USER MOD reduce.3.24.130724 H: found=0, std=0, add=852, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 850 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 22 ASN : amide:sc= 0.152 K(o=-0.44,f=-9.6!) USER MOD Set 1.2: A 25 THR OG1 : rot -67:sc= -0.588 USER MOD Set 2.1: A 16 LYS NZ :NH3+ 167:sc= 0.832 (180deg=-0.0934) USER MOD Set 2.2: A 82 ASN : amide:sc= -0.643 K(o=0.19,f=-8.8!) USER MOD Set 3.1: A 5 SER OG : rot -111:sc= 0.227 USER MOD Set 3.2: A 6 THR OG1 : rot 180:sc= 0.0508 USER MOD Single : A 1 MET CE :methyl -164:sc= -0.0569 (180deg=-0.409) USER MOD Single : A 1 MET N :NH3+ -169:sc= -0.0147 (180deg=-0.175) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 4 THR OG1 : rot -100:sc= -1.29 USER MOD Single : A 9 CYS SG : rot 40:sc= 0.827 USER MOD Single : A 10 GLN : amide:sc= -0.0195 K(o=-0.02,f=-0.6) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 TYR OH : rot -61:sc= 0.00174 USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot -96:sc= 1.81 USER MOD Single : A 39 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 THR OG1 : rot -22:sc= 0.203 USER MOD Single : A 50 SER OG : rot -81:sc= 1.3 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 56 SER OG : rot 39:sc= 0.235 USER MOD Single : A 62 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 68 GLN : amide:sc= -1.03 K(o=-1,f=-3.1!) USER MOD Single : A 70 GLN :FLIP amide:sc= -0.0415 F(o=-1.3!,f=-0.041) USER MOD Single : A 75 GLN :FLIP amide:sc= -2.5! C(o=-6.8!,f=-2.5!) USER MOD Single : A 76 ASN : amide:sc= 0.1 X(o=0.1,f=0) USER MOD Single : A 78 ASN : amide:sc= -0.268 K(o=-0.27,f=-3.7!) USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 GLN : amide:sc= -2.79! C(o=-2.8!,f=-9.4!) USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 GLN : amide:sc= -0.111 K(o=-0.11,f=-5.4!) USER MOD Single : A 104 GLN : amide:sc= 0 X(o=0,f=-0.48) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -1.421 0.701 -0.561 1.00 0.00 N ATOM 2 CA MET A 1 -0.348 1.657 -0.911 1.00 0.00 C ATOM 3 C MET A 1 -0.950 3.026 -1.179 1.00 0.00 C ATOM 4 O MET A 1 -1.943 3.146 -1.897 1.00 0.00 O ATOM 5 CB MET A 1 0.420 1.175 -2.147 1.00 0.00 C ATOM 6 CG MET A 1 1.030 -0.210 -1.994 1.00 0.00 C ATOM 7 SD MET A 1 2.226 -0.313 -0.647 1.00 0.00 S ATOM 8 CE MET A 1 3.501 0.804 -1.230 1.00 0.00 C ATOM 0 H1 MET A 1 -0.999 -0.178 -0.199 1.00 0.00 H new ATOM 0 H2 MET A 1 -2.032 1.118 0.170 1.00 0.00 H new ATOM 0 H3 MET A 1 -1.988 0.490 -1.407 1.00 0.00 H new ATOM 0 HA MET A 1 0.348 1.724 -0.075 1.00 0.00 H new ATOM 0 HB2 MET A 1 -0.255 1.171 -3.003 1.00 0.00 H new ATOM 0 HB3 MET A 1 1.214 1.888 -2.370 1.00 0.00 H new ATOM 0 HG2 MET A 1 0.234 -0.934 -1.821 1.00 0.00 H new ATOM 0 HG3 MET A 1 1.518 -0.490 -2.927 1.00 0.00 H new ATOM 0 HE1 MET A 1 4.418 0.637 -0.665 1.00 0.00 H new ATOM 0 HE2 MET A 1 3.689 0.621 -2.288 1.00 0.00 H new ATOM 0 HE3 MET A 1 3.173 1.834 -1.092 1.00 0.00 H new ATOM 18 N SER A 2 -0.356 4.054 -0.603 1.00 0.00 N ATOM 19 CA SER A 2 -0.860 5.407 -0.761 1.00 0.00 C ATOM 20 C SER A 2 0.041 6.206 -1.691 1.00 0.00 C ATOM 21 O SER A 2 1.256 6.008 -1.713 1.00 0.00 O ATOM 22 CB SER A 2 -0.956 6.092 0.599 1.00 0.00 C ATOM 23 OG SER A 2 -1.759 5.334 1.488 1.00 0.00 O ATOM 0 H SER A 2 0.478 3.979 -0.020 1.00 0.00 H new ATOM 0 HA SER A 2 -1.855 5.359 -1.203 1.00 0.00 H new ATOM 0 HB2 SER A 2 0.042 6.217 1.020 1.00 0.00 H new ATOM 0 HB3 SER A 2 -1.379 7.089 0.480 1.00 0.00 H new ATOM 0 HG SER A 2 -1.807 5.789 2.355 1.00 0.00 H new ATOM 29 N ILE A 3 -0.561 7.099 -2.458 1.00 0.00 N ATOM 30 CA ILE A 3 0.181 7.921 -3.397 1.00 0.00 C ATOM 31 C ILE A 3 0.931 9.021 -2.654 1.00 0.00 C ATOM 32 O ILE A 3 0.454 9.538 -1.640 1.00 0.00 O ATOM 33 CB ILE A 3 -0.755 8.540 -4.462 1.00 0.00 C ATOM 34 CG1 ILE A 3 -1.542 7.438 -5.180 1.00 0.00 C ATOM 35 CG2 ILE A 3 0.036 9.365 -5.471 1.00 0.00 C ATOM 36 CD1 ILE A 3 -0.664 6.395 -5.835 1.00 0.00 C ATOM 0 H ILE A 3 -1.566 7.273 -2.448 1.00 0.00 H new ATOM 0 HA ILE A 3 0.899 7.282 -3.910 1.00 0.00 H new ATOM 0 HB ILE A 3 -1.456 9.203 -3.955 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -2.201 6.948 -4.463 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -2.179 7.893 -5.939 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -0.646 9.789 -6.209 1.00 0.00 H new ATOM 0 HG22 ILE A 3 0.557 10.170 -4.954 1.00 0.00 H new ATOM 0 HG23 ILE A 3 0.763 8.726 -5.973 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -1.289 5.648 -6.323 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -0.023 6.872 -6.576 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -0.046 5.912 -5.078 1.00 0.00 H new ATOM 48 N THR A 4 2.108 9.361 -3.149 1.00 0.00 N ATOM 49 CA THR A 4 2.950 10.346 -2.504 1.00 0.00 C ATOM 50 C THR A 4 2.704 11.747 -3.060 1.00 0.00 C ATOM 51 O THR A 4 1.891 11.942 -3.969 1.00 0.00 O ATOM 52 CB THR A 4 4.434 9.980 -2.684 1.00 0.00 C ATOM 53 OG1 THR A 4 4.727 9.827 -4.078 1.00 0.00 O ATOM 54 CG2 THR A 4 4.766 8.690 -1.949 1.00 0.00 C ATOM 0 H THR A 4 2.502 8.965 -4.002 1.00 0.00 H new ATOM 0 HA THR A 4 2.697 10.347 -1.444 1.00 0.00 H new ATOM 0 HB THR A 4 5.041 10.783 -2.266 1.00 0.00 H new ATOM 0 HG1 THR A 4 4.737 8.874 -4.308 1.00 0.00 H new ATOM 0 HG21 THR A 4 5.820 8.451 -2.091 1.00 0.00 H new ATOM 0 HG22 THR A 4 4.562 8.814 -0.886 1.00 0.00 H new ATOM 0 HG23 THR A 4 4.154 7.879 -2.344 1.00 0.00 H new ATOM 62 N SER A 5 3.418 12.711 -2.507 1.00 0.00 N ATOM 63 CA SER A 5 3.337 14.092 -2.941 1.00 0.00 C ATOM 64 C SER A 5 4.316 14.329 -4.091 1.00 0.00 C ATOM 65 O SER A 5 4.878 13.376 -4.639 1.00 0.00 O ATOM 66 CB SER A 5 3.639 15.024 -1.758 1.00 0.00 C ATOM 67 OG SER A 5 3.411 16.386 -2.086 1.00 0.00 O ATOM 0 H SER A 5 4.073 12.556 -1.741 1.00 0.00 H new ATOM 0 HA SER A 5 2.330 14.307 -3.299 1.00 0.00 H new ATOM 0 HB2 SER A 5 3.016 14.746 -0.908 1.00 0.00 H new ATOM 0 HB3 SER A 5 4.676 14.894 -1.449 1.00 0.00 H new ATOM 0 HG SER A 5 4.267 16.862 -2.120 1.00 0.00 H new ATOM 73 N THR A 6 4.506 15.597 -4.448 1.00 0.00 N ATOM 74 CA THR A 6 5.391 16.011 -5.537 1.00 0.00 C ATOM 75 C THR A 6 6.792 15.390 -5.419 1.00 0.00 C ATOM 76 O THR A 6 7.526 15.305 -6.408 1.00 0.00 O ATOM 77 CB THR A 6 5.508 17.546 -5.567 1.00 0.00 C ATOM 78 OG1 THR A 6 4.225 18.125 -5.290 1.00 0.00 O ATOM 79 CG2 THR A 6 5.996 18.032 -6.925 1.00 0.00 C ATOM 0 H THR A 6 4.043 16.378 -3.983 1.00 0.00 H new ATOM 0 HA THR A 6 4.948 15.652 -6.466 1.00 0.00 H new ATOM 0 HB THR A 6 6.231 17.851 -4.811 1.00 0.00 H new ATOM 0 HG1 THR A 6 4.297 19.102 -5.307 1.00 0.00 H new ATOM 0 HG21 THR A 6 6.069 19.120 -6.917 1.00 0.00 H new ATOM 0 HG22 THR A 6 6.976 17.604 -7.134 1.00 0.00 H new ATOM 0 HG23 THR A 6 5.292 17.721 -7.697 1.00 0.00 H new ATOM 87 N ASP A 7 7.152 14.964 -4.206 1.00 0.00 N ATOM 88 CA ASP A 7 8.434 14.301 -3.943 1.00 0.00 C ATOM 89 C ASP A 7 8.666 13.137 -4.905 1.00 0.00 C ATOM 90 O ASP A 7 9.808 12.792 -5.203 1.00 0.00 O ATOM 91 CB ASP A 7 8.471 13.762 -2.511 1.00 0.00 C ATOM 92 CG ASP A 7 8.186 14.818 -1.469 1.00 0.00 C ATOM 93 OD1 ASP A 7 6.998 15.144 -1.265 1.00 0.00 O ATOM 94 OD2 ASP A 7 9.143 15.308 -0.833 1.00 0.00 O ATOM 0 H ASP A 7 6.565 15.068 -3.379 1.00 0.00 H new ATOM 0 HA ASP A 7 9.218 15.045 -4.085 1.00 0.00 H new ATOM 0 HB2 ASP A 7 7.741 12.958 -2.413 1.00 0.00 H new ATOM 0 HB3 ASP A 7 9.452 13.327 -2.319 1.00 0.00 H new ATOM 99 N ILE A 8 7.577 12.542 -5.390 1.00 0.00 N ATOM 100 CA ILE A 8 7.657 11.439 -6.346 1.00 0.00 C ATOM 101 C ILE A 8 8.450 11.849 -7.591 1.00 0.00 C ATOM 102 O ILE A 8 9.216 11.060 -8.144 1.00 0.00 O ATOM 103 CB ILE A 8 6.243 10.947 -6.755 1.00 0.00 C ATOM 104 CG1 ILE A 8 6.338 9.752 -7.707 1.00 0.00 C ATOM 105 CG2 ILE A 8 5.436 12.071 -7.394 1.00 0.00 C ATOM 106 CD1 ILE A 8 4.991 9.182 -8.095 1.00 0.00 C ATOM 0 H ILE A 8 6.626 12.807 -5.135 1.00 0.00 H new ATOM 0 HA ILE A 8 8.179 10.618 -5.854 1.00 0.00 H new ATOM 0 HB ILE A 8 5.726 10.628 -5.850 1.00 0.00 H new ATOM 0 HG12 ILE A 8 6.868 10.057 -8.609 1.00 0.00 H new ATOM 0 HG13 ILE A 8 6.933 8.969 -7.237 1.00 0.00 H new ATOM 0 HG21 ILE A 8 4.450 11.699 -7.671 1.00 0.00 H new ATOM 0 HG22 ILE A 8 5.328 12.891 -6.684 1.00 0.00 H new ATOM 0 HG23 ILE A 8 5.952 12.428 -8.285 1.00 0.00 H new ATOM 0 HD11 ILE A 8 5.134 8.339 -8.771 1.00 0.00 H new ATOM 0 HD12 ILE A 8 4.467 8.846 -7.200 1.00 0.00 H new ATOM 0 HD13 ILE A 8 4.401 9.951 -8.594 1.00 0.00 H new ATOM 118 N CYS A 9 8.287 13.101 -7.999 1.00 0.00 N ATOM 119 CA CYS A 9 8.980 13.631 -9.161 1.00 0.00 C ATOM 120 C CYS A 9 10.449 13.884 -8.841 1.00 0.00 C ATOM 121 O CYS A 9 11.319 13.747 -9.701 1.00 0.00 O ATOM 122 CB CYS A 9 8.309 14.929 -9.615 1.00 0.00 C ATOM 123 SG CYS A 9 9.181 15.789 -10.941 1.00 0.00 S ATOM 0 H CYS A 9 7.674 13.772 -7.536 1.00 0.00 H new ATOM 0 HA CYS A 9 8.926 12.898 -9.966 1.00 0.00 H new ATOM 0 HB2 CYS A 9 7.296 14.704 -9.948 1.00 0.00 H new ATOM 0 HB3 CYS A 9 8.222 15.598 -8.759 1.00 0.00 H new ATOM 0 HG CYS A 9 9.625 14.922 -11.802 1.00 0.00 H new ATOM 129 N GLN A 10 10.714 14.240 -7.592 1.00 0.00 N ATOM 130 CA GLN A 10 12.065 14.565 -7.159 1.00 0.00 C ATOM 131 C GLN A 10 12.901 13.295 -7.030 1.00 0.00 C ATOM 132 O GLN A 10 14.073 13.269 -7.402 1.00 0.00 O ATOM 133 CB GLN A 10 12.035 15.309 -5.820 1.00 0.00 C ATOM 134 CG GLN A 10 11.073 16.490 -5.789 1.00 0.00 C ATOM 135 CD GLN A 10 11.344 17.515 -6.875 1.00 0.00 C ATOM 136 OE1 GLN A 10 12.479 17.691 -7.317 1.00 0.00 O ATOM 137 NE2 GLN A 10 10.301 18.206 -7.306 1.00 0.00 N ATOM 0 H GLN A 10 10.008 14.311 -6.859 1.00 0.00 H new ATOM 0 HA GLN A 10 12.519 15.212 -7.909 1.00 0.00 H new ATOM 0 HB2 GLN A 10 11.759 14.608 -5.033 1.00 0.00 H new ATOM 0 HB3 GLN A 10 13.039 15.666 -5.592 1.00 0.00 H new ATOM 0 HG2 GLN A 10 10.053 16.121 -5.894 1.00 0.00 H new ATOM 0 HG3 GLN A 10 11.138 16.977 -4.816 1.00 0.00 H new ATOM 0 HE21 GLN A 10 9.376 18.030 -6.914 1.00 0.00 H new ATOM 0 HE22 GLN A 10 10.422 18.914 -8.030 1.00 0.00 H new ATOM 146 N ALA A 11 12.278 12.236 -6.520 1.00 0.00 N ATOM 147 CA ALA A 11 12.956 10.958 -6.331 1.00 0.00 C ATOM 148 C ALA A 11 13.375 10.346 -7.665 1.00 0.00 C ATOM 149 O ALA A 11 14.375 9.636 -7.742 1.00 0.00 O ATOM 150 CB ALA A 11 12.065 9.996 -5.560 1.00 0.00 C ATOM 0 H ALA A 11 11.300 12.239 -6.229 1.00 0.00 H new ATOM 0 HA ALA A 11 13.861 11.142 -5.752 1.00 0.00 H new ATOM 0 HB1 ALA A 11 12.584 9.047 -5.427 1.00 0.00 H new ATOM 0 HB2 ALA A 11 11.829 10.421 -4.584 1.00 0.00 H new ATOM 0 HB3 ALA A 11 11.142 9.830 -6.116 1.00 0.00 H new ATOM 156 N ALA A 12 12.608 10.628 -8.714 1.00 0.00 N ATOM 157 CA ALA A 12 12.937 10.153 -10.054 1.00 0.00 C ATOM 158 C ALA A 12 14.211 10.822 -10.563 1.00 0.00 C ATOM 159 O ALA A 12 14.992 10.225 -11.300 1.00 0.00 O ATOM 160 CB ALA A 12 11.781 10.414 -11.009 1.00 0.00 C ATOM 0 H ALA A 12 11.754 11.183 -8.662 1.00 0.00 H new ATOM 0 HA ALA A 12 13.110 9.078 -10.005 1.00 0.00 H new ATOM 0 HB1 ALA A 12 12.043 10.054 -12.004 1.00 0.00 H new ATOM 0 HB2 ALA A 12 10.892 9.891 -10.656 1.00 0.00 H new ATOM 0 HB3 ALA A 12 11.579 11.484 -11.052 1.00 0.00 H new ATOM 166 N ASP A 13 14.412 12.064 -10.149 1.00 0.00 N ATOM 167 CA ASP A 13 15.603 12.821 -10.516 1.00 0.00 C ATOM 168 C ASP A 13 16.800 12.340 -9.698 1.00 0.00 C ATOM 169 O ASP A 13 17.951 12.433 -10.128 1.00 0.00 O ATOM 170 CB ASP A 13 15.359 14.316 -10.271 1.00 0.00 C ATOM 171 CG ASP A 13 16.544 15.188 -10.642 1.00 0.00 C ATOM 172 OD1 ASP A 13 17.407 15.435 -9.771 1.00 0.00 O ATOM 173 OD2 ASP A 13 16.606 15.653 -11.802 1.00 0.00 O ATOM 0 H ASP A 13 13.760 12.574 -9.553 1.00 0.00 H new ATOM 0 HA ASP A 13 15.818 12.664 -11.573 1.00 0.00 H new ATOM 0 HB2 ASP A 13 14.489 14.634 -10.846 1.00 0.00 H new ATOM 0 HB3 ASP A 13 15.119 14.470 -9.219 1.00 0.00 H new ATOM 178 N ALA A 14 16.504 11.783 -8.531 1.00 0.00 N ATOM 179 CA ALA A 14 17.529 11.367 -7.584 1.00 0.00 C ATOM 180 C ALA A 14 18.013 9.941 -7.844 1.00 0.00 C ATOM 181 O ALA A 14 18.677 9.346 -6.997 1.00 0.00 O ATOM 182 CB ALA A 14 16.996 11.488 -6.163 1.00 0.00 C ATOM 0 H ALA A 14 15.550 11.607 -8.215 1.00 0.00 H new ATOM 0 HA ALA A 14 18.386 12.027 -7.715 1.00 0.00 H new ATOM 0 HB1 ALA A 14 17.766 11.176 -5.458 1.00 0.00 H new ATOM 0 HB2 ALA A 14 16.721 12.524 -5.965 1.00 0.00 H new ATOM 0 HB3 ALA A 14 16.119 10.851 -6.048 1.00 0.00 H new ATOM 188 N LEU A 15 17.684 9.392 -9.008 1.00 0.00 N ATOM 189 CA LEU A 15 18.158 8.060 -9.384 1.00 0.00 C ATOM 190 C LEU A 15 19.622 8.129 -9.810 1.00 0.00 C ATOM 191 O LEU A 15 20.072 9.162 -10.306 1.00 0.00 O ATOM 192 CB LEU A 15 17.307 7.488 -10.523 1.00 0.00 C ATOM 193 CG LEU A 15 15.814 7.352 -10.222 1.00 0.00 C ATOM 194 CD1 LEU A 15 15.086 6.740 -11.408 1.00 0.00 C ATOM 195 CD2 LEU A 15 15.593 6.514 -8.975 1.00 0.00 C ATOM 0 H LEU A 15 17.094 9.844 -9.706 1.00 0.00 H new ATOM 0 HA LEU A 15 18.068 7.402 -8.520 1.00 0.00 H new ATOM 0 HB2 LEU A 15 17.427 8.126 -11.399 1.00 0.00 H new ATOM 0 HB3 LEU A 15 17.698 6.506 -10.788 1.00 0.00 H new ATOM 0 HG LEU A 15 15.409 8.348 -10.043 1.00 0.00 H new ATOM 0 HD11 LEU A 15 14.025 6.650 -11.177 1.00 0.00 H new ATOM 0 HD12 LEU A 15 15.214 7.378 -12.282 1.00 0.00 H new ATOM 0 HD13 LEU A 15 15.497 5.752 -11.617 1.00 0.00 H new ATOM 0 HD21 LEU A 15 14.524 6.429 -8.778 1.00 0.00 H new ATOM 0 HD22 LEU A 15 16.014 5.520 -9.125 1.00 0.00 H new ATOM 0 HD23 LEU A 15 16.082 6.990 -8.125 1.00 0.00 H new ATOM 207 N LYS A 16 20.367 7.045 -9.619 1.00 0.00 N ATOM 208 CA LYS A 16 21.785 7.033 -9.968 1.00 0.00 C ATOM 209 C LYS A 16 22.111 5.884 -10.915 1.00 0.00 C ATOM 210 O LYS A 16 21.493 4.822 -10.858 1.00 0.00 O ATOM 211 CB LYS A 16 22.657 6.941 -8.712 1.00 0.00 C ATOM 212 CG LYS A 16 22.412 5.695 -7.876 1.00 0.00 C ATOM 213 CD LYS A 16 23.378 5.608 -6.705 1.00 0.00 C ATOM 214 CE LYS A 16 23.238 6.799 -5.769 1.00 0.00 C ATOM 215 NZ LYS A 16 21.898 6.854 -5.127 1.00 0.00 N ATOM 0 H LYS A 16 20.017 6.170 -9.228 1.00 0.00 H new ATOM 0 HA LYS A 16 22.004 7.971 -10.478 1.00 0.00 H new ATOM 0 HB2 LYS A 16 23.706 6.966 -9.008 1.00 0.00 H new ATOM 0 HB3 LYS A 16 22.479 7.821 -8.094 1.00 0.00 H new ATOM 0 HG2 LYS A 16 21.388 5.702 -7.504 1.00 0.00 H new ATOM 0 HG3 LYS A 16 22.518 4.809 -8.502 1.00 0.00 H new ATOM 0 HD2 LYS A 16 23.196 4.687 -6.151 1.00 0.00 H new ATOM 0 HD3 LYS A 16 24.400 5.558 -7.080 1.00 0.00 H new ATOM 0 HE2 LYS A 16 24.007 6.745 -4.998 1.00 0.00 H new ATOM 0 HE3 LYS A 16 23.410 7.720 -6.327 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 21.916 7.537 -4.343 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 21.189 7.150 -5.828 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 21.650 5.913 -4.760 1.00 0.00 H new ATOM 229 N GLY A 17 23.077 6.110 -11.791 1.00 0.00 N ATOM 230 CA GLY A 17 23.477 5.090 -12.735 1.00 0.00 C ATOM 231 C GLY A 17 23.408 5.577 -14.167 1.00 0.00 C ATOM 232 O GLY A 17 22.551 6.392 -14.514 1.00 0.00 O ATOM 0 H GLY A 17 23.593 6.987 -11.865 1.00 0.00 H new ATOM 0 HA2 GLY A 17 24.494 4.769 -12.511 1.00 0.00 H new ATOM 0 HA3 GLY A 17 22.834 4.217 -12.618 1.00 0.00 H new ATOM 236 N PHE A 18 24.313 5.084 -14.997 1.00 0.00 N ATOM 237 CA PHE A 18 24.350 5.453 -16.403 1.00 0.00 C ATOM 238 C PHE A 18 23.965 4.252 -17.249 1.00 0.00 C ATOM 239 O PHE A 18 24.641 3.230 -17.224 1.00 0.00 O ATOM 240 CB PHE A 18 25.751 5.934 -16.798 1.00 0.00 C ATOM 241 CG PHE A 18 26.252 7.098 -15.989 1.00 0.00 C ATOM 242 CD1 PHE A 18 26.005 8.399 -16.395 1.00 0.00 C ATOM 243 CD2 PHE A 18 26.974 6.890 -14.824 1.00 0.00 C ATOM 244 CE1 PHE A 18 26.466 9.470 -15.655 1.00 0.00 C ATOM 245 CE2 PHE A 18 27.437 7.957 -14.080 1.00 0.00 C ATOM 246 CZ PHE A 18 27.183 9.249 -14.496 1.00 0.00 C ATOM 0 H PHE A 18 25.037 4.422 -14.718 1.00 0.00 H new ATOM 0 HA PHE A 18 23.644 6.266 -16.572 1.00 0.00 H new ATOM 0 HB2 PHE A 18 26.451 5.105 -16.693 1.00 0.00 H new ATOM 0 HB3 PHE A 18 25.744 6.214 -17.851 1.00 0.00 H new ATOM 0 HD1 PHE A 18 25.445 8.578 -17.301 1.00 0.00 H new ATOM 0 HD2 PHE A 18 27.177 5.882 -14.495 1.00 0.00 H new ATOM 0 HE1 PHE A 18 26.266 10.479 -15.983 1.00 0.00 H new ATOM 0 HE2 PHE A 18 27.997 7.781 -13.174 1.00 0.00 H new ATOM 0 HZ PHE A 18 27.545 10.085 -13.916 1.00 0.00 H new ATOM 256 N VAL A 19 22.895 4.370 -18.004 1.00 0.00 N ATOM 257 CA VAL A 19 22.396 3.239 -18.766 1.00 0.00 C ATOM 258 C VAL A 19 22.972 3.273 -20.172 1.00 0.00 C ATOM 259 O VAL A 19 22.960 4.313 -20.829 1.00 0.00 O ATOM 260 CB VAL A 19 20.855 3.238 -18.838 1.00 0.00 C ATOM 261 CG1 VAL A 19 20.337 1.863 -19.226 1.00 0.00 C ATOM 262 CG2 VAL A 19 20.248 3.687 -17.518 1.00 0.00 C ATOM 0 H VAL A 19 22.355 5.229 -18.109 1.00 0.00 H new ATOM 0 HA VAL A 19 22.710 2.328 -18.257 1.00 0.00 H new ATOM 0 HB VAL A 19 20.553 3.948 -19.607 1.00 0.00 H new ATOM 0 HG11 VAL A 19 19.248 1.884 -19.271 1.00 0.00 H new ATOM 0 HG12 VAL A 19 20.735 1.586 -20.202 1.00 0.00 H new ATOM 0 HG13 VAL A 19 20.655 1.131 -18.483 1.00 0.00 H new ATOM 0 HG21 VAL A 19 19.161 3.677 -17.596 1.00 0.00 H new ATOM 0 HG22 VAL A 19 20.561 3.009 -16.724 1.00 0.00 H new ATOM 0 HG23 VAL A 19 20.586 4.697 -17.287 1.00 0.00 H new ATOM 272 N GLY A 20 23.497 2.140 -20.613 1.00 0.00 N ATOM 273 CA GLY A 20 24.139 2.070 -21.905 1.00 0.00 C ATOM 274 C GLY A 20 23.772 0.807 -22.655 1.00 0.00 C ATOM 275 O GLY A 20 23.323 -0.174 -22.059 1.00 0.00 O ATOM 0 H GLY A 20 23.488 1.262 -20.093 1.00 0.00 H new ATOM 0 HA2 GLY A 20 23.855 2.939 -22.498 1.00 0.00 H new ATOM 0 HA3 GLY A 20 25.220 2.113 -21.775 1.00 0.00 H new ATOM 279 N PHE A 21 23.958 0.824 -23.963 1.00 0.00 N ATOM 280 CA PHE A 21 23.603 -0.313 -24.795 1.00 0.00 C ATOM 281 C PHE A 21 24.794 -1.250 -24.960 1.00 0.00 C ATOM 282 O PHE A 21 25.914 -0.810 -25.215 1.00 0.00 O ATOM 283 CB PHE A 21 23.111 0.167 -26.164 1.00 0.00 C ATOM 284 CG PHE A 21 22.560 -0.933 -27.030 1.00 0.00 C ATOM 285 CD1 PHE A 21 21.253 -1.365 -26.870 1.00 0.00 C ATOM 286 CD2 PHE A 21 23.346 -1.533 -28.002 1.00 0.00 C ATOM 287 CE1 PHE A 21 20.740 -2.375 -27.663 1.00 0.00 C ATOM 288 CE2 PHE A 21 22.838 -2.543 -28.796 1.00 0.00 C ATOM 289 CZ PHE A 21 21.534 -2.964 -28.627 1.00 0.00 C ATOM 0 H PHE A 21 24.353 1.614 -24.473 1.00 0.00 H new ATOM 0 HA PHE A 21 22.799 -0.862 -24.305 1.00 0.00 H new ATOM 0 HB2 PHE A 21 22.339 0.923 -26.018 1.00 0.00 H new ATOM 0 HB3 PHE A 21 23.936 0.650 -26.687 1.00 0.00 H new ATOM 0 HD1 PHE A 21 20.628 -0.908 -26.117 1.00 0.00 H new ATOM 0 HD2 PHE A 21 24.366 -1.207 -28.140 1.00 0.00 H new ATOM 0 HE1 PHE A 21 19.720 -2.703 -27.529 1.00 0.00 H new ATOM 0 HE2 PHE A 21 23.461 -3.003 -29.549 1.00 0.00 H new ATOM 0 HZ PHE A 21 21.136 -3.753 -29.248 1.00 0.00 H new ATOM 299 N ASN A 22 24.546 -2.541 -24.802 1.00 0.00 N ATOM 300 CA ASN A 22 25.582 -3.546 -24.981 1.00 0.00 C ATOM 301 C ASN A 22 25.351 -4.294 -26.288 1.00 0.00 C ATOM 302 O ASN A 22 24.385 -5.045 -26.419 1.00 0.00 O ATOM 303 CB ASN A 22 25.587 -4.523 -23.803 1.00 0.00 C ATOM 304 CG ASN A 22 26.714 -5.533 -23.891 1.00 0.00 C ATOM 305 OD1 ASN A 22 26.566 -6.595 -24.496 1.00 0.00 O ATOM 306 ND2 ASN A 22 27.846 -5.216 -23.283 1.00 0.00 N ATOM 0 H ASN A 22 23.633 -2.918 -24.549 1.00 0.00 H new ATOM 0 HA ASN A 22 26.553 -3.052 -25.020 1.00 0.00 H new ATOM 0 HB2 ASN A 22 25.677 -3.964 -22.872 1.00 0.00 H new ATOM 0 HB3 ASN A 22 24.633 -5.050 -23.768 1.00 0.00 H new ATOM 0 HD21 ASN A 22 28.635 -5.862 -23.305 1.00 0.00 H new ATOM 0 HD22 ASN A 22 27.929 -4.326 -22.792 1.00 0.00 H new ATOM 313 N ARG A 23 26.238 -4.083 -27.255 1.00 0.00 N ATOM 314 CA ARG A 23 26.060 -4.639 -28.596 1.00 0.00 C ATOM 315 C ARG A 23 26.383 -6.131 -28.657 1.00 0.00 C ATOM 316 O ARG A 23 26.126 -6.784 -29.667 1.00 0.00 O ATOM 317 CB ARG A 23 26.915 -3.877 -29.611 1.00 0.00 C ATOM 318 CG ARG A 23 28.397 -3.839 -29.275 1.00 0.00 C ATOM 319 CD ARG A 23 29.200 -3.162 -30.377 1.00 0.00 C ATOM 320 NE ARG A 23 28.745 -1.794 -30.643 1.00 0.00 N ATOM 321 CZ ARG A 23 29.369 -0.947 -31.466 1.00 0.00 C ATOM 322 NH1 ARG A 23 30.480 -1.315 -32.093 1.00 0.00 N ATOM 323 NH2 ARG A 23 28.892 0.279 -31.653 1.00 0.00 N ATOM 0 H ARG A 23 27.088 -3.531 -27.137 1.00 0.00 H new ATOM 0 HA ARG A 23 25.006 -4.523 -28.849 1.00 0.00 H new ATOM 0 HB2 ARG A 23 26.788 -4.335 -30.592 1.00 0.00 H new ATOM 0 HB3 ARG A 23 26.545 -2.855 -29.686 1.00 0.00 H new ATOM 0 HG2 ARG A 23 28.545 -3.306 -28.336 1.00 0.00 H new ATOM 0 HG3 ARG A 23 28.764 -4.855 -29.127 1.00 0.00 H new ATOM 0 HD2 ARG A 23 30.253 -3.143 -30.096 1.00 0.00 H new ATOM 0 HD3 ARG A 23 29.125 -3.751 -31.291 1.00 0.00 H new ATOM 0 HE ARG A 23 27.901 -1.469 -30.171 1.00 0.00 H new ATOM 0 HH11 ARG A 23 30.862 -2.250 -31.948 1.00 0.00 H new ATOM 0 HH12 ARG A 23 30.951 -0.663 -32.720 1.00 0.00 H new ATOM 0 HH21 ARG A 23 28.046 0.577 -31.167 1.00 0.00 H new ATOM 0 HH22 ARG A 23 29.372 0.922 -32.282 1.00 0.00 H new ATOM 337 N LYS A 24 26.940 -6.672 -27.585 1.00 0.00 N ATOM 338 CA LYS A 24 27.265 -8.092 -27.546 1.00 0.00 C ATOM 339 C LYS A 24 26.023 -8.912 -27.214 1.00 0.00 C ATOM 340 O LYS A 24 25.748 -9.931 -27.844 1.00 0.00 O ATOM 341 CB LYS A 24 28.367 -8.366 -26.522 1.00 0.00 C ATOM 342 CG LYS A 24 28.734 -9.838 -26.402 1.00 0.00 C ATOM 343 CD LYS A 24 29.871 -10.055 -25.418 1.00 0.00 C ATOM 344 CE LYS A 24 31.143 -9.360 -25.876 1.00 0.00 C ATOM 345 NZ LYS A 24 32.275 -9.593 -24.942 1.00 0.00 N ATOM 0 H LYS A 24 27.175 -6.156 -26.737 1.00 0.00 H new ATOM 0 HA LYS A 24 27.628 -8.387 -28.531 1.00 0.00 H new ATOM 0 HB2 LYS A 24 29.257 -7.800 -26.798 1.00 0.00 H new ATOM 0 HB3 LYS A 24 28.045 -8.000 -25.547 1.00 0.00 H new ATOM 0 HG2 LYS A 24 27.861 -10.406 -26.080 1.00 0.00 H new ATOM 0 HG3 LYS A 24 29.021 -10.222 -27.381 1.00 0.00 H new ATOM 0 HD2 LYS A 24 29.582 -9.678 -24.437 1.00 0.00 H new ATOM 0 HD3 LYS A 24 30.058 -11.123 -25.306 1.00 0.00 H new ATOM 0 HE2 LYS A 24 31.414 -9.718 -26.869 1.00 0.00 H new ATOM 0 HE3 LYS A 24 30.959 -8.289 -25.962 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 33.121 -9.101 -25.293 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 32.028 -9.228 -24.000 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 32.469 -10.613 -24.879 1.00 0.00 H new ATOM 359 N THR A 25 25.275 -8.454 -26.224 1.00 0.00 N ATOM 360 CA THR A 25 24.063 -9.136 -25.808 1.00 0.00 C ATOM 361 C THR A 25 22.843 -8.582 -26.540 1.00 0.00 C ATOM 362 O THR A 25 21.806 -9.242 -26.632 1.00 0.00 O ATOM 363 CB THR A 25 23.861 -9.009 -24.288 1.00 0.00 C ATOM 364 OG1 THR A 25 24.072 -7.650 -23.882 1.00 0.00 O ATOM 365 CG2 THR A 25 24.814 -9.925 -23.535 1.00 0.00 C ATOM 0 H THR A 25 25.488 -7.610 -25.692 1.00 0.00 H new ATOM 0 HA THR A 25 24.173 -10.190 -26.064 1.00 0.00 H new ATOM 0 HB THR A 25 22.839 -9.306 -24.051 1.00 0.00 H new ATOM 0 HG1 THR A 25 25.015 -7.414 -24.007 1.00 0.00 H new ATOM 0 HG21 THR A 25 24.651 -9.817 -22.463 1.00 0.00 H new ATOM 0 HG22 THR A 25 24.632 -10.959 -23.827 1.00 0.00 H new ATOM 0 HG23 THR A 25 25.843 -9.656 -23.775 1.00 0.00 H new ATOM 373 N GLY A 26 22.980 -7.367 -27.061 1.00 0.00 N ATOM 374 CA GLY A 26 21.896 -6.744 -27.792 1.00 0.00 C ATOM 375 C GLY A 26 20.815 -6.219 -26.871 1.00 0.00 C ATOM 376 O GLY A 26 19.635 -6.239 -27.215 1.00 0.00 O ATOM 0 H GLY A 26 23.826 -6.802 -26.989 1.00 0.00 H new ATOM 0 HA2 GLY A 26 22.289 -5.924 -28.393 1.00 0.00 H new ATOM 0 HA3 GLY A 26 21.463 -7.467 -28.483 1.00 0.00 H new ATOM 380 N ARG A 27 21.216 -5.744 -25.699 1.00 0.00 N ATOM 381 CA ARG A 27 20.260 -5.251 -24.717 1.00 0.00 C ATOM 382 C ARG A 27 20.750 -3.956 -24.079 1.00 0.00 C ATOM 383 O ARG A 27 21.901 -3.552 -24.266 1.00 0.00 O ATOM 384 CB ARG A 27 19.997 -6.309 -23.642 1.00 0.00 C ATOM 385 CG ARG A 27 21.222 -6.672 -22.820 1.00 0.00 C ATOM 386 CD ARG A 27 20.922 -7.804 -21.852 1.00 0.00 C ATOM 387 NE ARG A 27 22.085 -8.153 -21.037 1.00 0.00 N ATOM 388 CZ ARG A 27 22.378 -9.392 -20.649 1.00 0.00 C ATOM 389 NH1 ARG A 27 21.648 -10.419 -21.070 1.00 0.00 N ATOM 390 NH2 ARG A 27 23.423 -9.605 -19.862 1.00 0.00 N ATOM 0 H ARG A 27 22.192 -5.690 -25.406 1.00 0.00 H new ATOM 0 HA ARG A 27 19.324 -5.042 -25.235 1.00 0.00 H new ATOM 0 HB2 ARG A 27 19.217 -5.946 -22.972 1.00 0.00 H new ATOM 0 HB3 ARG A 27 19.613 -7.210 -24.120 1.00 0.00 H new ATOM 0 HG2 ARG A 27 22.035 -6.965 -23.485 1.00 0.00 H new ATOM 0 HG3 ARG A 27 21.563 -5.797 -22.266 1.00 0.00 H new ATOM 0 HD2 ARG A 27 20.097 -7.515 -21.201 1.00 0.00 H new ATOM 0 HD3 ARG A 27 20.595 -8.681 -22.410 1.00 0.00 H new ATOM 0 HE ARG A 27 22.710 -7.401 -20.748 1.00 0.00 H new ATOM 0 HH11 ARG A 27 20.857 -10.261 -21.695 1.00 0.00 H new ATOM 0 HH12 ARG A 27 21.878 -11.366 -20.769 1.00 0.00 H new ATOM 0 HH21 ARG A 27 23.999 -8.821 -19.556 1.00 0.00 H new ATOM 0 HH22 ARG A 27 23.651 -10.553 -19.562 1.00 0.00 H new ATOM 404 N TYR A 28 19.869 -3.319 -23.324 1.00 0.00 N ATOM 405 CA TYR A 28 20.157 -2.035 -22.703 1.00 0.00 C ATOM 406 C TYR A 28 20.398 -2.239 -21.207 1.00 0.00 C ATOM 407 O TYR A 28 19.490 -2.630 -20.477 1.00 0.00 O ATOM 408 CB TYR A 28 18.968 -1.097 -22.948 1.00 0.00 C ATOM 409 CG TYR A 28 19.273 0.378 -22.810 1.00 0.00 C ATOM 410 CD1 TYR A 28 20.414 0.931 -23.376 1.00 0.00 C ATOM 411 CD2 TYR A 28 18.402 1.222 -22.136 1.00 0.00 C ATOM 412 CE1 TYR A 28 20.680 2.283 -23.268 1.00 0.00 C ATOM 413 CE2 TYR A 28 18.662 2.574 -22.023 1.00 0.00 C ATOM 414 CZ TYR A 28 19.802 3.099 -22.590 1.00 0.00 C ATOM 415 OH TYR A 28 20.063 4.445 -22.480 1.00 0.00 O ATOM 0 H TYR A 28 18.935 -3.677 -23.124 1.00 0.00 H new ATOM 0 HA TYR A 28 21.054 -1.590 -23.134 1.00 0.00 H new ATOM 0 HB2 TYR A 28 18.582 -1.280 -23.951 1.00 0.00 H new ATOM 0 HB3 TYR A 28 18.173 -1.354 -22.249 1.00 0.00 H new ATOM 0 HD1 TYR A 28 21.105 0.294 -23.909 1.00 0.00 H new ATOM 0 HD2 TYR A 28 17.505 0.815 -21.692 1.00 0.00 H new ATOM 0 HE1 TYR A 28 21.572 2.698 -23.713 1.00 0.00 H new ATOM 0 HE2 TYR A 28 17.975 3.216 -21.493 1.00 0.00 H new ATOM 0 HH TYR A 28 20.908 4.576 -22.002 1.00 0.00 H new ATOM 425 N ILE A 29 21.621 -1.993 -20.753 1.00 0.00 N ATOM 426 CA ILE A 29 22.001 -2.309 -19.377 1.00 0.00 C ATOM 427 C ILE A 29 22.507 -1.081 -18.625 1.00 0.00 C ATOM 428 O ILE A 29 22.929 -0.101 -19.229 1.00 0.00 O ATOM 429 CB ILE A 29 23.061 -3.437 -19.326 1.00 0.00 C ATOM 430 CG1 ILE A 29 24.172 -3.211 -20.362 1.00 0.00 C ATOM 431 CG2 ILE A 29 22.401 -4.792 -19.539 1.00 0.00 C ATOM 432 CD1 ILE A 29 25.252 -2.244 -19.923 1.00 0.00 C ATOM 0 H ILE A 29 22.365 -1.577 -21.313 1.00 0.00 H new ATOM 0 HA ILE A 29 21.096 -2.659 -18.880 1.00 0.00 H new ATOM 0 HB ILE A 29 23.521 -3.420 -18.338 1.00 0.00 H new ATOM 0 HG12 ILE A 29 24.634 -4.170 -20.596 1.00 0.00 H new ATOM 0 HG13 ILE A 29 23.723 -2.840 -21.283 1.00 0.00 H new ATOM 0 HG21 ILE A 29 23.158 -5.575 -19.501 1.00 0.00 H new ATOM 0 HG22 ILE A 29 21.661 -4.963 -18.757 1.00 0.00 H new ATOM 0 HG23 ILE A 29 21.910 -4.809 -20.512 1.00 0.00 H new ATOM 0 HD11 ILE A 29 25.995 -2.144 -20.715 1.00 0.00 H new ATOM 0 HD12 ILE A 29 24.807 -1.270 -19.718 1.00 0.00 H new ATOM 0 HD13 ILE A 29 25.733 -2.621 -19.020 1.00 0.00 H new ATOM 444 N VAL A 30 22.464 -1.142 -17.300 1.00 0.00 N ATOM 445 CA VAL A 30 22.881 -0.016 -16.474 1.00 0.00 C ATOM 446 C VAL A 30 24.314 -0.206 -15.996 1.00 0.00 C ATOM 447 O VAL A 30 24.646 -1.229 -15.404 1.00 0.00 O ATOM 448 CB VAL A 30 21.963 0.170 -15.243 1.00 0.00 C ATOM 449 CG1 VAL A 30 22.317 1.449 -14.496 1.00 0.00 C ATOM 450 CG2 VAL A 30 20.498 0.175 -15.655 1.00 0.00 C ATOM 0 H VAL A 30 22.146 -1.957 -16.776 1.00 0.00 H new ATOM 0 HA VAL A 30 22.810 0.876 -17.097 1.00 0.00 H new ATOM 0 HB VAL A 30 22.122 -0.673 -14.571 1.00 0.00 H new ATOM 0 HG11 VAL A 30 21.659 1.561 -13.634 1.00 0.00 H new ATOM 0 HG12 VAL A 30 23.352 1.399 -14.159 1.00 0.00 H new ATOM 0 HG13 VAL A 30 22.193 2.304 -15.160 1.00 0.00 H new ATOM 0 HG21 VAL A 30 19.872 0.307 -14.772 1.00 0.00 H new ATOM 0 HG22 VAL A 30 20.319 0.993 -16.352 1.00 0.00 H new ATOM 0 HG23 VAL A 30 20.252 -0.772 -16.136 1.00 0.00 H new ATOM 460 N ARG A 31 25.156 0.777 -16.268 1.00 0.00 N ATOM 461 CA ARG A 31 26.536 0.763 -15.813 1.00 0.00 C ATOM 462 C ARG A 31 26.764 1.876 -14.798 1.00 0.00 C ATOM 463 O ARG A 31 26.231 2.974 -14.936 1.00 0.00 O ATOM 464 CB ARG A 31 27.499 0.941 -16.993 1.00 0.00 C ATOM 465 CG ARG A 31 27.526 -0.236 -17.955 1.00 0.00 C ATOM 466 CD ARG A 31 28.022 -1.504 -17.277 1.00 0.00 C ATOM 467 NE ARG A 31 29.359 -1.334 -16.704 1.00 0.00 N ATOM 468 CZ ARG A 31 29.768 -1.934 -15.583 1.00 0.00 C ATOM 469 NH1 ARG A 31 28.963 -2.779 -14.954 1.00 0.00 N ATOM 470 NH2 ARG A 31 30.987 -1.707 -15.107 1.00 0.00 N ATOM 0 H ARG A 31 24.903 1.604 -16.808 1.00 0.00 H new ATOM 0 HA ARG A 31 26.730 -0.202 -15.344 1.00 0.00 H new ATOM 0 HB2 ARG A 31 27.220 1.840 -17.543 1.00 0.00 H new ATOM 0 HB3 ARG A 31 28.505 1.103 -16.606 1.00 0.00 H new ATOM 0 HG2 ARG A 31 26.525 -0.404 -18.353 1.00 0.00 H new ATOM 0 HG3 ARG A 31 28.171 0.000 -18.802 1.00 0.00 H new ATOM 0 HD2 ARG A 31 27.324 -1.791 -16.490 1.00 0.00 H new ATOM 0 HD3 ARG A 31 28.039 -2.319 -18.001 1.00 0.00 H new ATOM 0 HE ARG A 31 30.016 -0.722 -17.189 1.00 0.00 H new ATOM 0 HH11 ARG A 31 28.033 -2.970 -15.326 1.00 0.00 H new ATOM 0 HH12 ARG A 31 29.274 -3.238 -14.098 1.00 0.00 H new ATOM 0 HH21 ARG A 31 31.616 -1.072 -15.598 1.00 0.00 H new ATOM 0 HH22 ARG A 31 31.294 -2.168 -14.250 1.00 0.00 H new ATOM 484 N PHE A 32 27.545 1.590 -13.774 1.00 0.00 N ATOM 485 CA PHE A 32 27.881 2.597 -12.778 1.00 0.00 C ATOM 486 C PHE A 32 29.309 3.071 -12.986 1.00 0.00 C ATOM 487 O PHE A 32 29.885 3.767 -12.150 1.00 0.00 O ATOM 488 CB PHE A 32 27.678 2.037 -11.371 1.00 0.00 C ATOM 489 CG PHE A 32 26.244 1.690 -11.097 1.00 0.00 C ATOM 490 CD1 PHE A 32 25.748 0.436 -11.414 1.00 0.00 C ATOM 491 CD2 PHE A 32 25.385 2.626 -10.544 1.00 0.00 C ATOM 492 CE1 PHE A 32 24.425 0.121 -11.181 1.00 0.00 C ATOM 493 CE2 PHE A 32 24.060 2.317 -10.312 1.00 0.00 C ATOM 494 CZ PHE A 32 23.580 1.062 -10.630 1.00 0.00 C ATOM 0 H PHE A 32 27.959 0.673 -13.608 1.00 0.00 H new ATOM 0 HA PHE A 32 27.218 3.455 -12.893 1.00 0.00 H new ATOM 0 HB2 PHE A 32 28.295 1.148 -11.244 1.00 0.00 H new ATOM 0 HB3 PHE A 32 28.019 2.769 -10.639 1.00 0.00 H new ATOM 0 HD1 PHE A 32 26.404 -0.304 -11.848 1.00 0.00 H new ATOM 0 HD2 PHE A 32 25.756 3.608 -10.292 1.00 0.00 H new ATOM 0 HE1 PHE A 32 24.051 -0.861 -11.430 1.00 0.00 H new ATOM 0 HE2 PHE A 32 23.400 3.056 -9.882 1.00 0.00 H new ATOM 0 HZ PHE A 32 22.544 0.817 -10.448 1.00 0.00 H new ATOM 504 N SER A 33 29.856 2.690 -14.129 1.00 0.00 N ATOM 505 CA SER A 33 31.194 3.081 -14.523 1.00 0.00 C ATOM 506 C SER A 33 31.186 3.497 -15.990 1.00 0.00 C ATOM 507 O SER A 33 31.065 2.650 -16.878 1.00 0.00 O ATOM 508 CB SER A 33 32.161 1.916 -14.305 1.00 0.00 C ATOM 509 OG SER A 33 32.035 1.394 -12.993 1.00 0.00 O ATOM 0 H SER A 33 29.380 2.099 -14.810 1.00 0.00 H new ATOM 0 HA SER A 33 31.524 3.924 -13.915 1.00 0.00 H new ATOM 0 HB2 SER A 33 31.961 1.131 -15.034 1.00 0.00 H new ATOM 0 HB3 SER A 33 33.185 2.252 -14.471 1.00 0.00 H new ATOM 0 HG SER A 33 32.661 0.649 -12.876 1.00 0.00 H new ATOM 515 N GLU A 34 31.287 4.796 -16.240 1.00 0.00 N ATOM 516 CA GLU A 34 31.232 5.331 -17.600 1.00 0.00 C ATOM 517 C GLU A 34 32.371 4.784 -18.456 1.00 0.00 C ATOM 518 O GLU A 34 32.222 4.589 -19.663 1.00 0.00 O ATOM 519 CB GLU A 34 31.309 6.857 -17.572 1.00 0.00 C ATOM 520 CG GLU A 34 30.198 7.516 -16.775 1.00 0.00 C ATOM 521 CD GLU A 34 30.355 9.020 -16.718 1.00 0.00 C ATOM 522 OE1 GLU A 34 29.897 9.708 -17.652 1.00 0.00 O ATOM 523 OE2 GLU A 34 30.951 9.524 -15.742 1.00 0.00 O ATOM 0 H GLU A 34 31.408 5.504 -15.516 1.00 0.00 H new ATOM 0 HA GLU A 34 30.285 5.019 -18.040 1.00 0.00 H new ATOM 0 HB2 GLU A 34 32.270 7.155 -17.152 1.00 0.00 H new ATOM 0 HB3 GLU A 34 31.279 7.231 -18.595 1.00 0.00 H new ATOM 0 HG2 GLU A 34 29.235 7.269 -17.223 1.00 0.00 H new ATOM 0 HG3 GLU A 34 30.191 7.114 -15.762 1.00 0.00 H new ATOM 530 N ASP A 35 33.494 4.494 -17.813 1.00 0.00 N ATOM 531 CA ASP A 35 34.707 4.087 -18.518 1.00 0.00 C ATOM 532 C ASP A 35 34.664 2.617 -18.931 1.00 0.00 C ATOM 533 O ASP A 35 35.691 2.041 -19.289 1.00 0.00 O ATOM 534 CB ASP A 35 35.945 4.331 -17.646 1.00 0.00 C ATOM 535 CG ASP A 35 36.143 5.791 -17.288 1.00 0.00 C ATOM 536 OD1 ASP A 35 36.824 6.508 -18.047 1.00 0.00 O ATOM 537 OD2 ASP A 35 35.625 6.224 -16.237 1.00 0.00 O ATOM 0 H ASP A 35 33.592 4.533 -16.799 1.00 0.00 H new ATOM 0 HA ASP A 35 34.766 4.694 -19.421 1.00 0.00 H new ATOM 0 HB2 ASP A 35 35.857 3.747 -16.730 1.00 0.00 H new ATOM 0 HB3 ASP A 35 36.829 3.969 -18.171 1.00 0.00 H new ATOM 542 N SER A 36 33.483 2.011 -18.904 1.00 0.00 N ATOM 543 CA SER A 36 33.349 0.619 -19.315 1.00 0.00 C ATOM 544 C SER A 36 32.886 0.537 -20.768 1.00 0.00 C ATOM 545 O SER A 36 32.813 -0.544 -21.351 1.00 0.00 O ATOM 546 CB SER A 36 32.390 -0.142 -18.388 1.00 0.00 C ATOM 547 OG SER A 36 31.114 0.476 -18.324 1.00 0.00 O ATOM 0 H SER A 36 32.614 2.455 -18.606 1.00 0.00 H new ATOM 0 HA SER A 36 34.327 0.144 -19.238 1.00 0.00 H new ATOM 0 HB2 SER A 36 32.280 -1.167 -18.742 1.00 0.00 H new ATOM 0 HB3 SER A 36 32.818 -0.195 -17.387 1.00 0.00 H new ATOM 0 HG SER A 36 31.071 1.057 -17.536 1.00 0.00 H new ATOM 553 N PHE A 37 32.571 1.694 -21.338 1.00 0.00 N ATOM 554 CA PHE A 37 32.209 1.798 -22.744 1.00 0.00 C ATOM 555 C PHE A 37 32.813 3.065 -23.333 1.00 0.00 C ATOM 556 O PHE A 37 32.526 4.167 -22.870 1.00 0.00 O ATOM 557 CB PHE A 37 30.686 1.821 -22.925 1.00 0.00 C ATOM 558 CG PHE A 37 30.015 0.499 -22.678 1.00 0.00 C ATOM 559 CD1 PHE A 37 30.013 -0.481 -23.657 1.00 0.00 C ATOM 560 CD2 PHE A 37 29.382 0.238 -21.473 1.00 0.00 C ATOM 561 CE1 PHE A 37 29.394 -1.697 -23.439 1.00 0.00 C ATOM 562 CE2 PHE A 37 28.761 -0.976 -21.250 1.00 0.00 C ATOM 563 CZ PHE A 37 28.767 -1.945 -22.234 1.00 0.00 C ATOM 0 H PHE A 37 32.560 2.584 -20.839 1.00 0.00 H new ATOM 0 HA PHE A 37 32.601 0.923 -23.264 1.00 0.00 H new ATOM 0 HB2 PHE A 37 30.262 2.563 -22.248 1.00 0.00 H new ATOM 0 HB3 PHE A 37 30.457 2.148 -23.939 1.00 0.00 H new ATOM 0 HD1 PHE A 37 30.501 -0.292 -24.602 1.00 0.00 H new ATOM 0 HD2 PHE A 37 29.374 0.992 -20.700 1.00 0.00 H new ATOM 0 HE1 PHE A 37 29.401 -2.453 -24.210 1.00 0.00 H new ATOM 0 HE2 PHE A 37 28.271 -1.167 -20.307 1.00 0.00 H new ATOM 0 HZ PHE A 37 28.282 -2.895 -22.061 1.00 0.00 H new ATOM 573 N GLY A 38 33.672 2.907 -24.328 1.00 0.00 N ATOM 574 CA GLY A 38 34.280 4.060 -24.963 1.00 0.00 C ATOM 575 C GLY A 38 33.612 4.402 -26.276 1.00 0.00 C ATOM 576 O GLY A 38 32.645 5.161 -26.314 1.00 0.00 O ATOM 0 H GLY A 38 33.959 2.005 -24.707 1.00 0.00 H new ATOM 0 HA2 GLY A 38 34.220 4.917 -24.292 1.00 0.00 H new ATOM 0 HA3 GLY A 38 35.338 3.863 -25.135 1.00 0.00 H new ATOM 580 N MET A 39 34.122 3.828 -27.353 1.00 0.00 N ATOM 581 CA MET A 39 33.552 4.043 -28.676 1.00 0.00 C ATOM 582 C MET A 39 32.792 2.802 -29.123 1.00 0.00 C ATOM 583 O MET A 39 32.383 2.687 -30.278 1.00 0.00 O ATOM 584 CB MET A 39 34.647 4.397 -29.689 1.00 0.00 C ATOM 585 CG MET A 39 35.720 3.331 -29.842 1.00 0.00 C ATOM 586 SD MET A 39 37.000 3.808 -31.020 1.00 0.00 S ATOM 587 CE MET A 39 38.115 2.410 -30.886 1.00 0.00 C ATOM 0 H MET A 39 34.932 3.208 -27.339 1.00 0.00 H new ATOM 0 HA MET A 39 32.857 4.881 -28.623 1.00 0.00 H new ATOM 0 HB2 MET A 39 34.185 4.574 -30.660 1.00 0.00 H new ATOM 0 HB3 MET A 39 35.119 5.331 -29.386 1.00 0.00 H new ATOM 0 HG2 MET A 39 36.177 3.137 -28.872 1.00 0.00 H new ATOM 0 HG3 MET A 39 35.259 2.399 -30.169 1.00 0.00 H new ATOM 0 HE1 MET A 39 38.962 2.555 -31.556 1.00 0.00 H new ATOM 0 HE2 MET A 39 38.474 2.328 -29.860 1.00 0.00 H new ATOM 0 HE3 MET A 39 37.588 1.496 -31.160 1.00 0.00 H new ATOM 597 N ASP A 40 32.590 1.886 -28.184 1.00 0.00 N ATOM 598 CA ASP A 40 31.885 0.636 -28.456 1.00 0.00 C ATOM 599 C ASP A 40 30.381 0.836 -28.358 1.00 0.00 C ATOM 600 O ASP A 40 29.612 -0.125 -28.370 1.00 0.00 O ATOM 601 CB ASP A 40 32.318 -0.451 -27.470 1.00 0.00 C ATOM 602 CG ASP A 40 33.795 -0.762 -27.550 1.00 0.00 C ATOM 603 OD1 ASP A 40 34.183 -1.651 -28.336 1.00 0.00 O ATOM 604 OD2 ASP A 40 34.579 -0.125 -26.816 1.00 0.00 O ATOM 0 H ASP A 40 32.907 1.985 -27.219 1.00 0.00 H new ATOM 0 HA ASP A 40 32.138 0.323 -29.469 1.00 0.00 H new ATOM 0 HB2 ASP A 40 32.073 -0.134 -26.456 1.00 0.00 H new ATOM 0 HB3 ASP A 40 31.749 -1.360 -27.666 1.00 0.00 H new ATOM 609 N VAL A 41 29.969 2.087 -28.249 1.00 0.00 N ATOM 610 CA VAL A 41 28.565 2.429 -28.154 1.00 0.00 C ATOM 611 C VAL A 41 28.383 3.907 -28.476 1.00 0.00 C ATOM 612 O VAL A 41 29.314 4.699 -28.312 1.00 0.00 O ATOM 613 CB VAL A 41 28.005 2.112 -26.743 1.00 0.00 C ATOM 614 CG1 VAL A 41 28.632 3.008 -25.686 1.00 0.00 C ATOM 615 CG2 VAL A 41 26.488 2.223 -26.717 1.00 0.00 C ATOM 0 H VAL A 41 30.598 2.890 -28.224 1.00 0.00 H new ATOM 0 HA VAL A 41 28.009 1.827 -28.873 1.00 0.00 H new ATOM 0 HB VAL A 41 28.271 1.082 -26.508 1.00 0.00 H new ATOM 0 HG11 VAL A 41 28.219 2.761 -24.708 1.00 0.00 H new ATOM 0 HG12 VAL A 41 29.711 2.855 -25.673 1.00 0.00 H new ATOM 0 HG13 VAL A 41 28.416 4.051 -25.918 1.00 0.00 H new ATOM 0 HG21 VAL A 41 26.124 1.995 -25.715 1.00 0.00 H new ATOM 0 HG22 VAL A 41 26.193 3.236 -26.989 1.00 0.00 H new ATOM 0 HG23 VAL A 41 26.059 1.517 -27.428 1.00 0.00 H new ATOM 625 N ALA A 42 27.211 4.269 -28.972 1.00 0.00 N ATOM 626 CA ALA A 42 26.897 5.663 -29.230 1.00 0.00 C ATOM 627 C ALA A 42 26.780 6.428 -27.918 1.00 0.00 C ATOM 628 O ALA A 42 26.233 5.915 -26.942 1.00 0.00 O ATOM 629 CB ALA A 42 25.609 5.778 -30.029 1.00 0.00 C ATOM 0 H ALA A 42 26.462 3.616 -29.204 1.00 0.00 H new ATOM 0 HA ALA A 42 27.706 6.099 -29.816 1.00 0.00 H new ATOM 0 HB1 ALA A 42 25.388 6.829 -30.214 1.00 0.00 H new ATOM 0 HB2 ALA A 42 25.723 5.259 -30.980 1.00 0.00 H new ATOM 0 HB3 ALA A 42 24.791 5.329 -29.467 1.00 0.00 H new ATOM 635 N ASP A 43 27.294 7.651 -27.900 1.00 0.00 N ATOM 636 CA ASP A 43 27.250 8.490 -26.703 1.00 0.00 C ATOM 637 C ASP A 43 25.810 8.760 -26.292 1.00 0.00 C ATOM 638 O ASP A 43 25.498 8.870 -25.107 1.00 0.00 O ATOM 639 CB ASP A 43 27.978 9.816 -26.937 1.00 0.00 C ATOM 640 CG ASP A 43 29.467 9.641 -27.161 1.00 0.00 C ATOM 641 OD1 ASP A 43 30.211 9.503 -26.169 1.00 0.00 O ATOM 642 OD2 ASP A 43 29.902 9.659 -28.335 1.00 0.00 O ATOM 0 H ASP A 43 27.748 8.088 -28.702 1.00 0.00 H new ATOM 0 HA ASP A 43 27.754 7.952 -25.900 1.00 0.00 H new ATOM 0 HB2 ASP A 43 27.542 10.316 -27.802 1.00 0.00 H new ATOM 0 HB3 ASP A 43 27.819 10.468 -26.078 1.00 0.00 H new ATOM 647 N ASP A 44 24.931 8.835 -27.286 1.00 0.00 N ATOM 648 CA ASP A 44 23.506 9.050 -27.047 1.00 0.00 C ATOM 649 C ASP A 44 22.877 7.834 -26.380 1.00 0.00 C ATOM 650 O ASP A 44 21.774 7.912 -25.840 1.00 0.00 O ATOM 651 CB ASP A 44 22.771 9.337 -28.360 1.00 0.00 C ATOM 652 CG ASP A 44 23.080 10.707 -28.925 1.00 0.00 C ATOM 653 OD1 ASP A 44 24.189 10.895 -29.463 1.00 0.00 O ATOM 654 OD2 ASP A 44 22.211 11.605 -28.835 1.00 0.00 O ATOM 0 H ASP A 44 25.182 8.750 -28.271 1.00 0.00 H new ATOM 0 HA ASP A 44 23.412 9.911 -26.385 1.00 0.00 H new ATOM 0 HB2 ASP A 44 23.041 8.578 -29.094 1.00 0.00 H new ATOM 0 HB3 ASP A 44 21.697 9.252 -28.194 1.00 0.00 H new ATOM 659 N SER A 45 23.579 6.712 -26.422 1.00 0.00 N ATOM 660 CA SER A 45 23.082 5.482 -25.836 1.00 0.00 C ATOM 661 C SER A 45 23.593 5.307 -24.410 1.00 0.00 C ATOM 662 O SER A 45 23.269 4.326 -23.749 1.00 0.00 O ATOM 663 CB SER A 45 23.470 4.289 -26.707 1.00 0.00 C ATOM 664 OG SER A 45 22.888 4.407 -27.995 1.00 0.00 O ATOM 0 H SER A 45 24.498 6.630 -26.858 1.00 0.00 H new ATOM 0 HA SER A 45 21.994 5.538 -25.790 1.00 0.00 H new ATOM 0 HB2 SER A 45 24.555 4.233 -26.795 1.00 0.00 H new ATOM 0 HB3 SER A 45 23.140 3.364 -26.235 1.00 0.00 H new ATOM 0 HG SER A 45 23.147 3.637 -28.543 1.00 0.00 H new ATOM 670 N ILE A 46 24.402 6.254 -23.947 1.00 0.00 N ATOM 671 CA ILE A 46 24.775 6.309 -22.542 1.00 0.00 C ATOM 672 C ILE A 46 24.011 7.447 -21.878 1.00 0.00 C ATOM 673 O ILE A 46 24.326 8.621 -22.073 1.00 0.00 O ATOM 674 CB ILE A 46 26.298 6.501 -22.325 1.00 0.00 C ATOM 675 CG1 ILE A 46 27.078 5.298 -22.871 1.00 0.00 C ATOM 676 CG2 ILE A 46 26.603 6.706 -20.845 1.00 0.00 C ATOM 677 CD1 ILE A 46 28.570 5.355 -22.592 1.00 0.00 C ATOM 0 H ILE A 46 24.810 6.990 -24.523 1.00 0.00 H new ATOM 0 HA ILE A 46 24.517 5.350 -22.093 1.00 0.00 H new ATOM 0 HB ILE A 46 26.613 7.390 -22.871 1.00 0.00 H new ATOM 0 HG12 ILE A 46 26.671 4.385 -22.435 1.00 0.00 H new ATOM 0 HG13 ILE A 46 26.922 5.234 -23.948 1.00 0.00 H new ATOM 0 HG21 ILE A 46 27.676 6.839 -20.710 1.00 0.00 H new ATOM 0 HG22 ILE A 46 26.079 7.591 -20.485 1.00 0.00 H new ATOM 0 HG23 ILE A 46 26.272 5.834 -20.281 1.00 0.00 H new ATOM 0 HD11 ILE A 46 29.052 4.471 -23.009 1.00 0.00 H new ATOM 0 HD12 ILE A 46 28.992 6.249 -23.051 1.00 0.00 H new ATOM 0 HD13 ILE A 46 28.738 5.387 -21.515 1.00 0.00 H new ATOM 689 N THR A 47 22.980 7.095 -21.133 1.00 0.00 N ATOM 690 CA THR A 47 22.110 8.081 -20.520 1.00 0.00 C ATOM 691 C THR A 47 21.935 7.801 -19.030 1.00 0.00 C ATOM 692 O THR A 47 21.545 6.700 -18.639 1.00 0.00 O ATOM 693 CB THR A 47 20.731 8.086 -21.211 1.00 0.00 C ATOM 694 OG1 THR A 47 20.907 8.185 -22.632 1.00 0.00 O ATOM 695 CG2 THR A 47 19.874 9.247 -20.721 1.00 0.00 C ATOM 0 H THR A 47 22.724 6.127 -20.937 1.00 0.00 H new ATOM 0 HA THR A 47 22.575 9.059 -20.640 1.00 0.00 H new ATOM 0 HB THR A 47 20.220 7.156 -20.963 1.00 0.00 H new ATOM 0 HG1 THR A 47 20.031 8.186 -23.071 1.00 0.00 H new ATOM 0 HG21 THR A 47 18.908 9.225 -21.226 1.00 0.00 H new ATOM 0 HG22 THR A 47 19.723 9.159 -19.645 1.00 0.00 H new ATOM 0 HG23 THR A 47 20.377 10.189 -20.941 1.00 0.00 H new ATOM 703 N PRO A 48 22.257 8.784 -18.176 1.00 0.00 N ATOM 704 CA PRO A 48 22.005 8.689 -16.739 1.00 0.00 C ATOM 705 C PRO A 48 20.530 8.431 -16.462 1.00 0.00 C ATOM 706 O PRO A 48 19.665 9.089 -17.038 1.00 0.00 O ATOM 707 CB PRO A 48 22.418 10.062 -16.200 1.00 0.00 C ATOM 708 CG PRO A 48 23.344 10.619 -17.225 1.00 0.00 C ATOM 709 CD PRO A 48 22.896 10.058 -18.546 1.00 0.00 C ATOM 0 HA PRO A 48 22.551 7.868 -16.274 1.00 0.00 H new ATOM 0 HB2 PRO A 48 21.551 10.707 -16.060 1.00 0.00 H new ATOM 0 HB3 PRO A 48 22.910 9.974 -15.231 1.00 0.00 H new ATOM 0 HG2 PRO A 48 23.307 11.708 -17.232 1.00 0.00 H new ATOM 0 HG3 PRO A 48 24.375 10.337 -17.012 1.00 0.00 H new ATOM 0 HD2 PRO A 48 22.198 10.726 -19.050 1.00 0.00 H new ATOM 0 HD3 PRO A 48 23.736 9.904 -19.223 1.00 0.00 H new ATOM 717 N THR A 49 20.245 7.482 -15.581 1.00 0.00 N ATOM 718 CA THR A 49 18.871 7.082 -15.305 1.00 0.00 C ATOM 719 C THR A 49 18.060 8.231 -14.701 1.00 0.00 C ATOM 720 O THR A 49 16.831 8.195 -14.705 1.00 0.00 O ATOM 721 CB THR A 49 18.812 5.853 -14.375 1.00 0.00 C ATOM 722 OG1 THR A 49 17.455 5.431 -14.194 1.00 0.00 O ATOM 723 CG2 THR A 49 19.435 6.160 -13.026 1.00 0.00 C ATOM 0 H THR A 49 20.948 6.974 -15.044 1.00 0.00 H new ATOM 0 HA THR A 49 18.427 6.811 -16.263 1.00 0.00 H new ATOM 0 HB THR A 49 19.380 5.050 -14.845 1.00 0.00 H new ATOM 0 HG1 THR A 49 16.852 6.180 -14.382 1.00 0.00 H new ATOM 0 HG21 THR A 49 19.380 5.276 -12.390 1.00 0.00 H new ATOM 0 HG22 THR A 49 20.478 6.444 -13.163 1.00 0.00 H new ATOM 0 HG23 THR A 49 18.895 6.981 -12.554 1.00 0.00 H new ATOM 731 N SER A 50 18.751 9.244 -14.191 1.00 0.00 N ATOM 732 CA SER A 50 18.097 10.434 -13.671 1.00 0.00 C ATOM 733 C SER A 50 17.332 11.139 -14.792 1.00 0.00 C ATOM 734 O SER A 50 16.169 11.500 -14.638 1.00 0.00 O ATOM 735 CB SER A 50 19.147 11.376 -13.085 1.00 0.00 C ATOM 736 OG SER A 50 20.188 10.641 -12.460 1.00 0.00 O ATOM 0 H SER A 50 19.769 9.262 -14.127 1.00 0.00 H new ATOM 0 HA SER A 50 17.393 10.147 -12.890 1.00 0.00 H new ATOM 0 HB2 SER A 50 19.561 12.003 -13.875 1.00 0.00 H new ATOM 0 HB3 SER A 50 18.680 12.043 -12.360 1.00 0.00 H new ATOM 0 HG SER A 50 19.905 10.372 -11.561 1.00 0.00 H new ATOM 742 N GLU A 51 18.003 11.310 -15.926 1.00 0.00 N ATOM 743 CA GLU A 51 17.410 11.956 -17.091 1.00 0.00 C ATOM 744 C GLU A 51 16.692 10.940 -17.970 1.00 0.00 C ATOM 745 O GLU A 51 15.873 11.303 -18.808 1.00 0.00 O ATOM 746 CB GLU A 51 18.489 12.672 -17.910 1.00 0.00 C ATOM 747 CG GLU A 51 18.886 14.038 -17.367 1.00 0.00 C ATOM 748 CD GLU A 51 19.428 13.986 -15.954 1.00 0.00 C ATOM 749 OE1 GLU A 51 20.370 13.206 -15.700 1.00 0.00 O ATOM 750 OE2 GLU A 51 18.915 14.727 -15.088 1.00 0.00 O ATOM 0 H GLU A 51 18.967 11.007 -16.063 1.00 0.00 H new ATOM 0 HA GLU A 51 16.683 12.686 -16.736 1.00 0.00 H new ATOM 0 HB2 GLU A 51 19.376 12.039 -17.952 1.00 0.00 H new ATOM 0 HB3 GLU A 51 18.133 12.791 -18.933 1.00 0.00 H new ATOM 0 HG2 GLU A 51 19.639 14.477 -18.022 1.00 0.00 H new ATOM 0 HG3 GLU A 51 18.018 14.697 -17.392 1.00 0.00 H new ATOM 757 N PHE A 52 17.003 9.667 -17.765 1.00 0.00 N ATOM 758 CA PHE A 52 16.425 8.587 -18.560 1.00 0.00 C ATOM 759 C PHE A 52 14.912 8.509 -18.366 1.00 0.00 C ATOM 760 O PHE A 52 14.183 8.047 -19.244 1.00 0.00 O ATOM 761 CB PHE A 52 17.077 7.252 -18.179 1.00 0.00 C ATOM 762 CG PHE A 52 16.596 6.083 -18.990 1.00 0.00 C ATOM 763 CD1 PHE A 52 16.855 6.019 -20.349 1.00 0.00 C ATOM 764 CD2 PHE A 52 15.886 5.049 -18.396 1.00 0.00 C ATOM 765 CE1 PHE A 52 16.416 4.949 -21.102 1.00 0.00 C ATOM 766 CE2 PHE A 52 15.445 3.977 -19.145 1.00 0.00 C ATOM 767 CZ PHE A 52 15.711 3.928 -20.499 1.00 0.00 C ATOM 0 H PHE A 52 17.658 9.353 -17.049 1.00 0.00 H new ATOM 0 HA PHE A 52 16.619 8.795 -19.612 1.00 0.00 H new ATOM 0 HB2 PHE A 52 18.157 7.341 -18.294 1.00 0.00 H new ATOM 0 HB3 PHE A 52 16.884 7.053 -17.125 1.00 0.00 H new ATOM 0 HD1 PHE A 52 17.407 6.816 -20.825 1.00 0.00 H new ATOM 0 HD2 PHE A 52 15.677 5.084 -17.337 1.00 0.00 H new ATOM 0 HE1 PHE A 52 16.624 4.911 -22.161 1.00 0.00 H new ATOM 0 HE2 PHE A 52 14.893 3.178 -18.673 1.00 0.00 H new ATOM 0 HZ PHE A 52 15.367 3.090 -21.086 1.00 0.00 H new ATOM 777 N VAL A 53 14.443 8.974 -17.218 1.00 0.00 N ATOM 778 CA VAL A 53 13.026 8.921 -16.906 1.00 0.00 C ATOM 779 C VAL A 53 12.299 10.154 -17.447 1.00 0.00 C ATOM 780 O VAL A 53 11.071 10.236 -17.388 1.00 0.00 O ATOM 781 CB VAL A 53 12.787 8.801 -15.382 1.00 0.00 C ATOM 782 CG1 VAL A 53 13.582 7.644 -14.801 1.00 0.00 C ATOM 783 CG2 VAL A 53 13.134 10.098 -14.665 1.00 0.00 C ATOM 0 H VAL A 53 15.023 9.391 -16.490 1.00 0.00 H new ATOM 0 HA VAL A 53 12.623 8.032 -17.390 1.00 0.00 H new ATOM 0 HB VAL A 53 11.726 8.604 -15.228 1.00 0.00 H new ATOM 0 HG11 VAL A 53 13.399 7.579 -13.729 1.00 0.00 H new ATOM 0 HG12 VAL A 53 13.274 6.714 -15.279 1.00 0.00 H new ATOM 0 HG13 VAL A 53 14.645 7.808 -14.978 1.00 0.00 H new ATOM 0 HG21 VAL A 53 12.955 9.982 -13.596 1.00 0.00 H new ATOM 0 HG22 VAL A 53 14.184 10.337 -14.834 1.00 0.00 H new ATOM 0 HG23 VAL A 53 12.511 10.905 -15.051 1.00 0.00 H new ATOM 793 N TRP A 54 13.064 11.101 -17.986 1.00 0.00 N ATOM 794 CA TRP A 54 12.502 12.348 -18.490 1.00 0.00 C ATOM 795 C TRP A 54 12.626 12.442 -20.004 1.00 0.00 C ATOM 796 O TRP A 54 13.727 12.425 -20.554 1.00 0.00 O ATOM 797 CB TRP A 54 13.196 13.555 -17.853 1.00 0.00 C ATOM 798 CG TRP A 54 12.962 13.672 -16.381 1.00 0.00 C ATOM 799 CD1 TRP A 54 13.881 13.503 -15.390 1.00 0.00 C ATOM 800 CD2 TRP A 54 11.723 13.978 -15.736 1.00 0.00 C ATOM 801 NE1 TRP A 54 13.291 13.688 -14.165 1.00 0.00 N ATOM 802 CE2 TRP A 54 11.964 13.979 -14.351 1.00 0.00 C ATOM 803 CE3 TRP A 54 10.432 14.250 -16.197 1.00 0.00 C ATOM 804 CZ2 TRP A 54 10.961 14.240 -13.423 1.00 0.00 C ATOM 805 CZ3 TRP A 54 9.438 14.512 -15.276 1.00 0.00 C ATOM 806 CH2 TRP A 54 9.707 14.504 -13.903 1.00 0.00 C ATOM 0 H TRP A 54 14.077 11.026 -18.084 1.00 0.00 H new ATOM 0 HA TRP A 54 11.445 12.354 -18.223 1.00 0.00 H new ATOM 0 HB2 TRP A 54 14.268 13.486 -18.038 1.00 0.00 H new ATOM 0 HB3 TRP A 54 12.846 14.464 -18.341 1.00 0.00 H new ATOM 0 HD1 TRP A 54 14.922 13.259 -15.546 1.00 0.00 H new ATOM 0 HE1 TRP A 54 13.763 13.620 -13.263 1.00 0.00 H new ATOM 0 HE3 TRP A 54 10.216 14.255 -17.255 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 11.165 14.234 -12.362 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 8.437 14.726 -15.620 1.00 0.00 H new ATOM 0 HH2 TRP A 54 8.908 14.711 -13.207 1.00 0.00 H new ATOM 817 N SER A 55 11.493 12.546 -20.673 1.00 0.00 N ATOM 818 CA SER A 55 11.476 12.739 -22.110 1.00 0.00 C ATOM 819 C SER A 55 11.241 14.212 -22.428 1.00 0.00 C ATOM 820 O SER A 55 10.188 14.767 -22.107 1.00 0.00 O ATOM 821 CB SER A 55 10.388 11.870 -22.751 1.00 0.00 C ATOM 822 OG SER A 55 10.390 11.990 -24.166 1.00 0.00 O ATOM 0 H SER A 55 10.570 12.500 -20.242 1.00 0.00 H new ATOM 0 HA SER A 55 12.439 12.438 -22.522 1.00 0.00 H new ATOM 0 HB2 SER A 55 10.544 10.827 -22.473 1.00 0.00 H new ATOM 0 HB3 SER A 55 9.412 12.161 -22.362 1.00 0.00 H new ATOM 0 HG SER A 55 9.686 11.422 -24.543 1.00 0.00 H new ATOM 828 N SER A 56 12.243 14.855 -23.014 1.00 0.00 N ATOM 829 CA SER A 56 12.120 16.243 -23.435 1.00 0.00 C ATOM 830 C SER A 56 11.116 16.360 -24.580 1.00 0.00 C ATOM 831 O SER A 56 11.318 15.787 -25.652 1.00 0.00 O ATOM 832 CB SER A 56 13.488 16.782 -23.862 1.00 0.00 C ATOM 833 OG SER A 56 14.099 15.923 -24.814 1.00 0.00 O ATOM 0 H SER A 56 13.152 14.435 -23.209 1.00 0.00 H new ATOM 0 HA SER A 56 11.757 16.838 -22.597 1.00 0.00 H new ATOM 0 HB2 SER A 56 13.373 17.779 -24.287 1.00 0.00 H new ATOM 0 HB3 SER A 56 14.133 16.880 -22.989 1.00 0.00 H new ATOM 0 HG SER A 56 13.419 15.584 -25.433 1.00 0.00 H new ATOM 839 N VAL A 57 10.028 17.082 -24.349 1.00 0.00 N ATOM 840 CA VAL A 57 8.987 17.216 -25.359 1.00 0.00 C ATOM 841 C VAL A 57 8.951 18.623 -25.943 1.00 0.00 C ATOM 842 O VAL A 57 8.193 18.894 -26.879 1.00 0.00 O ATOM 843 CB VAL A 57 7.595 16.857 -24.799 1.00 0.00 C ATOM 844 CG1 VAL A 57 7.527 15.379 -24.448 1.00 0.00 C ATOM 845 CG2 VAL A 57 7.261 17.711 -23.584 1.00 0.00 C ATOM 0 H VAL A 57 9.844 17.580 -23.478 1.00 0.00 H new ATOM 0 HA VAL A 57 9.236 16.511 -26.152 1.00 0.00 H new ATOM 0 HB VAL A 57 6.855 17.064 -25.572 1.00 0.00 H new ATOM 0 HG11 VAL A 57 6.538 15.144 -24.055 1.00 0.00 H new ATOM 0 HG12 VAL A 57 7.713 14.784 -25.342 1.00 0.00 H new ATOM 0 HG13 VAL A 57 8.281 15.149 -23.695 1.00 0.00 H new ATOM 0 HG21 VAL A 57 6.275 17.439 -23.208 1.00 0.00 H new ATOM 0 HG22 VAL A 57 8.005 17.543 -22.806 1.00 0.00 H new ATOM 0 HG23 VAL A 57 7.263 18.764 -23.867 1.00 0.00 H new ATOM 855 N ARG A 58 9.771 19.512 -25.393 1.00 0.00 N ATOM 856 CA ARG A 58 9.852 20.880 -25.881 1.00 0.00 C ATOM 857 C ARG A 58 11.108 21.555 -25.335 1.00 0.00 C ATOM 858 O ARG A 58 12.098 20.886 -25.041 1.00 0.00 O ATOM 859 CB ARG A 58 8.602 21.672 -25.475 1.00 0.00 C ATOM 860 CG ARG A 58 8.191 22.723 -26.497 1.00 0.00 C ATOM 861 CD ARG A 58 7.905 22.094 -27.849 1.00 0.00 C ATOM 862 NE ARG A 58 7.600 23.095 -28.867 1.00 0.00 N ATOM 863 CZ ARG A 58 6.492 23.081 -29.607 1.00 0.00 C ATOM 864 NH1 ARG A 58 5.573 22.144 -29.415 1.00 0.00 N ATOM 865 NH2 ARG A 58 6.299 24.003 -30.539 1.00 0.00 N ATOM 0 H ARG A 58 10.389 19.307 -24.608 1.00 0.00 H new ATOM 0 HA ARG A 58 9.906 20.860 -26.969 1.00 0.00 H new ATOM 0 HB2 ARG A 58 7.775 20.978 -25.326 1.00 0.00 H new ATOM 0 HB3 ARG A 58 8.786 22.160 -24.518 1.00 0.00 H new ATOM 0 HG2 ARG A 58 7.305 23.250 -26.144 1.00 0.00 H new ATOM 0 HG3 ARG A 58 8.984 23.464 -26.599 1.00 0.00 H new ATOM 0 HD2 ARG A 58 8.768 21.507 -28.165 1.00 0.00 H new ATOM 0 HD3 ARG A 58 7.066 21.404 -27.757 1.00 0.00 H new ATOM 0 HE ARG A 58 8.272 23.847 -29.020 1.00 0.00 H new ATOM 0 HH11 ARG A 58 5.713 21.431 -28.699 1.00 0.00 H new ATOM 0 HH12 ARG A 58 4.726 22.136 -29.983 1.00 0.00 H new ATOM 0 HH21 ARG A 58 7.000 24.728 -30.692 1.00 0.00 H new ATOM 0 HH22 ARG A 58 5.449 23.988 -31.103 1.00 0.00 H new ATOM 879 N ASP A 59 11.040 22.874 -25.186 1.00 0.00 N ATOM 880 CA ASP A 59 12.185 23.694 -24.804 1.00 0.00 C ATOM 881 C ASP A 59 12.786 23.265 -23.466 1.00 0.00 C ATOM 882 O ASP A 59 13.964 22.913 -23.392 1.00 0.00 O ATOM 883 CB ASP A 59 11.757 25.162 -24.744 1.00 0.00 C ATOM 884 CG ASP A 59 12.874 26.084 -24.306 1.00 0.00 C ATOM 885 OD1 ASP A 59 13.777 26.364 -25.124 1.00 0.00 O ATOM 886 OD2 ASP A 59 12.839 26.552 -23.151 1.00 0.00 O ATOM 0 H ASP A 59 10.183 23.408 -25.328 1.00 0.00 H new ATOM 0 HA ASP A 59 12.960 23.559 -25.558 1.00 0.00 H new ATOM 0 HB2 ASP A 59 11.401 25.472 -25.727 1.00 0.00 H new ATOM 0 HB3 ASP A 59 10.918 25.263 -24.055 1.00 0.00 H new ATOM 891 N ASP A 60 11.986 23.302 -22.411 1.00 0.00 N ATOM 892 CA ASP A 60 12.474 22.933 -21.086 1.00 0.00 C ATOM 893 C ASP A 60 11.580 21.876 -20.445 1.00 0.00 C ATOM 894 O ASP A 60 12.009 21.140 -19.556 1.00 0.00 O ATOM 895 CB ASP A 60 12.553 24.175 -20.192 1.00 0.00 C ATOM 896 CG ASP A 60 13.247 23.907 -18.871 1.00 0.00 C ATOM 897 OD1 ASP A 60 14.497 23.899 -18.845 1.00 0.00 O ATOM 898 OD2 ASP A 60 12.549 23.719 -17.853 1.00 0.00 O ATOM 0 H ASP A 60 11.005 23.581 -22.443 1.00 0.00 H new ATOM 0 HA ASP A 60 13.472 22.508 -21.196 1.00 0.00 H new ATOM 0 HB2 ASP A 60 13.085 24.965 -20.722 1.00 0.00 H new ATOM 0 HB3 ASP A 60 11.545 24.543 -19.999 1.00 0.00 H new ATOM 903 N VAL A 61 10.340 21.791 -20.913 1.00 0.00 N ATOM 904 CA VAL A 61 9.378 20.858 -20.344 1.00 0.00 C ATOM 905 C VAL A 61 9.708 19.410 -20.719 1.00 0.00 C ATOM 906 O VAL A 61 9.852 19.059 -21.897 1.00 0.00 O ATOM 907 CB VAL A 61 7.925 21.206 -20.759 1.00 0.00 C ATOM 908 CG1 VAL A 61 7.749 21.162 -22.266 1.00 0.00 C ATOM 909 CG2 VAL A 61 6.929 20.281 -20.075 1.00 0.00 C ATOM 0 H VAL A 61 9.979 22.355 -21.682 1.00 0.00 H new ATOM 0 HA VAL A 61 9.451 20.954 -19.261 1.00 0.00 H new ATOM 0 HB VAL A 61 7.728 22.227 -20.432 1.00 0.00 H new ATOM 0 HG11 VAL A 61 6.719 21.411 -22.519 1.00 0.00 H new ATOM 0 HG12 VAL A 61 8.422 21.882 -22.732 1.00 0.00 H new ATOM 0 HG13 VAL A 61 7.980 20.161 -22.630 1.00 0.00 H new ATOM 0 HG21 VAL A 61 5.917 20.545 -20.382 1.00 0.00 H new ATOM 0 HG22 VAL A 61 7.137 19.249 -20.359 1.00 0.00 H new ATOM 0 HG23 VAL A 61 7.019 20.385 -18.994 1.00 0.00 H new ATOM 919 N MET A 62 9.862 18.585 -19.698 1.00 0.00 N ATOM 920 CA MET A 62 10.097 17.163 -19.877 1.00 0.00 C ATOM 921 C MET A 62 8.936 16.386 -19.270 1.00 0.00 C ATOM 922 O MET A 62 8.247 16.895 -18.387 1.00 0.00 O ATOM 923 CB MET A 62 11.411 16.748 -19.208 1.00 0.00 C ATOM 924 CG MET A 62 12.622 17.526 -19.700 1.00 0.00 C ATOM 925 SD MET A 62 14.148 17.034 -18.875 1.00 0.00 S ATOM 926 CE MET A 62 15.312 18.184 -19.604 1.00 0.00 C ATOM 0 H MET A 62 9.828 18.882 -18.723 1.00 0.00 H new ATOM 0 HA MET A 62 10.171 16.943 -20.942 1.00 0.00 H new ATOM 0 HB2 MET A 62 11.318 16.882 -18.130 1.00 0.00 H new ATOM 0 HB3 MET A 62 11.578 15.685 -19.383 1.00 0.00 H new ATOM 0 HG2 MET A 62 12.731 17.379 -20.775 1.00 0.00 H new ATOM 0 HG3 MET A 62 12.454 18.591 -19.539 1.00 0.00 H new ATOM 0 HE1 MET A 62 16.306 18.005 -19.193 1.00 0.00 H new ATOM 0 HE2 MET A 62 15.335 18.042 -20.684 1.00 0.00 H new ATOM 0 HE3 MET A 62 15.004 19.205 -19.379 1.00 0.00 H new ATOM 936 N ARG A 63 8.702 15.176 -19.749 1.00 0.00 N ATOM 937 CA ARG A 63 7.621 14.353 -19.226 1.00 0.00 C ATOM 938 C ARG A 63 8.164 13.043 -18.665 1.00 0.00 C ATOM 939 O ARG A 63 9.165 12.518 -19.154 1.00 0.00 O ATOM 940 CB ARG A 63 6.585 14.075 -20.315 1.00 0.00 C ATOM 941 CG ARG A 63 5.975 15.333 -20.907 1.00 0.00 C ATOM 942 CD ARG A 63 4.923 15.011 -21.954 1.00 0.00 C ATOM 943 NE ARG A 63 3.778 14.302 -21.385 1.00 0.00 N ATOM 944 CZ ARG A 63 2.521 14.745 -21.451 1.00 0.00 C ATOM 945 NH1 ARG A 63 2.242 15.892 -22.059 1.00 0.00 N ATOM 946 NH2 ARG A 63 1.537 14.039 -20.911 1.00 0.00 N ATOM 0 H ARG A 63 9.243 14.741 -20.497 1.00 0.00 H new ATOM 0 HA ARG A 63 7.137 14.900 -18.417 1.00 0.00 H new ATOM 0 HB2 ARG A 63 7.054 13.498 -21.112 1.00 0.00 H new ATOM 0 HB3 ARG A 63 5.790 13.456 -19.899 1.00 0.00 H new ATOM 0 HG2 ARG A 63 5.526 15.928 -20.112 1.00 0.00 H new ATOM 0 HG3 ARG A 63 6.760 15.941 -21.356 1.00 0.00 H new ATOM 0 HD2 ARG A 63 4.581 15.935 -22.420 1.00 0.00 H new ATOM 0 HD3 ARG A 63 5.370 14.404 -22.741 1.00 0.00 H new ATOM 0 HE ARG A 63 3.950 13.416 -20.909 1.00 0.00 H new ATOM 0 HH11 ARG A 63 2.991 16.441 -22.480 1.00 0.00 H new ATOM 0 HH12 ARG A 63 1.279 16.224 -22.105 1.00 0.00 H new ATOM 0 HH21 ARG A 63 1.740 13.155 -20.444 1.00 0.00 H new ATOM 0 HH22 ARG A 63 0.577 14.380 -20.963 1.00 0.00 H new ATOM 960 N LEU A 64 7.505 12.533 -17.631 1.00 0.00 N ATOM 961 CA LEU A 64 7.932 11.309 -16.960 1.00 0.00 C ATOM 962 C LEU A 64 7.469 10.086 -17.752 1.00 0.00 C ATOM 963 O LEU A 64 6.276 9.927 -18.019 1.00 0.00 O ATOM 964 CB LEU A 64 7.353 11.279 -15.533 1.00 0.00 C ATOM 965 CG LEU A 64 8.081 10.390 -14.507 1.00 0.00 C ATOM 966 CD1 LEU A 64 7.938 8.912 -14.837 1.00 0.00 C ATOM 967 CD2 LEU A 64 9.549 10.774 -14.417 1.00 0.00 C ATOM 0 H LEU A 64 6.664 12.953 -17.235 1.00 0.00 H new ATOM 0 HA LEU A 64 9.020 11.288 -16.903 1.00 0.00 H new ATOM 0 HB2 LEU A 64 7.340 12.299 -15.150 1.00 0.00 H new ATOM 0 HB3 LEU A 64 6.316 10.948 -15.594 1.00 0.00 H new ATOM 0 HG LEU A 64 7.611 10.557 -13.538 1.00 0.00 H new ATOM 0 HD11 LEU A 64 8.466 8.320 -14.089 1.00 0.00 H new ATOM 0 HD12 LEU A 64 6.883 8.640 -14.837 1.00 0.00 H new ATOM 0 HD13 LEU A 64 8.363 8.716 -15.821 1.00 0.00 H new ATOM 0 HD21 LEU A 64 10.048 10.136 -13.688 1.00 0.00 H new ATOM 0 HD22 LEU A 64 10.019 10.647 -15.392 1.00 0.00 H new ATOM 0 HD23 LEU A 64 9.634 11.815 -14.107 1.00 0.00 H new ATOM 979 N GLY A 65 8.414 9.236 -18.129 1.00 0.00 N ATOM 980 CA GLY A 65 8.079 8.023 -18.853 1.00 0.00 C ATOM 981 C GLY A 65 8.034 6.805 -17.947 1.00 0.00 C ATOM 982 O GLY A 65 9.031 6.462 -17.313 1.00 0.00 O ATOM 0 H GLY A 65 9.409 9.364 -17.947 1.00 0.00 H new ATOM 0 HA2 GLY A 65 7.111 8.148 -19.339 1.00 0.00 H new ATOM 0 HA3 GLY A 65 8.813 7.859 -19.642 1.00 0.00 H new ATOM 986 N ARG A 66 6.876 6.151 -17.886 1.00 0.00 N ATOM 987 CA ARG A 66 6.687 4.979 -17.027 1.00 0.00 C ATOM 988 C ARG A 66 7.508 3.785 -17.516 1.00 0.00 C ATOM 989 O ARG A 66 7.750 2.837 -16.769 1.00 0.00 O ATOM 990 CB ARG A 66 5.208 4.587 -16.971 1.00 0.00 C ATOM 991 CG ARG A 66 4.668 4.044 -18.286 1.00 0.00 C ATOM 992 CD ARG A 66 3.179 3.763 -18.199 1.00 0.00 C ATOM 993 NE ARG A 66 2.420 4.972 -17.895 1.00 0.00 N ATOM 994 CZ ARG A 66 1.147 4.981 -17.507 1.00 0.00 C ATOM 995 NH1 ARG A 66 0.466 3.846 -17.396 1.00 0.00 N ATOM 996 NH2 ARG A 66 0.555 6.130 -17.227 1.00 0.00 N ATOM 0 H ARG A 66 6.049 6.413 -18.423 1.00 0.00 H new ATOM 0 HA ARG A 66 7.031 5.251 -16.029 1.00 0.00 H new ATOM 0 HB2 ARG A 66 5.070 3.835 -16.194 1.00 0.00 H new ATOM 0 HB3 ARG A 66 4.621 5.458 -16.680 1.00 0.00 H new ATOM 0 HG2 ARG A 66 4.858 4.762 -19.084 1.00 0.00 H new ATOM 0 HG3 ARG A 66 5.198 3.128 -18.548 1.00 0.00 H new ATOM 0 HD2 ARG A 66 2.832 3.343 -19.143 1.00 0.00 H new ATOM 0 HD3 ARG A 66 2.994 3.014 -17.429 1.00 0.00 H new ATOM 0 HE ARG A 66 2.897 5.869 -17.986 1.00 0.00 H new ATOM 0 HH11 ARG A 66 0.918 2.957 -17.609 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -0.509 3.863 -17.098 1.00 0.00 H new ATOM 0 HH21 ARG A 66 1.074 7.004 -17.309 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -0.421 6.142 -16.929 1.00 0.00 H new ATOM 1010 N GLU A 67 7.931 3.841 -18.771 1.00 0.00 N ATOM 1011 CA GLU A 67 8.664 2.743 -19.392 1.00 0.00 C ATOM 1012 C GLU A 67 9.981 2.470 -18.678 1.00 0.00 C ATOM 1013 O GLU A 67 10.500 1.355 -18.729 1.00 0.00 O ATOM 1014 CB GLU A 67 8.910 3.055 -20.863 1.00 0.00 C ATOM 1015 CG GLU A 67 7.622 3.225 -21.639 1.00 0.00 C ATOM 1016 CD GLU A 67 7.852 3.600 -23.084 1.00 0.00 C ATOM 1017 OE1 GLU A 67 7.957 4.811 -23.375 1.00 0.00 O ATOM 1018 OE2 GLU A 67 7.921 2.691 -23.932 1.00 0.00 O ATOM 0 H GLU A 67 7.778 4.641 -19.385 1.00 0.00 H new ATOM 0 HA GLU A 67 8.057 1.841 -19.310 1.00 0.00 H new ATOM 0 HB2 GLU A 67 9.503 3.966 -20.944 1.00 0.00 H new ATOM 0 HB3 GLU A 67 9.497 2.252 -21.309 1.00 0.00 H new ATOM 0 HG2 GLU A 67 7.052 2.297 -21.596 1.00 0.00 H new ATOM 0 HG3 GLU A 67 7.015 3.994 -21.161 1.00 0.00 H new ATOM 1025 N GLN A 68 10.503 3.486 -17.999 1.00 0.00 N ATOM 1026 CA GLN A 68 11.759 3.354 -17.265 1.00 0.00 C ATOM 1027 C GLN A 68 11.676 2.215 -16.245 1.00 0.00 C ATOM 1028 O GLN A 68 12.619 1.439 -16.097 1.00 0.00 O ATOM 1029 CB GLN A 68 12.141 4.685 -16.586 1.00 0.00 C ATOM 1030 CG GLN A 68 11.154 5.176 -15.535 1.00 0.00 C ATOM 1031 CD GLN A 68 11.610 4.904 -14.111 1.00 0.00 C ATOM 1032 OE1 GLN A 68 12.306 3.932 -13.839 1.00 0.00 O ATOM 1033 NE2 GLN A 68 11.221 5.773 -13.193 1.00 0.00 N ATOM 0 H GLN A 68 10.077 4.411 -17.941 1.00 0.00 H new ATOM 0 HA GLN A 68 12.546 3.107 -17.978 1.00 0.00 H new ATOM 0 HB2 GLN A 68 13.119 4.570 -16.119 1.00 0.00 H new ATOM 0 HB3 GLN A 68 12.243 5.452 -17.354 1.00 0.00 H new ATOM 0 HG2 GLN A 68 11.001 6.248 -15.662 1.00 0.00 H new ATOM 0 HG3 GLN A 68 10.190 4.695 -15.699 1.00 0.00 H new ATOM 0 HE21 GLN A 68 10.642 6.570 -13.458 1.00 0.00 H new ATOM 0 HE22 GLN A 68 11.500 5.646 -12.220 1.00 0.00 H new ATOM 1042 N LEU A 69 10.524 2.084 -15.584 1.00 0.00 N ATOM 1043 CA LEU A 69 10.340 1.049 -14.571 1.00 0.00 C ATOM 1044 C LEU A 69 10.387 -0.336 -15.202 1.00 0.00 C ATOM 1045 O LEU A 69 10.914 -1.281 -14.615 1.00 0.00 O ATOM 1046 CB LEU A 69 9.010 1.218 -13.821 1.00 0.00 C ATOM 1047 CG LEU A 69 8.891 2.459 -12.930 1.00 0.00 C ATOM 1048 CD1 LEU A 69 8.398 3.657 -13.724 1.00 0.00 C ATOM 1049 CD2 LEU A 69 7.965 2.182 -11.759 1.00 0.00 C ATOM 0 H LEU A 69 9.710 2.680 -15.733 1.00 0.00 H new ATOM 0 HA LEU A 69 11.157 1.153 -13.857 1.00 0.00 H new ATOM 0 HB2 LEU A 69 8.204 1.243 -14.554 1.00 0.00 H new ATOM 0 HB3 LEU A 69 8.851 0.335 -13.202 1.00 0.00 H new ATOM 0 HG LEU A 69 9.883 2.695 -12.545 1.00 0.00 H new ATOM 0 HD11 LEU A 69 8.323 4.523 -13.067 1.00 0.00 H new ATOM 0 HD12 LEU A 69 9.099 3.873 -14.530 1.00 0.00 H new ATOM 0 HD13 LEU A 69 7.418 3.436 -14.146 1.00 0.00 H new ATOM 0 HD21 LEU A 69 7.891 3.073 -11.135 1.00 0.00 H new ATOM 0 HD22 LEU A 69 6.976 1.917 -12.132 1.00 0.00 H new ATOM 0 HD23 LEU A 69 8.363 1.357 -11.168 1.00 0.00 H new ATOM 1061 N GLN A 70 9.847 -0.448 -16.408 1.00 0.00 N ATOM 1062 CA GLN A 70 9.779 -1.732 -17.088 1.00 0.00 C ATOM 1063 C GLN A 70 11.151 -2.157 -17.584 1.00 0.00 C ATOM 1064 O GLN A 70 11.453 -3.345 -17.666 1.00 0.00 O ATOM 1065 CB GLN A 70 8.799 -1.684 -18.256 1.00 0.00 C ATOM 1066 CG GLN A 70 7.383 -1.314 -17.846 1.00 0.00 C ATOM 1067 CD GLN A 70 6.366 -1.535 -18.951 1.00 0.00 C ATOM 1068 OE1 GLN A 70 6.557 -2.576 -19.750 1.00 0.00 O flip ATOM 1069 NE2 GLN A 70 5.391 -0.790 -19.065 1.00 0.00 N flip ATOM 0 H GLN A 70 9.451 0.332 -16.933 1.00 0.00 H new ATOM 0 HA GLN A 70 9.423 -2.466 -16.365 1.00 0.00 H new ATOM 0 HB2 GLN A 70 9.156 -0.962 -18.990 1.00 0.00 H new ATOM 0 HB3 GLN A 70 8.784 -2.657 -18.747 1.00 0.00 H new ATOM 0 HG2 GLN A 70 7.098 -1.903 -16.975 1.00 0.00 H new ATOM 0 HG3 GLN A 70 7.361 -0.267 -17.544 1.00 0.00 H new ATOM 0 HE21 GLN A 70 5.277 0.002 -18.432 1.00 0.00 H new ATOM 0 HE22 GLN A 70 4.698 -0.965 -19.793 1.00 0.00 H new ATOM 1078 N ILE A 71 11.978 -1.189 -17.922 1.00 0.00 N ATOM 1079 CA ILE A 71 13.328 -1.484 -18.361 1.00 0.00 C ATOM 1080 C ILE A 71 14.189 -1.897 -17.172 1.00 0.00 C ATOM 1081 O ILE A 71 14.944 -2.866 -17.245 1.00 0.00 O ATOM 1082 CB ILE A 71 13.960 -0.276 -19.089 1.00 0.00 C ATOM 1083 CG1 ILE A 71 13.120 0.077 -20.321 1.00 0.00 C ATOM 1084 CG2 ILE A 71 15.399 -0.579 -19.488 1.00 0.00 C ATOM 1085 CD1 ILE A 71 13.625 1.277 -21.092 1.00 0.00 C ATOM 0 H ILE A 71 11.742 -0.197 -17.902 1.00 0.00 H new ATOM 0 HA ILE A 71 13.279 -2.311 -19.069 1.00 0.00 H new ATOM 0 HB ILE A 71 13.974 0.578 -18.412 1.00 0.00 H new ATOM 0 HG12 ILE A 71 13.094 -0.785 -20.988 1.00 0.00 H new ATOM 0 HG13 ILE A 71 12.094 0.267 -20.005 1.00 0.00 H new ATOM 0 HG21 ILE A 71 15.824 0.285 -19.999 1.00 0.00 H new ATOM 0 HG22 ILE A 71 15.986 -0.798 -18.596 1.00 0.00 H new ATOM 0 HG23 ILE A 71 15.418 -1.441 -20.155 1.00 0.00 H new ATOM 0 HD11 ILE A 71 12.975 1.459 -21.948 1.00 0.00 H new ATOM 0 HD12 ILE A 71 13.625 2.153 -20.443 1.00 0.00 H new ATOM 0 HD13 ILE A 71 14.639 1.085 -21.441 1.00 0.00 H new ATOM 1097 N LEU A 72 14.036 -1.183 -16.062 1.00 0.00 N ATOM 1098 CA LEU A 72 14.833 -1.446 -14.869 1.00 0.00 C ATOM 1099 C LEU A 72 14.500 -2.799 -14.235 1.00 0.00 C ATOM 1100 O LEU A 72 15.364 -3.419 -13.610 1.00 0.00 O ATOM 1101 CB LEU A 72 14.652 -0.325 -13.844 1.00 0.00 C ATOM 1102 CG LEU A 72 15.069 1.067 -14.324 1.00 0.00 C ATOM 1103 CD1 LEU A 72 14.977 2.074 -13.190 1.00 0.00 C ATOM 1104 CD2 LEU A 72 16.476 1.038 -14.903 1.00 0.00 C ATOM 0 H LEU A 72 13.368 -0.418 -15.963 1.00 0.00 H new ATOM 0 HA LEU A 72 15.876 -1.481 -15.184 1.00 0.00 H new ATOM 0 HB2 LEU A 72 13.604 -0.291 -13.547 1.00 0.00 H new ATOM 0 HB3 LEU A 72 15.228 -0.573 -12.952 1.00 0.00 H new ATOM 0 HG LEU A 72 14.383 1.376 -15.113 1.00 0.00 H new ATOM 0 HD11 LEU A 72 15.278 3.057 -13.551 1.00 0.00 H new ATOM 0 HD12 LEU A 72 13.951 2.119 -12.826 1.00 0.00 H new ATOM 0 HD13 LEU A 72 15.637 1.769 -12.378 1.00 0.00 H new ATOM 0 HD21 LEU A 72 16.752 2.038 -15.238 1.00 0.00 H new ATOM 0 HD22 LEU A 72 17.177 0.705 -14.138 1.00 0.00 H new ATOM 0 HD23 LEU A 72 16.508 0.350 -15.748 1.00 0.00 H new ATOM 1116 N LEU A 73 13.266 -3.273 -14.408 1.00 0.00 N ATOM 1117 CA LEU A 73 12.854 -4.539 -13.798 1.00 0.00 C ATOM 1118 C LEU A 73 13.623 -5.715 -14.401 1.00 0.00 C ATOM 1119 O LEU A 73 13.806 -6.745 -13.750 1.00 0.00 O ATOM 1120 CB LEU A 73 11.325 -4.753 -13.896 1.00 0.00 C ATOM 1121 CG LEU A 73 10.724 -4.933 -15.300 1.00 0.00 C ATOM 1122 CD1 LEU A 73 10.916 -6.353 -15.815 1.00 0.00 C ATOM 1123 CD2 LEU A 73 9.244 -4.586 -15.287 1.00 0.00 C ATOM 0 H LEU A 73 12.543 -2.808 -14.957 1.00 0.00 H new ATOM 0 HA LEU A 73 13.102 -4.487 -12.738 1.00 0.00 H new ATOM 0 HB2 LEU A 73 11.069 -5.632 -13.305 1.00 0.00 H new ATOM 0 HB3 LEU A 73 10.835 -3.900 -13.427 1.00 0.00 H new ATOM 0 HG LEU A 73 11.251 -4.256 -15.973 1.00 0.00 H new ATOM 0 HD11 LEU A 73 10.478 -6.442 -16.809 1.00 0.00 H new ATOM 0 HD12 LEU A 73 11.981 -6.581 -15.865 1.00 0.00 H new ATOM 0 HD13 LEU A 73 10.426 -7.054 -15.139 1.00 0.00 H new ATOM 0 HD21 LEU A 73 8.831 -4.718 -16.287 1.00 0.00 H new ATOM 0 HD22 LEU A 73 8.723 -5.242 -14.590 1.00 0.00 H new ATOM 0 HD23 LEU A 73 9.116 -3.549 -14.975 1.00 0.00 H new ATOM 1135 N GLU A 74 14.077 -5.554 -15.643 1.00 0.00 N ATOM 1136 CA GLU A 74 14.851 -6.593 -16.316 1.00 0.00 C ATOM 1137 C GLU A 74 16.309 -6.551 -15.876 1.00 0.00 C ATOM 1138 O GLU A 74 17.051 -7.520 -16.045 1.00 0.00 O ATOM 1139 CB GLU A 74 14.770 -6.437 -17.835 1.00 0.00 C ATOM 1140 CG GLU A 74 13.416 -6.794 -18.422 1.00 0.00 C ATOM 1141 CD GLU A 74 13.411 -6.730 -19.935 1.00 0.00 C ATOM 1142 OE1 GLU A 74 14.346 -7.279 -20.556 1.00 0.00 O ATOM 1143 OE2 GLU A 74 12.484 -6.123 -20.510 1.00 0.00 O ATOM 0 H GLU A 74 13.922 -4.715 -16.202 1.00 0.00 H new ATOM 0 HA GLU A 74 14.423 -7.556 -16.037 1.00 0.00 H new ATOM 0 HB2 GLU A 74 15.008 -5.406 -18.097 1.00 0.00 H new ATOM 0 HB3 GLU A 74 15.531 -7.066 -18.296 1.00 0.00 H new ATOM 0 HG2 GLU A 74 13.137 -7.798 -18.102 1.00 0.00 H new ATOM 0 HG3 GLU A 74 12.661 -6.113 -18.029 1.00 0.00 H new ATOM 1150 N GLN A 75 16.711 -5.427 -15.302 1.00 0.00 N ATOM 1151 CA GLN A 75 18.085 -5.247 -14.858 1.00 0.00 C ATOM 1152 C GLN A 75 18.285 -5.947 -13.520 1.00 0.00 C ATOM 1153 O GLN A 75 19.349 -6.503 -13.251 1.00 0.00 O ATOM 1154 CB GLN A 75 18.410 -3.755 -14.733 1.00 0.00 C ATOM 1155 CG GLN A 75 17.831 -2.914 -15.862 1.00 0.00 C ATOM 1156 CD GLN A 75 18.359 -3.298 -17.230 1.00 0.00 C ATOM 1157 OE1 GLN A 75 19.375 -2.590 -17.687 1.00 0.00 O flip ATOM 1158 NE2 GLN A 75 17.841 -4.203 -17.883 1.00 0.00 N flip ATOM 0 H GLN A 75 16.104 -4.625 -15.133 1.00 0.00 H new ATOM 0 HA GLN A 75 18.760 -5.686 -15.593 1.00 0.00 H new ATOM 0 HB2 GLN A 75 18.027 -3.386 -13.782 1.00 0.00 H new ATOM 0 HB3 GLN A 75 19.492 -3.627 -14.712 1.00 0.00 H new ATOM 0 HG2 GLN A 75 16.745 -3.013 -15.859 1.00 0.00 H new ATOM 0 HG3 GLN A 75 18.056 -1.864 -15.675 1.00 0.00 H new ATOM 0 HE21 GLN A 75 17.057 -4.728 -17.495 1.00 0.00 H new ATOM 0 HE22 GLN A 75 18.196 -4.429 -18.812 1.00 0.00 H new ATOM 1167 N ASN A 76 17.241 -5.897 -12.686 1.00 0.00 N ATOM 1168 CA ASN A 76 17.206 -6.600 -11.395 1.00 0.00 C ATOM 1169 C ASN A 76 18.224 -6.040 -10.404 1.00 0.00 C ATOM 1170 O ASN A 76 18.448 -6.616 -9.338 1.00 0.00 O ATOM 1171 CB ASN A 76 17.426 -8.109 -11.578 1.00 0.00 C ATOM 1172 CG ASN A 76 16.248 -8.799 -12.241 1.00 0.00 C ATOM 1173 OD1 ASN A 76 15.308 -9.226 -11.572 1.00 0.00 O ATOM 1174 ND2 ASN A 76 16.293 -8.927 -13.558 1.00 0.00 N ATOM 0 H ASN A 76 16.393 -5.367 -12.886 1.00 0.00 H new ATOM 0 HA ASN A 76 16.212 -6.436 -10.980 1.00 0.00 H new ATOM 0 HB2 ASN A 76 18.321 -8.271 -12.179 1.00 0.00 H new ATOM 0 HB3 ASN A 76 17.608 -8.566 -10.605 1.00 0.00 H new ATOM 0 HD21 ASN A 76 15.531 -9.393 -14.051 1.00 0.00 H new ATOM 0 HD22 ASN A 76 17.089 -8.560 -14.079 1.00 0.00 H new ATOM 1181 N ILE A 77 18.817 -4.905 -10.742 1.00 0.00 N ATOM 1182 CA ILE A 77 19.803 -4.269 -9.880 1.00 0.00 C ATOM 1183 C ILE A 77 19.200 -3.050 -9.189 1.00 0.00 C ATOM 1184 O ILE A 77 19.851 -2.019 -9.016 1.00 0.00 O ATOM 1185 CB ILE A 77 21.076 -3.882 -10.672 1.00 0.00 C ATOM 1186 CG1 ILE A 77 20.739 -3.029 -11.902 1.00 0.00 C ATOM 1187 CG2 ILE A 77 21.829 -5.134 -11.089 1.00 0.00 C ATOM 1188 CD1 ILE A 77 21.057 -1.559 -11.732 1.00 0.00 C ATOM 0 H ILE A 77 18.632 -4.403 -11.611 1.00 0.00 H new ATOM 0 HA ILE A 77 20.097 -4.988 -9.116 1.00 0.00 H new ATOM 0 HB ILE A 77 21.709 -3.282 -10.018 1.00 0.00 H new ATOM 0 HG12 ILE A 77 21.289 -3.413 -12.761 1.00 0.00 H new ATOM 0 HG13 ILE A 77 19.678 -3.138 -12.128 1.00 0.00 H new ATOM 0 HG21 ILE A 77 22.723 -4.853 -11.646 1.00 0.00 H new ATOM 0 HG22 ILE A 77 22.117 -5.698 -10.202 1.00 0.00 H new ATOM 0 HG23 ILE A 77 21.188 -5.751 -11.719 1.00 0.00 H new ATOM 0 HD11 ILE A 77 20.792 -1.022 -12.642 1.00 0.00 H new ATOM 0 HD12 ILE A 77 20.486 -1.158 -10.894 1.00 0.00 H new ATOM 0 HD13 ILE A 77 22.122 -1.437 -11.537 1.00 0.00 H new ATOM 1200 N ASN A 78 17.950 -3.204 -8.769 1.00 0.00 N ATOM 1201 CA ASN A 78 17.191 -2.133 -8.129 1.00 0.00 C ATOM 1202 C ASN A 78 17.921 -1.584 -6.906 1.00 0.00 C ATOM 1203 O ASN A 78 17.826 -0.395 -6.597 1.00 0.00 O ATOM 1204 CB ASN A 78 15.799 -2.632 -7.713 1.00 0.00 C ATOM 1205 CG ASN A 78 14.954 -3.115 -8.885 1.00 0.00 C ATOM 1206 OD1 ASN A 78 15.472 -3.630 -9.876 1.00 0.00 O ATOM 1207 ND2 ASN A 78 13.644 -2.959 -8.773 1.00 0.00 N ATOM 0 H ASN A 78 17.431 -4.077 -8.862 1.00 0.00 H new ATOM 0 HA ASN A 78 17.085 -1.330 -8.858 1.00 0.00 H new ATOM 0 HB2 ASN A 78 15.912 -3.446 -6.997 1.00 0.00 H new ATOM 0 HB3 ASN A 78 15.271 -1.828 -7.201 1.00 0.00 H new ATOM 0 HD21 ASN A 78 13.027 -3.270 -9.524 1.00 0.00 H new ATOM 0 HD22 ASN A 78 13.251 -2.528 -7.936 1.00 0.00 H new ATOM 1214 N GLU A 79 18.651 -2.455 -6.217 1.00 0.00 N ATOM 1215 CA GLU A 79 19.403 -2.058 -5.030 1.00 0.00 C ATOM 1216 C GLU A 79 20.586 -1.169 -5.398 1.00 0.00 C ATOM 1217 O GLU A 79 20.982 -0.300 -4.626 1.00 0.00 O ATOM 1218 CB GLU A 79 19.930 -3.283 -4.285 1.00 0.00 C ATOM 1219 CG GLU A 79 18.863 -4.262 -3.834 1.00 0.00 C ATOM 1220 CD GLU A 79 19.467 -5.460 -3.133 1.00 0.00 C ATOM 1221 OE1 GLU A 79 20.157 -6.258 -3.803 1.00 0.00 O ATOM 1222 OE2 GLU A 79 19.285 -5.593 -1.906 1.00 0.00 O ATOM 0 H GLU A 79 18.738 -3.442 -6.460 1.00 0.00 H new ATOM 0 HA GLU A 79 18.718 -1.503 -4.389 1.00 0.00 H new ATOM 0 HB2 GLU A 79 20.635 -3.808 -4.930 1.00 0.00 H new ATOM 0 HB3 GLU A 79 20.487 -2.947 -3.411 1.00 0.00 H new ATOM 0 HG2 GLU A 79 18.167 -3.759 -3.162 1.00 0.00 H new ATOM 0 HG3 GLU A 79 18.287 -4.597 -4.697 1.00 0.00 H new ATOM 1229 N ARG A 80 21.155 -1.400 -6.571 1.00 0.00 N ATOM 1230 CA ARG A 80 22.361 -0.695 -6.981 1.00 0.00 C ATOM 1231 C ARG A 80 22.017 0.655 -7.597 1.00 0.00 C ATOM 1232 O ARG A 80 22.707 1.647 -7.369 1.00 0.00 O ATOM 1233 CB ARG A 80 23.152 -1.549 -7.975 1.00 0.00 C ATOM 1234 CG ARG A 80 24.656 -1.357 -7.867 1.00 0.00 C ATOM 1235 CD ARG A 80 25.421 -2.576 -8.364 1.00 0.00 C ATOM 1236 NE ARG A 80 25.295 -2.782 -9.809 1.00 0.00 N ATOM 1237 CZ ARG A 80 25.102 -3.977 -10.372 1.00 0.00 C ATOM 1238 NH1 ARG A 80 24.920 -5.051 -9.614 1.00 0.00 N ATOM 1239 NH2 ARG A 80 25.083 -4.099 -11.694 1.00 0.00 N ATOM 0 H ARG A 80 20.802 -2.069 -7.255 1.00 0.00 H new ATOM 0 HA ARG A 80 22.975 -0.517 -6.098 1.00 0.00 H new ATOM 0 HB2 ARG A 80 22.914 -2.600 -7.811 1.00 0.00 H new ATOM 0 HB3 ARG A 80 22.833 -1.304 -8.988 1.00 0.00 H new ATOM 0 HG2 ARG A 80 24.953 -0.482 -8.445 1.00 0.00 H new ATOM 0 HG3 ARG A 80 24.923 -1.159 -6.829 1.00 0.00 H new ATOM 0 HD2 ARG A 80 26.475 -2.465 -8.109 1.00 0.00 H new ATOM 0 HD3 ARG A 80 25.059 -3.462 -7.843 1.00 0.00 H new ATOM 0 HE ARG A 80 25.358 -1.967 -10.419 1.00 0.00 H new ATOM 0 HH11 ARG A 80 24.927 -4.965 -8.598 1.00 0.00 H new ATOM 0 HH12 ARG A 80 24.773 -5.962 -10.048 1.00 0.00 H new ATOM 0 HH21 ARG A 80 25.216 -3.278 -12.284 1.00 0.00 H new ATOM 0 HH22 ARG A 80 24.935 -5.014 -12.120 1.00 0.00 H new ATOM 1253 N LEU A 81 20.944 0.683 -8.375 1.00 0.00 N ATOM 1254 CA LEU A 81 20.503 1.911 -9.029 1.00 0.00 C ATOM 1255 C LEU A 81 19.815 2.832 -8.019 1.00 0.00 C ATOM 1256 O LEU A 81 19.750 4.048 -8.210 1.00 0.00 O ATOM 1257 CB LEU A 81 19.564 1.567 -10.195 1.00 0.00 C ATOM 1258 CG LEU A 81 19.257 2.708 -11.175 1.00 0.00 C ATOM 1259 CD1 LEU A 81 18.978 2.147 -12.557 1.00 0.00 C ATOM 1260 CD2 LEU A 81 18.065 3.532 -10.706 1.00 0.00 C ATOM 0 H LEU A 81 20.361 -0.131 -8.570 1.00 0.00 H new ATOM 0 HA LEU A 81 21.369 2.440 -9.427 1.00 0.00 H new ATOM 0 HB2 LEU A 81 20.002 0.742 -10.756 1.00 0.00 H new ATOM 0 HB3 LEU A 81 18.622 1.207 -9.782 1.00 0.00 H new ATOM 0 HG LEU A 81 20.130 3.359 -11.215 1.00 0.00 H new ATOM 0 HD11 LEU A 81 18.761 2.965 -13.245 1.00 0.00 H new ATOM 0 HD12 LEU A 81 19.851 1.598 -12.910 1.00 0.00 H new ATOM 0 HD13 LEU A 81 18.121 1.475 -12.511 1.00 0.00 H new ATOM 0 HD21 LEU A 81 17.872 4.332 -11.421 1.00 0.00 H new ATOM 0 HD22 LEU A 81 17.186 2.891 -10.633 1.00 0.00 H new ATOM 0 HD23 LEU A 81 18.282 3.963 -9.729 1.00 0.00 H new ATOM 1272 N ASN A 82 19.325 2.232 -6.935 1.00 0.00 N ATOM 1273 CA ASN A 82 18.607 2.958 -5.885 1.00 0.00 C ATOM 1274 C ASN A 82 17.349 3.612 -6.443 1.00 0.00 C ATOM 1275 O ASN A 82 17.302 4.829 -6.646 1.00 0.00 O ATOM 1276 CB ASN A 82 19.488 4.026 -5.217 1.00 0.00 C ATOM 1277 CG ASN A 82 20.641 3.459 -4.408 1.00 0.00 C ATOM 1278 OD1 ASN A 82 21.708 4.070 -4.328 1.00 0.00 O ATOM 1279 ND2 ASN A 82 20.432 2.315 -3.777 1.00 0.00 N ATOM 0 H ASN A 82 19.414 1.231 -6.759 1.00 0.00 H new ATOM 0 HA ASN A 82 18.330 2.225 -5.128 1.00 0.00 H new ATOM 0 HB2 ASN A 82 19.888 4.686 -5.987 1.00 0.00 H new ATOM 0 HB3 ASN A 82 18.866 4.638 -4.564 1.00 0.00 H new ATOM 0 HD21 ASN A 82 21.168 1.909 -3.199 1.00 0.00 H new ATOM 0 HD22 ASN A 82 19.535 1.839 -3.868 1.00 0.00 H new ATOM 1286 N ILE A 83 16.340 2.796 -6.717 1.00 0.00 N ATOM 1287 CA ILE A 83 15.065 3.303 -7.206 1.00 0.00 C ATOM 1288 C ILE A 83 14.268 3.893 -6.047 1.00 0.00 C ATOM 1289 O ILE A 83 14.159 3.277 -4.986 1.00 0.00 O ATOM 1290 CB ILE A 83 14.224 2.207 -7.919 1.00 0.00 C ATOM 1291 CG1 ILE A 83 14.854 1.810 -9.260 1.00 0.00 C ATOM 1292 CG2 ILE A 83 12.794 2.679 -8.146 1.00 0.00 C ATOM 1293 CD1 ILE A 83 16.089 0.947 -9.143 1.00 0.00 C ATOM 0 H ILE A 83 16.379 1.782 -6.609 1.00 0.00 H new ATOM 0 HA ILE A 83 15.283 4.075 -7.944 1.00 0.00 H new ATOM 0 HB ILE A 83 14.209 1.334 -7.267 1.00 0.00 H new ATOM 0 HG12 ILE A 83 14.110 1.278 -9.853 1.00 0.00 H new ATOM 0 HG13 ILE A 83 15.110 2.716 -9.809 1.00 0.00 H new ATOM 0 HG21 ILE A 83 12.227 1.894 -8.646 1.00 0.00 H new ATOM 0 HG22 ILE A 83 12.330 2.907 -7.187 1.00 0.00 H new ATOM 0 HG23 ILE A 83 12.801 3.574 -8.768 1.00 0.00 H new ATOM 0 HD11 ILE A 83 16.466 0.715 -10.139 1.00 0.00 H new ATOM 0 HD12 ILE A 83 16.854 1.481 -8.580 1.00 0.00 H new ATOM 0 HD13 ILE A 83 15.838 0.021 -8.625 1.00 0.00 H new ATOM 1305 N GLY A 84 13.738 5.093 -6.252 1.00 0.00 N ATOM 1306 CA GLY A 84 12.971 5.760 -5.219 1.00 0.00 C ATOM 1307 C GLY A 84 11.732 4.985 -4.815 1.00 0.00 C ATOM 1308 O GLY A 84 11.124 4.297 -5.633 1.00 0.00 O ATOM 0 H GLY A 84 13.827 5.618 -7.122 1.00 0.00 H new ATOM 0 HA2 GLY A 84 13.602 5.909 -4.343 1.00 0.00 H new ATOM 0 HA3 GLY A 84 12.677 6.748 -5.572 1.00 0.00 H new ATOM 1312 N GLU A 85 11.353 5.111 -3.555 1.00 0.00 N ATOM 1313 CA GLU A 85 10.190 4.411 -3.021 1.00 0.00 C ATOM 1314 C GLU A 85 8.892 4.862 -3.708 1.00 0.00 C ATOM 1315 O GLU A 85 8.107 4.017 -4.143 1.00 0.00 O ATOM 1316 CB GLU A 85 10.100 4.603 -1.504 1.00 0.00 C ATOM 1317 CG GLU A 85 8.894 3.933 -0.874 1.00 0.00 C ATOM 1318 CD GLU A 85 8.923 4.003 0.634 1.00 0.00 C ATOM 1319 OE1 GLU A 85 8.650 5.085 1.191 1.00 0.00 O ATOM 1320 OE2 GLU A 85 9.234 2.977 1.274 1.00 0.00 O ATOM 0 H GLU A 85 11.837 5.697 -2.874 1.00 0.00 H new ATOM 0 HA GLU A 85 10.316 3.349 -3.230 1.00 0.00 H new ATOM 0 HB2 GLU A 85 11.005 4.209 -1.043 1.00 0.00 H new ATOM 0 HB3 GLU A 85 10.068 5.670 -1.283 1.00 0.00 H new ATOM 0 HG2 GLU A 85 7.984 4.409 -1.240 1.00 0.00 H new ATOM 0 HG3 GLU A 85 8.856 2.889 -1.187 1.00 0.00 H new ATOM 1327 N PRO A 86 8.636 6.191 -3.828 1.00 0.00 N ATOM 1328 CA PRO A 86 7.455 6.702 -4.541 1.00 0.00 C ATOM 1329 C PRO A 86 7.386 6.213 -5.988 1.00 0.00 C ATOM 1330 O PRO A 86 6.324 6.226 -6.606 1.00 0.00 O ATOM 1331 CB PRO A 86 7.621 8.228 -4.498 1.00 0.00 C ATOM 1332 CG PRO A 86 9.042 8.462 -4.116 1.00 0.00 C ATOM 1333 CD PRO A 86 9.434 7.295 -3.263 1.00 0.00 C ATOM 0 HA PRO A 86 6.532 6.354 -4.078 1.00 0.00 H new ATOM 0 HB2 PRO A 86 7.396 8.675 -5.466 1.00 0.00 H new ATOM 0 HB3 PRO A 86 6.941 8.677 -3.774 1.00 0.00 H new ATOM 0 HG2 PRO A 86 9.678 8.532 -4.999 1.00 0.00 H new ATOM 0 HG3 PRO A 86 9.151 9.399 -3.570 1.00 0.00 H new ATOM 0 HD2 PRO A 86 10.503 7.092 -3.323 1.00 0.00 H new ATOM 0 HD3 PRO A 86 9.200 7.466 -2.212 1.00 0.00 H new ATOM 1341 N LEU A 87 8.522 5.769 -6.517 1.00 0.00 N ATOM 1342 CA LEU A 87 8.581 5.235 -7.873 1.00 0.00 C ATOM 1343 C LEU A 87 7.863 3.890 -7.937 1.00 0.00 C ATOM 1344 O LEU A 87 7.201 3.575 -8.924 1.00 0.00 O ATOM 1345 CB LEU A 87 10.038 5.085 -8.339 1.00 0.00 C ATOM 1346 CG LEU A 87 10.744 6.372 -8.806 1.00 0.00 C ATOM 1347 CD1 LEU A 87 10.122 6.890 -10.095 1.00 0.00 C ATOM 1348 CD2 LEU A 87 10.704 7.448 -7.731 1.00 0.00 C ATOM 0 H LEU A 87 9.416 5.769 -6.026 1.00 0.00 H new ATOM 0 HA LEU A 87 8.081 5.936 -8.542 1.00 0.00 H new ATOM 0 HB2 LEU A 87 10.616 4.656 -7.520 1.00 0.00 H new ATOM 0 HB3 LEU A 87 10.062 4.366 -9.158 1.00 0.00 H new ATOM 0 HG LEU A 87 11.788 6.124 -8.996 1.00 0.00 H new ATOM 0 HD11 LEU A 87 10.636 7.799 -10.407 1.00 0.00 H new ATOM 0 HD12 LEU A 87 10.217 6.134 -10.874 1.00 0.00 H new ATOM 0 HD13 LEU A 87 9.067 7.108 -9.928 1.00 0.00 H new ATOM 0 HD21 LEU A 87 11.211 8.343 -8.093 1.00 0.00 H new ATOM 0 HD22 LEU A 87 9.667 7.688 -7.495 1.00 0.00 H new ATOM 0 HD23 LEU A 87 11.205 7.085 -6.834 1.00 0.00 H new ATOM 1360 N LEU A 88 7.984 3.104 -6.871 1.00 0.00 N ATOM 1361 CA LEU A 88 7.262 1.839 -6.770 1.00 0.00 C ATOM 1362 C LEU A 88 5.777 2.106 -6.566 1.00 0.00 C ATOM 1363 O LEU A 88 4.926 1.342 -7.020 1.00 0.00 O ATOM 1364 CB LEU A 88 7.797 0.972 -5.619 1.00 0.00 C ATOM 1365 CG LEU A 88 9.089 0.193 -5.908 1.00 0.00 C ATOM 1366 CD1 LEU A 88 8.946 -0.636 -7.175 1.00 0.00 C ATOM 1367 CD2 LEU A 88 10.286 1.123 -6.009 1.00 0.00 C ATOM 0 H LEU A 88 8.573 3.320 -6.067 1.00 0.00 H new ATOM 0 HA LEU A 88 7.414 1.292 -7.701 1.00 0.00 H new ATOM 0 HB2 LEU A 88 7.969 1.615 -4.756 1.00 0.00 H new ATOM 0 HB3 LEU A 88 7.022 0.260 -5.336 1.00 0.00 H new ATOM 0 HG LEU A 88 9.262 -0.483 -5.071 1.00 0.00 H new ATOM 0 HD11 LEU A 88 9.872 -1.179 -7.361 1.00 0.00 H new ATOM 0 HD12 LEU A 88 8.127 -1.345 -7.055 1.00 0.00 H new ATOM 0 HD13 LEU A 88 8.736 0.022 -8.018 1.00 0.00 H new ATOM 0 HD21 LEU A 88 11.184 0.540 -6.214 1.00 0.00 H new ATOM 0 HD22 LEU A 88 10.125 1.837 -6.817 1.00 0.00 H new ATOM 0 HD23 LEU A 88 10.409 1.661 -5.069 1.00 0.00 H new ATOM 1379 N VAL A 89 5.477 3.203 -5.883 1.00 0.00 N ATOM 1380 CA VAL A 89 4.100 3.635 -5.694 1.00 0.00 C ATOM 1381 C VAL A 89 3.489 4.030 -7.036 1.00 0.00 C ATOM 1382 O VAL A 89 2.331 3.721 -7.318 1.00 0.00 O ATOM 1383 CB VAL A 89 4.011 4.826 -4.713 1.00 0.00 C ATOM 1384 CG1 VAL A 89 2.569 5.267 -4.523 1.00 0.00 C ATOM 1385 CG2 VAL A 89 4.640 4.467 -3.375 1.00 0.00 C ATOM 0 H VAL A 89 6.172 3.811 -5.450 1.00 0.00 H new ATOM 0 HA VAL A 89 3.544 2.800 -5.268 1.00 0.00 H new ATOM 0 HB VAL A 89 4.567 5.659 -5.143 1.00 0.00 H new ATOM 0 HG11 VAL A 89 2.534 6.106 -3.828 1.00 0.00 H new ATOM 0 HG12 VAL A 89 2.153 5.573 -5.483 1.00 0.00 H new ATOM 0 HG13 VAL A 89 1.985 4.439 -4.121 1.00 0.00 H new ATOM 0 HG21 VAL A 89 4.567 5.319 -2.699 1.00 0.00 H new ATOM 0 HG22 VAL A 89 4.115 3.615 -2.943 1.00 0.00 H new ATOM 0 HG23 VAL A 89 5.689 4.210 -3.523 1.00 0.00 H new ATOM 1395 N TYR A 90 4.296 4.695 -7.859 1.00 0.00 N ATOM 1396 CA TYR A 90 3.899 5.096 -9.208 1.00 0.00 C ATOM 1397 C TYR A 90 3.546 3.876 -10.057 1.00 0.00 C ATOM 1398 O TYR A 90 2.687 3.942 -10.937 1.00 0.00 O ATOM 1399 CB TYR A 90 5.041 5.878 -9.864 1.00 0.00 C ATOM 1400 CG TYR A 90 4.697 6.491 -11.204 1.00 0.00 C ATOM 1401 CD1 TYR A 90 3.995 7.687 -11.280 1.00 0.00 C ATOM 1402 CD2 TYR A 90 5.089 5.885 -12.392 1.00 0.00 C ATOM 1403 CE1 TYR A 90 3.691 8.259 -12.499 1.00 0.00 C ATOM 1404 CE2 TYR A 90 4.786 6.451 -13.615 1.00 0.00 C ATOM 1405 CZ TYR A 90 4.088 7.638 -13.663 1.00 0.00 C ATOM 1406 OH TYR A 90 3.790 8.210 -14.879 1.00 0.00 O ATOM 0 H TYR A 90 5.246 4.972 -7.610 1.00 0.00 H new ATOM 0 HA TYR A 90 3.014 5.729 -9.139 1.00 0.00 H new ATOM 0 HB2 TYR A 90 5.356 6.672 -9.187 1.00 0.00 H new ATOM 0 HB3 TYR A 90 5.894 5.211 -9.993 1.00 0.00 H new ATOM 0 HD1 TYR A 90 3.682 8.178 -10.370 1.00 0.00 H new ATOM 0 HD2 TYR A 90 5.639 4.956 -12.358 1.00 0.00 H new ATOM 0 HE1 TYR A 90 3.144 9.189 -12.540 1.00 0.00 H new ATOM 0 HE2 TYR A 90 5.095 5.966 -14.529 1.00 0.00 H new ATOM 0 HH TYR A 90 4.141 7.647 -15.600 1.00 0.00 H new ATOM 1416 N LEU A 91 4.220 2.766 -9.785 1.00 0.00 N ATOM 1417 CA LEU A 91 3.958 1.519 -10.489 1.00 0.00 C ATOM 1418 C LEU A 91 2.586 0.972 -10.106 1.00 0.00 C ATOM 1419 O LEU A 91 1.939 0.272 -10.888 1.00 0.00 O ATOM 1420 CB LEU A 91 5.046 0.490 -10.169 1.00 0.00 C ATOM 1421 CG LEU A 91 4.928 -0.836 -10.920 1.00 0.00 C ATOM 1422 CD1 LEU A 91 5.028 -0.610 -12.420 1.00 0.00 C ATOM 1423 CD2 LEU A 91 6.001 -1.807 -10.455 1.00 0.00 C ATOM 0 H LEU A 91 4.954 2.705 -9.080 1.00 0.00 H new ATOM 0 HA LEU A 91 3.968 1.717 -11.561 1.00 0.00 H new ATOM 0 HB2 LEU A 91 6.018 0.931 -10.393 1.00 0.00 H new ATOM 0 HB3 LEU A 91 5.027 0.286 -9.098 1.00 0.00 H new ATOM 0 HG LEU A 91 3.952 -1.270 -10.702 1.00 0.00 H new ATOM 0 HD11 LEU A 91 4.942 -1.565 -12.938 1.00 0.00 H new ATOM 0 HD12 LEU A 91 4.224 0.052 -12.743 1.00 0.00 H new ATOM 0 HD13 LEU A 91 5.990 -0.154 -12.656 1.00 0.00 H new ATOM 0 HD21 LEU A 91 5.903 -2.746 -11.000 1.00 0.00 H new ATOM 0 HD22 LEU A 91 6.986 -1.379 -10.644 1.00 0.00 H new ATOM 0 HD23 LEU A 91 5.885 -1.993 -9.387 1.00 0.00 H new ATOM 1435 N ARG A 92 2.151 1.299 -8.898 1.00 0.00 N ATOM 1436 CA ARG A 92 0.843 0.886 -8.417 1.00 0.00 C ATOM 1437 C ARG A 92 -0.236 1.802 -8.975 1.00 0.00 C ATOM 1438 O ARG A 92 -1.087 1.372 -9.753 1.00 0.00 O ATOM 1439 CB ARG A 92 0.805 0.902 -6.887 1.00 0.00 C ATOM 1440 CG ARG A 92 1.641 -0.189 -6.239 1.00 0.00 C ATOM 1441 CD ARG A 92 1.076 -1.571 -6.532 1.00 0.00 C ATOM 1442 NE ARG A 92 -0.329 -1.681 -6.138 1.00 0.00 N ATOM 1443 CZ ARG A 92 -0.747 -2.242 -5.004 1.00 0.00 C ATOM 1444 NH1 ARG A 92 0.133 -2.756 -4.150 1.00 0.00 N ATOM 1445 NH2 ARG A 92 -2.044 -2.281 -4.722 1.00 0.00 N ATOM 0 H ARG A 92 2.689 1.852 -8.231 1.00 0.00 H new ATOM 0 HA ARG A 92 0.655 -0.131 -8.760 1.00 0.00 H new ATOM 0 HB2 ARG A 92 1.155 1.872 -6.535 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -0.229 0.798 -6.558 1.00 0.00 H new ATOM 0 HG2 ARG A 92 2.666 -0.129 -6.604 1.00 0.00 H new ATOM 0 HG3 ARG A 92 1.677 -0.030 -5.161 1.00 0.00 H new ATOM 0 HD2 ARG A 92 1.172 -1.784 -7.597 1.00 0.00 H new ATOM 0 HD3 ARG A 92 1.662 -2.322 -6.002 1.00 0.00 H new ATOM 0 HE ARG A 92 -1.033 -1.304 -6.772 1.00 0.00 H new ATOM 0 HH11 ARG A 92 1.130 -2.721 -4.362 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -0.189 -3.185 -3.282 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -2.720 -1.882 -5.373 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -2.365 -2.710 -3.854 1.00 0.00 H new ATOM 1459 N ARG A 93 -0.190 3.065 -8.576 1.00 0.00 N ATOM 1460 CA ARG A 93 -1.135 4.068 -9.047 1.00 0.00 C ATOM 1461 C ARG A 93 -0.406 5.388 -9.234 1.00 0.00 C ATOM 1462 O ARG A 93 0.755 5.517 -8.855 1.00 0.00 O ATOM 1463 CB ARG A 93 -2.290 4.252 -8.052 1.00 0.00 C ATOM 1464 CG ARG A 93 -3.188 3.035 -7.894 1.00 0.00 C ATOM 1465 CD ARG A 93 -3.906 2.690 -9.189 1.00 0.00 C ATOM 1466 NE ARG A 93 -4.830 1.571 -9.014 1.00 0.00 N ATOM 1467 CZ ARG A 93 -5.030 0.613 -9.916 1.00 0.00 C ATOM 1468 NH1 ARG A 93 -4.383 0.634 -11.075 1.00 0.00 N ATOM 1469 NH2 ARG A 93 -5.880 -0.371 -9.652 1.00 0.00 N ATOM 0 H ARG A 93 0.502 3.423 -7.918 1.00 0.00 H new ATOM 0 HA ARG A 93 -1.556 3.733 -9.995 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -1.875 4.510 -7.078 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -2.899 5.097 -8.374 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -2.591 2.182 -7.571 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -3.922 3.224 -7.111 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -4.454 3.562 -9.544 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -3.173 2.440 -9.956 1.00 0.00 H new ATOM 0 HE ARG A 93 -5.357 1.521 -8.142 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -3.727 1.388 -11.279 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -4.542 -0.104 -11.761 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -6.377 -0.391 -8.761 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -6.037 -1.108 -10.340 1.00 0.00 H new ATOM 1483 N GLN A 94 -1.081 6.370 -9.802 1.00 0.00 N ATOM 1484 CA GLN A 94 -0.468 7.667 -10.024 1.00 0.00 C ATOM 1485 C GLN A 94 -1.486 8.786 -9.878 1.00 0.00 C ATOM 1486 O GLN A 94 -2.527 8.797 -10.540 1.00 0.00 O ATOM 1487 CB GLN A 94 0.208 7.709 -11.396 1.00 0.00 C ATOM 1488 CG GLN A 94 -0.628 7.098 -12.503 1.00 0.00 C ATOM 1489 CD GLN A 94 0.188 6.796 -13.743 1.00 0.00 C ATOM 1490 OE1 GLN A 94 0.290 7.616 -14.651 1.00 0.00 O ATOM 1491 NE2 GLN A 94 0.795 5.621 -13.779 1.00 0.00 N ATOM 0 H GLN A 94 -2.048 6.296 -10.117 1.00 0.00 H new ATOM 0 HA GLN A 94 0.297 7.820 -9.262 1.00 0.00 H new ATOM 0 HB2 GLN A 94 0.431 8.745 -11.650 1.00 0.00 H new ATOM 0 HB3 GLN A 94 1.161 7.183 -11.339 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -1.089 6.179 -12.142 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -1.438 7.780 -12.762 1.00 0.00 H new ATOM 0 HE21 GLN A 94 0.686 4.966 -13.004 1.00 0.00 H new ATOM 0 HE22 GLN A 94 1.372 5.370 -14.581 1.00 0.00 H new ATOM 1500 N ASP A 95 -1.175 9.711 -8.983 1.00 0.00 N ATOM 1501 CA ASP A 95 -2.030 10.863 -8.718 1.00 0.00 C ATOM 1502 C ASP A 95 -2.230 11.660 -9.999 1.00 0.00 C ATOM 1503 O ASP A 95 -3.354 11.980 -10.388 1.00 0.00 O ATOM 1504 CB ASP A 95 -1.395 11.748 -7.643 1.00 0.00 C ATOM 1505 CG ASP A 95 -2.365 12.759 -7.071 1.00 0.00 C ATOM 1506 OD1 ASP A 95 -2.623 13.784 -7.731 1.00 0.00 O ATOM 1507 OD2 ASP A 95 -2.872 12.529 -5.953 1.00 0.00 O ATOM 0 H ASP A 95 -0.325 9.687 -8.420 1.00 0.00 H new ATOM 0 HA ASP A 95 -2.999 10.515 -8.360 1.00 0.00 H new ATOM 0 HB2 ASP A 95 -1.015 11.119 -6.838 1.00 0.00 H new ATOM 0 HB3 ASP A 95 -0.539 12.272 -8.068 1.00 0.00 H new ATOM 1512 N LEU A 96 -1.123 11.962 -10.656 1.00 0.00 N ATOM 1513 CA LEU A 96 -1.148 12.620 -11.948 1.00 0.00 C ATOM 1514 C LEU A 96 -0.477 11.723 -12.978 1.00 0.00 C ATOM 1515 O LEU A 96 0.705 11.409 -12.853 1.00 0.00 O ATOM 1516 CB LEU A 96 -0.429 13.969 -11.882 1.00 0.00 C ATOM 1517 CG LEU A 96 -1.027 14.986 -10.907 1.00 0.00 C ATOM 1518 CD1 LEU A 96 -0.173 16.242 -10.858 1.00 0.00 C ATOM 1519 CD2 LEU A 96 -2.457 15.330 -11.302 1.00 0.00 C ATOM 0 H LEU A 96 -0.186 11.758 -10.309 1.00 0.00 H new ATOM 0 HA LEU A 96 -2.184 12.800 -12.235 1.00 0.00 H new ATOM 0 HB2 LEU A 96 0.611 13.794 -11.605 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -0.424 14.408 -12.880 1.00 0.00 H new ATOM 0 HG LEU A 96 -1.043 14.540 -9.913 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -0.613 16.954 -10.160 1.00 0.00 H new ATOM 0 HD12 LEU A 96 0.834 15.985 -10.528 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -0.126 16.689 -11.851 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -2.865 16.054 -10.597 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -2.465 15.756 -12.305 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -3.066 14.426 -11.287 1.00 0.00 H new ATOM 1531 N PRO A 97 -1.226 11.283 -13.996 1.00 0.00 N ATOM 1532 CA PRO A 97 -0.700 10.385 -15.025 1.00 0.00 C ATOM 1533 C PRO A 97 0.276 11.095 -15.952 1.00 0.00 C ATOM 1534 O PRO A 97 1.153 10.476 -16.552 1.00 0.00 O ATOM 1535 CB PRO A 97 -1.952 9.947 -15.790 1.00 0.00 C ATOM 1536 CG PRO A 97 -2.930 11.052 -15.585 1.00 0.00 C ATOM 1537 CD PRO A 97 -2.641 11.624 -14.224 1.00 0.00 C ATOM 0 HA PRO A 97 -0.139 9.553 -14.600 1.00 0.00 H new ATOM 0 HB2 PRO A 97 -1.737 9.800 -16.849 1.00 0.00 H new ATOM 0 HB3 PRO A 97 -2.338 9.002 -15.409 1.00 0.00 H new ATOM 0 HG2 PRO A 97 -2.824 11.814 -16.357 1.00 0.00 H new ATOM 0 HG3 PRO A 97 -3.953 10.681 -15.642 1.00 0.00 H new ATOM 0 HD2 PRO A 97 -2.802 12.702 -14.200 1.00 0.00 H new ATOM 0 HD3 PRO A 97 -3.286 11.188 -13.461 1.00 0.00 H new ATOM 1545 N GLU A 98 0.123 12.402 -16.048 1.00 0.00 N ATOM 1546 CA GLU A 98 0.949 13.202 -16.925 1.00 0.00 C ATOM 1547 C GLU A 98 1.841 14.119 -16.107 1.00 0.00 C ATOM 1548 O GLU A 98 1.491 15.269 -15.843 1.00 0.00 O ATOM 1549 CB GLU A 98 0.064 14.017 -17.863 1.00 0.00 C ATOM 1550 CG GLU A 98 -0.958 13.170 -18.602 1.00 0.00 C ATOM 1551 CD GLU A 98 -1.995 14.001 -19.316 1.00 0.00 C ATOM 1552 OE1 GLU A 98 -2.922 14.499 -18.645 1.00 0.00 O ATOM 1553 OE2 GLU A 98 -1.889 14.157 -20.550 1.00 0.00 O ATOM 0 H GLU A 98 -0.572 12.933 -15.524 1.00 0.00 H new ATOM 0 HA GLU A 98 1.582 12.545 -17.521 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -0.455 14.784 -17.288 1.00 0.00 H new ATOM 0 HB3 GLU A 98 0.692 14.533 -18.589 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -0.444 12.537 -19.326 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -1.454 12.507 -17.894 1.00 0.00 H new ATOM 1560 N ILE A 99 2.976 13.593 -15.673 1.00 0.00 N ATOM 1561 CA ILE A 99 3.911 14.361 -14.866 1.00 0.00 C ATOM 1562 C ILE A 99 4.863 15.144 -15.757 1.00 0.00 C ATOM 1563 O ILE A 99 5.656 14.561 -16.501 1.00 0.00 O ATOM 1564 CB ILE A 99 4.727 13.456 -13.916 1.00 0.00 C ATOM 1565 CG1 ILE A 99 3.790 12.689 -12.977 1.00 0.00 C ATOM 1566 CG2 ILE A 99 5.725 14.283 -13.113 1.00 0.00 C ATOM 1567 CD1 ILE A 99 4.508 11.748 -12.032 1.00 0.00 C ATOM 0 H ILE A 99 3.272 12.636 -15.866 1.00 0.00 H new ATOM 0 HA ILE A 99 3.323 15.050 -14.261 1.00 0.00 H new ATOM 0 HB ILE A 99 5.283 12.737 -14.517 1.00 0.00 H new ATOM 0 HG12 ILE A 99 3.211 13.404 -12.393 1.00 0.00 H new ATOM 0 HG13 ILE A 99 3.080 12.117 -13.575 1.00 0.00 H new ATOM 0 HG21 ILE A 99 6.290 13.628 -12.450 1.00 0.00 H new ATOM 0 HG22 ILE A 99 6.410 14.788 -13.794 1.00 0.00 H new ATOM 0 HG23 ILE A 99 5.189 15.025 -12.520 1.00 0.00 H new ATOM 0 HD11 ILE A 99 3.779 11.241 -11.400 1.00 0.00 H new ATOM 0 HD12 ILE A 99 5.065 11.009 -12.608 1.00 0.00 H new ATOM 0 HD13 ILE A 99 5.198 12.316 -11.408 1.00 0.00 H new ATOM 1579 N THR A 100 4.765 16.462 -15.693 1.00 0.00 N ATOM 1580 CA THR A 100 5.630 17.329 -16.467 1.00 0.00 C ATOM 1581 C THR A 100 6.620 18.051 -15.565 1.00 0.00 C ATOM 1582 O THR A 100 6.334 18.317 -14.395 1.00 0.00 O ATOM 1583 CB THR A 100 4.820 18.363 -17.275 1.00 0.00 C ATOM 1584 OG1 THR A 100 3.834 18.996 -16.444 1.00 0.00 O ATOM 1585 CG2 THR A 100 4.143 17.704 -18.465 1.00 0.00 C ATOM 0 H THR A 100 4.090 16.955 -15.108 1.00 0.00 H new ATOM 0 HA THR A 100 6.176 16.696 -17.166 1.00 0.00 H new ATOM 0 HB THR A 100 5.513 19.121 -17.640 1.00 0.00 H new ATOM 0 HG1 THR A 100 3.331 19.650 -16.973 1.00 0.00 H new ATOM 0 HG21 THR A 100 3.577 18.451 -19.021 1.00 0.00 H new ATOM 0 HG22 THR A 100 4.899 17.263 -19.115 1.00 0.00 H new ATOM 0 HG23 THR A 100 3.467 16.924 -18.113 1.00 0.00 H new ATOM 1593 N ALA A 101 7.788 18.344 -16.106 1.00 0.00 N ATOM 1594 CA ALA A 101 8.810 19.061 -15.368 1.00 0.00 C ATOM 1595 C ALA A 101 9.400 20.174 -16.217 1.00 0.00 C ATOM 1596 O ALA A 101 9.944 19.924 -17.293 1.00 0.00 O ATOM 1597 CB ALA A 101 9.901 18.105 -14.913 1.00 0.00 C ATOM 0 H ALA A 101 8.053 18.095 -17.059 1.00 0.00 H new ATOM 0 HA ALA A 101 8.350 19.509 -14.487 1.00 0.00 H new ATOM 0 HB1 ALA A 101 10.661 18.657 -14.360 1.00 0.00 H new ATOM 0 HB2 ALA A 101 9.469 17.339 -14.269 1.00 0.00 H new ATOM 0 HB3 ALA A 101 10.357 17.632 -15.783 1.00 0.00 H new ATOM 1603 N GLN A 102 9.275 21.398 -15.735 1.00 0.00 N ATOM 1604 CA GLN A 102 9.838 22.553 -16.410 1.00 0.00 C ATOM 1605 C GLN A 102 10.153 23.626 -15.382 1.00 0.00 C ATOM 1606 O GLN A 102 9.441 23.763 -14.383 1.00 0.00 O ATOM 1607 CB GLN A 102 8.890 23.111 -17.487 1.00 0.00 C ATOM 1608 CG GLN A 102 7.601 23.723 -16.950 1.00 0.00 C ATOM 1609 CD GLN A 102 6.437 22.748 -16.910 1.00 0.00 C ATOM 1610 OE1 GLN A 102 6.613 21.543 -16.736 1.00 0.00 O ATOM 1611 NE2 GLN A 102 5.232 23.269 -17.063 1.00 0.00 N ATOM 0 H GLN A 102 8.783 21.618 -14.869 1.00 0.00 H new ATOM 0 HA GLN A 102 10.751 22.240 -16.917 1.00 0.00 H new ATOM 0 HB2 GLN A 102 9.423 23.868 -18.063 1.00 0.00 H new ATOM 0 HB3 GLN A 102 8.634 22.307 -18.177 1.00 0.00 H new ATOM 0 HG2 GLN A 102 7.780 24.103 -15.944 1.00 0.00 H new ATOM 0 HG3 GLN A 102 7.328 24.577 -17.570 1.00 0.00 H new ATOM 0 HE21 GLN A 102 5.125 24.273 -17.205 1.00 0.00 H new ATOM 0 HE22 GLN A 102 4.409 22.667 -17.039 1.00 0.00 H new ATOM 1620 N ARG A 103 11.214 24.376 -15.619 1.00 0.00 N ATOM 1621 CA ARG A 103 11.658 25.378 -14.663 1.00 0.00 C ATOM 1622 C ARG A 103 10.721 26.574 -14.669 1.00 0.00 C ATOM 1623 O ARG A 103 10.130 26.910 -15.700 1.00 0.00 O ATOM 1624 CB ARG A 103 13.090 25.828 -14.965 1.00 0.00 C ATOM 1625 CG ARG A 103 14.052 24.674 -15.192 1.00 0.00 C ATOM 1626 CD ARG A 103 13.936 23.612 -14.107 1.00 0.00 C ATOM 1627 NE ARG A 103 14.386 24.086 -12.800 1.00 0.00 N ATOM 1628 CZ ARG A 103 15.378 23.518 -12.118 1.00 0.00 C ATOM 1629 NH1 ARG A 103 16.045 22.493 -12.639 1.00 0.00 N ATOM 1630 NH2 ARG A 103 15.712 23.975 -10.920 1.00 0.00 N ATOM 0 H ARG A 103 11.784 24.312 -16.462 1.00 0.00 H new ATOM 0 HA ARG A 103 11.643 24.925 -13.672 1.00 0.00 H new ATOM 0 HB2 ARG A 103 13.084 26.465 -15.850 1.00 0.00 H new ATOM 0 HB3 ARG A 103 13.454 26.436 -14.137 1.00 0.00 H new ATOM 0 HG2 ARG A 103 13.853 24.222 -16.164 1.00 0.00 H new ATOM 0 HG3 ARG A 103 15.073 25.054 -15.220 1.00 0.00 H new ATOM 0 HD2 ARG A 103 12.898 23.287 -14.033 1.00 0.00 H new ATOM 0 HD3 ARG A 103 14.524 22.740 -14.394 1.00 0.00 H new ATOM 0 HE ARG A 103 13.916 24.893 -12.390 1.00 0.00 H new ATOM 0 HH11 ARG A 103 15.797 22.140 -13.563 1.00 0.00 H new ATOM 0 HH12 ARG A 103 16.805 22.059 -12.114 1.00 0.00 H new ATOM 0 HH21 ARG A 103 15.208 24.765 -10.517 1.00 0.00 H new ATOM 0 HH22 ARG A 103 16.473 23.537 -10.401 1.00 0.00 H new ATOM 1644 N GLN A 104 10.578 27.205 -13.512 1.00 0.00 N ATOM 1645 CA GLN A 104 9.696 28.351 -13.371 1.00 0.00 C ATOM 1646 C GLN A 104 10.247 29.566 -14.119 1.00 0.00 C ATOM 1647 O GLN A 104 11.132 30.272 -13.634 1.00 0.00 O ATOM 1648 CB GLN A 104 9.461 28.671 -11.887 1.00 0.00 C ATOM 1649 CG GLN A 104 10.738 28.875 -11.086 1.00 0.00 C ATOM 1650 CD GLN A 104 10.485 29.085 -9.606 1.00 0.00 C ATOM 1651 OE1 GLN A 104 9.435 29.590 -9.204 1.00 0.00 O ATOM 1652 NE2 GLN A 104 11.454 28.713 -8.787 1.00 0.00 N ATOM 0 H GLN A 104 11.064 26.940 -12.655 1.00 0.00 H new ATOM 0 HA GLN A 104 8.735 28.099 -13.819 1.00 0.00 H new ATOM 0 HB2 GLN A 104 8.851 29.571 -11.813 1.00 0.00 H new ATOM 0 HB3 GLN A 104 8.889 27.860 -11.438 1.00 0.00 H new ATOM 0 HG2 GLN A 104 11.385 28.008 -11.218 1.00 0.00 H new ATOM 0 HG3 GLN A 104 11.275 29.737 -11.483 1.00 0.00 H new ATOM 0 HE21 GLN A 104 12.307 28.299 -9.162 1.00 0.00 H new ATOM 0 HE22 GLN A 104 11.348 28.840 -7.781 1.00 0.00 H new ATOM 1661 N LEU A 105 9.745 29.771 -15.328 1.00 0.00 N ATOM 1662 CA LEU A 105 10.112 30.931 -16.124 1.00 0.00 C ATOM 1663 C LEU A 105 9.131 32.064 -15.853 1.00 0.00 C ATOM 1664 O LEU A 105 9.414 33.232 -16.114 1.00 0.00 O ATOM 1665 CB LEU A 105 10.112 30.569 -17.614 1.00 0.00 C ATOM 1666 CG LEU A 105 10.539 31.687 -18.569 1.00 0.00 C ATOM 1667 CD1 LEU A 105 11.982 32.092 -18.313 1.00 0.00 C ATOM 1668 CD2 LEU A 105 10.355 31.246 -20.012 1.00 0.00 C ATOM 0 H LEU A 105 9.079 29.145 -15.780 1.00 0.00 H new ATOM 0 HA LEU A 105 11.115 31.256 -15.848 1.00 0.00 H new ATOM 0 HB2 LEU A 105 10.775 29.717 -17.762 1.00 0.00 H new ATOM 0 HB3 LEU A 105 9.109 30.244 -17.890 1.00 0.00 H new ATOM 0 HG LEU A 105 9.906 32.556 -18.388 1.00 0.00 H new ATOM 0 HD11 LEU A 105 12.264 32.888 -19.003 1.00 0.00 H new ATOM 0 HD12 LEU A 105 12.084 32.447 -17.288 1.00 0.00 H new ATOM 0 HD13 LEU A 105 12.634 31.232 -18.465 1.00 0.00 H new ATOM 0 HD21 LEU A 105 10.662 32.050 -20.680 1.00 0.00 H new ATOM 0 HD22 LEU A 105 10.964 30.363 -20.203 1.00 0.00 H new ATOM 0 HD23 LEU A 105 9.306 31.008 -20.189 1.00 0.00 H new ATOM 1680 N ARG A 106 7.977 31.698 -15.313 1.00 0.00 N ATOM 1681 CA ARG A 106 6.945 32.666 -14.987 1.00 0.00 C ATOM 1682 C ARG A 106 6.837 32.811 -13.475 1.00 0.00 C ATOM 1683 O ARG A 106 5.830 32.344 -12.901 1.00 0.00 O ATOM 1684 CB ARG A 106 5.583 32.241 -15.562 1.00 0.00 C ATOM 1685 CG ARG A 106 5.489 32.268 -17.082 1.00 0.00 C ATOM 1686 CD ARG A 106 6.204 31.092 -17.729 1.00 0.00 C ATOM 1687 NE ARG A 106 6.023 31.081 -19.179 1.00 0.00 N ATOM 1688 CZ ARG A 106 6.312 30.044 -19.966 1.00 0.00 C ATOM 1689 NH1 ARG A 106 6.853 28.941 -19.459 1.00 0.00 N ATOM 1690 NH2 ARG A 106 6.066 30.116 -21.268 1.00 0.00 N ATOM 1691 OXT ARG A 106 7.774 33.355 -12.858 1.00 0.00 O ATOM 0 H ARG A 106 7.733 30.733 -15.091 1.00 0.00 H new ATOM 0 HA ARG A 106 7.222 33.622 -15.432 1.00 0.00 H new ATOM 0 HB2 ARG A 106 5.359 31.232 -15.217 1.00 0.00 H new ATOM 0 HB3 ARG A 106 4.813 32.896 -15.154 1.00 0.00 H new ATOM 0 HG2 ARG A 106 4.440 32.259 -17.378 1.00 0.00 H new ATOM 0 HG3 ARG A 106 5.918 33.199 -17.453 1.00 0.00 H new ATOM 0 HD2 ARG A 106 7.268 31.139 -17.495 1.00 0.00 H new ATOM 0 HD3 ARG A 106 5.826 30.160 -17.308 1.00 0.00 H new ATOM 0 HE ARG A 106 5.651 31.923 -19.619 1.00 0.00 H new ATOM 0 HH11 ARG A 106 7.051 28.883 -18.460 1.00 0.00 H new ATOM 0 HH12 ARG A 106 7.071 28.153 -20.069 1.00 0.00 H new ATOM 0 HH21 ARG A 106 5.657 30.963 -21.664 1.00 0.00 H new ATOM 0 HH22 ARG A 106 6.286 29.325 -21.873 1.00 0.00 H new TER 1705 ARG A 106