.00 0.00 H new ATOM 0 HG2 LYS A 73 143.342 1.204 13.085 1.00 0.00 H new ATOM 0 HG3 LYS A 73 141.965 0.730 12.111 1.00 0.00 H new ATOM 0 HD2 LYS A 73 144.040 -0.629 10.867 1.00 0.00 H new ATOM 0 HD3 LYS A 73 144.540 -0.666 12.546 1.00 0.00 H new ATOM 0 HE2 LYS A 73 143.200 -2.516 12.617 1.00 0.00 H new ATOM 0 HE3 LYS A 73 141.938 -1.330 12.885 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 141.322 -2.891 11.156 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 141.470 -1.331 10.501 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 142.693 -2.480 10.242 1.00 0.00 H new ATOM 1203 N SER A 74 145.476 3.395 9.003 1.00 0.00 N ATOM 1204 CA SER A 74 145.965 3.571 7.635 1.00 0.00 C ATOM 1205 C SER A 74 147.488 3.418 7.570 1.00 0.00 C ATOM 1206 O SER A 74 148.138 3.171 8.587 1.00 0.00 O ATOM 1207 CB SER A 74 145.546 4.940 7.088 1.00 0.00 C ATOM 1208 OG SER A 74 146.265 5.993 7.712 1.00 0.00 O ATOM 0 H SER A 74 145.117 4.246 9.436 1.00 0.00 H new ATOM 0 HA SER A 74 145.518 2.793 7.016 1.00 0.00 H new ATOM 0 HB2 SER A 74 145.716 4.970 6.012 1.00 0.00 H new ATOM 0 HB3 SER A 74 144.477 5.084 7.246 1.00 0.00 H new ATOM 0 HG SER A 74 145.976 6.852 7.340 1.00 0.00 H new ATOM 1214 N LEU A 75 148.054 3.561 6.369 1.00 0.00 N ATOM 1215 CA LEU A 75 149.496 3.430 6.186 1.00 0.00 C ATOM 1216 C LEU A 75 150.072 4.613 5.414 1.00 0.00 C ATOM 1217 O LEU A 75 149.725 4.836 4.252 1.00 0.00 O ATOM 1218 CB LEU A 75 149.822 2.126 5.453 1.00 0.00 C ATOM 1219 CG LEU A 75 149.954 0.894 6.352 1.00 0.00 C ATOM 1220 CD1 LEU A 75 148.614 0.186 6.492 1.00 0.00 C ATOM 1221 CD2 LEU A 75 151.010 -0.056 5.803 1.00 0.00 C ATOM 0 H LEU A 75 147.536 3.766 5.515 1.00 0.00 H new ATOM 0 HA LEU A 75 149.954 3.414 7.175 1.00 0.00 H new ATOM 0 HB2 LEU A 75 149.042 1.937 4.715 1.00 0.00 H new ATOM 0 HB3 LEU A 75 150.755 2.258 4.904 1.00 0.00 H new ATOM 0 HG LEU A 75 150.270 1.223 7.342 1.00 0.00 H new ATOM 0 HD11 LEU A 75 148.729 -0.687 7.135 1.00 0.00 H new ATOM 0 HD12 LEU A 75 147.887 0.868 6.933 1.00 0.00 H new ATOM 0 HD13 LEU A 75 148.265 -0.131 5.509 1.00 0.00 H new ATOM 0 HD21 LEU A 75 151.091 -0.926 6.454 1.00 0.00 H new ATOM 0 HD22 LEU A 75 150.725 -0.378 4.801 1.00 0.00 H new ATOM 0 HD23 LEU A 75 151.972 0.455 5.760 1.00 0.00 H new ATOM 1233 N ARG A 76 150.964 5.362 6.064 1.00 0.00 N ATOM 1234 CA ARG A 76 151.601 6.515 5.434 1.00 0.00 C ATOM 1235 C ARG A 76 152.847 6.076 4.664 1.00 0.00 C ATOM 1236 O ARG A 76 153.871 5.739 5.264 1.00 0.00 O ATOM 1237 CB ARG A 76 151.976 7.566 6.488 1.00 0.00 C ATOM 1238 CG ARG A 76 150.975 8.706 6.600 1.00 0.00 C ATOM 1239 CD ARG A 76 151.316 9.637 7.755 1.00 0.00 C ATOM 1240 NE ARG A 76 150.232 9.718 8.735 1.00 0.00 N ATOM 1241 CZ ARG A 76 149.125 10.448 8.570 1.00 0.00 C ATOM 1242 NH1 ARG A 76 148.943 11.160 7.459 1.00 0.00 N ATOM 1243 NH2 ARG A 76 148.194 10.464 9.520 1.00 0.00 N ATOM 0 H ARG A 76 151.260 5.190 7.025 1.00 0.00 H new ATOM 0 HA ARG A 76 150.893 6.961 4.735 1.00 0.00 H new ATOM 0 HB2 ARG A 76 152.067 7.078 7.458 1.00 0.00 H new ATOM 0 HB3 ARG A 76 152.956 7.977 6.245 1.00 0.00 H new ATOM 0 HG2 ARG A 76 150.960 9.271 5.668 1.00 0.00 H new ATOM 0 HG3 ARG A 76 149.974 8.300 6.742 1.00 0.00 H new ATOM 0 HD2 ARG A 76 152.223 9.287 8.247 1.00 0.00 H new ATOM 0 HD3 ARG A 76 151.528 10.633 7.367 1.00 0.00 H new ATOM 0 HE ARG A 76 150.328 9.183 9.598 1.00 0.00 H new ATOM 0 HH11 ARG A 76 149.652 11.151 6.726 1.00 0.00 H new ATOM 0 HH12 ARG A 76 148.095 11.714 7.342 1.00 0.00 H new ATOM 0 HH21 ARG A 76 148.326 9.920 10.372 1.00 0.00 H new ATOM 0 HH22 ARG A 76 147.348 11.021 9.396 1.00 0.00 H new ATOM 1257 N ILE A 77 152.749 6.075 3.335 1.00 0.00 N ATOM 1258 CA ILE A 77 153.862 5.672 2.479 1.00 0.00 C ATOM 1259 C ILE A 77 154.124 6.712 1.391 1.00 0.00 C ATOM 1260 O ILE A 77 153.199 7.142 0.698 1.00 0.00 O ATOM 1261 CB ILE A 77 153.594 4.301 1.814 1.00 0.00 C ATOM 1262 CG1 ILE A 77 153.244 3.248 2.869 1.00 0.00 C ATOM 1263 CG2 ILE A 77 154.800 3.855 1.001 1.00 0.00 C ATOM 1264 CD1 ILE A 77 151.884 2.621 2.662 1.00 0.00 C ATOM 0 H ILE A 77 151.908 6.350 2.828 1.00 0.00 H new ATOM 0 HA ILE A 77 154.741 5.591 3.119 1.00 0.00 H new ATOM 0 HB ILE A 77 152.744 4.410 1.140 1.00 0.00 H new ATOM 0 HG12 ILE A 77 154.003 2.465 2.856 1.00 0.00 H new ATOM 0 HG13 ILE A 77 153.277 3.708 3.856 1.00 0.00 H new ATOM 0 HG21 ILE A 77 154.592 2.889 0.541 1.00 0.00 H new ATOM 0 HG22 ILE A 77 155.006 4.590 0.223 1.00 0.00 H new ATOM 0 HG23 ILE A 77 155.667 3.766 1.655 1.00 0.00 H new ATOM 0 HD11 ILE A 77 151.700 1.884 3.444 1.00 0.00 H new ATOM 0 HD12 ILE A 77 151.117 3.394 2.704 1.00 0.00 H new ATOM 0 HD13 ILE A 77 151.853 2.132 1.688 1.00 0.00 H new ATOM 1276 N LEU A 78 155.388 7.106 1.244 1.00 0.00 N ATOM 1277 CA LEU A 78 155.775 8.090 0.237 1.00 0.00 C ATOM 1278 C LEU A 78 156.456 7.407 -0.947 1.00 0.00 C ATOM 1279 O LEU A 78 157.377 6.608 -0.765 1.00 0.00 O ATOM 1280 CB LEU A 78 156.704 9.143 0.852 1.00 0.00 C ATOM 1281 CG LEU A 78 156.010 10.413 1.358 1.00 0.00 C ATOM 1282 CD1 LEU A 78 155.435 11.211 0.196 1.00 0.00 C ATOM 1283 CD2 LEU A 78 154.919 10.068 2.364 1.00 0.00 C ATOM 0 H LEU A 78 156.161 6.758 1.811 1.00 0.00 H new ATOM 0 HA LEU A 78 154.875 8.587 -0.124 1.00 0.00 H new ATOM 0 HB2 LEU A 78 157.243 8.688 1.683 1.00 0.00 H new ATOM 0 HB3 LEU A 78 157.448 9.427 0.107 1.00 0.00 H new ATOM 0 HG LEU A 78 156.755 11.030 1.861 1.00 0.00 H new ATOM 0 HD11 LEU A 78 154.947 12.108 0.577 1.00 0.00 H new ATOM 0 HD12 LEU A 78 156.239 11.496 -0.483 1.00 0.00 H new ATOM 0 HD13 LEU A 78 154.707 10.601 -0.339 1.00 0.00 H new ATOM 0 HD21 LEU A 78 154.440 10.984 2.710 1.00 0.00 H new ATOM 0 HD22 LEU A 78 154.176 9.427 1.890 1.00 0.00 H new ATOM 0 HD23 LEU A 78 155.359 9.546 3.214 1.00 0.00 H new ATOM 1295 N LEU A 79 155.990 7.719 -2.158 1.00 0.00 N ATOM 1296 CA LEU A 79 156.547 7.126 -3.376 1.00 0.00 C ATOM 1297 C LEU A 79 157.639 8.012 -3.974 1.00 0.00 C ATOM 1298 O LEU A 79 157.437 9.211 -4.177 1.00 0.00 O ATOM 1299 CB LEU A 79 155.441 6.894 -4.411 1.00 0.00 C ATOM 1300 CG LEU A 79 154.186 6.199 -3.878 1.00 0.00 C ATOM 1301 CD1 LEU A 79 152.960 6.620 -4.674 1.00 0.00 C ATOM 1302 CD2 LEU A 79 154.358 4.687 -3.915 1.00 0.00 C ATOM 0 H LEU A 79 155.229 8.378 -2.322 1.00 0.00 H new ATOM 0 HA LEU A 79 156.992 6.168 -3.106 1.00 0.00 H new ATOM 0 HB2 LEU A 79 155.152 7.857 -4.833 1.00 0.00 H new ATOM 0 HB3 LEU A 79 155.848 6.297 -5.227 1.00 0.00 H new ATOM 0 HG LEU A 79 154.039 6.503 -2.842 1.00 0.00 H new ATOM 0 HD11 LEU A 79 152.079 6.115 -4.279 1.00 0.00 H new ATOM 0 HD12 LEU A 79 152.827 7.699 -4.593 1.00 0.00 H new ATOM 0 HD13 LEU A 79 153.095 6.349 -5.721 1.00 0.00 H new ATOM 0 HD21 LEU A 79 153.456 4.209 -3.532 1.00 0.00 H new ATOM 0 HD22 LEU A 79 154.531 4.366 -4.942 1.00 0.00 H new ATOM 0 HD23 LEU A 79 155.210 4.402 -3.297 1.00 0.00 H new ATOM 1314 N LEU A 80 158.797 7.410 -4.255 1.00 0.00 N ATOM 1315 CA LEU A 80 159.928 8.138 -4.831 1.00 0.00 C ATOM 1316 C LEU A 80 160.613 7.315 -5.923 1.00 0.00 C ATOM 1317 O LEU A 80 160.870 6.124 -5.744 1.00 0.00 O ATOM 1318 CB LEU A 80 160.937 8.501 -3.736 1.00 0.00 C ATOM 1319 CG LEU A 80 160.437 9.517 -2.703 1.00 0.00 C ATOM 1320 CD1 LEU A 80 159.695 8.817 -1.573 1.00 0.00 C ATOM 1321 CD2 LEU A 80 161.596 10.338 -2.153 1.00 0.00 C ATOM 0 H LEU A 80 158.975 6.419 -4.092 1.00 0.00 H new ATOM 0 HA LEU A 80 159.546 9.054 -5.283 1.00 0.00 H new ATOM 0 HB2 LEU A 80 161.228 7.589 -3.215 1.00 0.00 H new ATOM 0 HB3 LEU A 80 161.835 8.898 -4.208 1.00 0.00 H new ATOM 0 HG LEU A 80 159.742 10.193 -3.201 1.00 0.00 H new ATOM 0 HD11 LEU A 80 159.349 9.557 -0.851 1.00 0.00 H new ATOM 0 HD12 LEU A 80 158.839 8.278 -1.979 1.00 0.00 H new ATOM 0 HD13 LEU A 80 160.365 8.114 -1.078 1.00 0.00 H new ATOM 0 HD21 LEU A 80 161.220 11.053 -1.421 1.00 0.00 H new ATOM 0 HD22 LEU A 80 162.317 9.675 -1.675 1.00 0.00 H new ATOM 0 HD23 LEU A 80 162.081 10.874 -2.969 1.00 0.00 H new ATOM 1333 N SER A 81 160.901 7.959 -7.055 1.00 0.00 N ATOM 1334 CA SER A 81 161.552 7.290 -8.182 1.00 0.00 C ATOM 1335 C SER A 81 162.951 6.804 -7.806 1.00 0.00 C ATOM 1336 O SER A 81 163.841 7.608 -7.520 1.00 0.00 O ATOM 1337 CB SER A 81 161.637 8.234 -9.387 1.00 0.00 C ATOM 1338 OG SER A 81 160.367 8.781 -9.698 1.00 0.00 O ATOM 0 H SER A 81 160.693 8.945 -7.216 1.00 0.00 H new ATOM 0 HA SER A 81 160.947 6.423 -8.447 1.00 0.00 H new ATOM 0 HB2 SER A 81 162.340 9.039 -9.173 1.00 0.00 H new ATOM 0 HB3 SER A 81 162.024 7.693 -10.250 1.00 0.00 H new ATOM 0 HG SER A 81 160.449 9.380 -10.469 1.00 0.00 H new