USER MOD reduce.3.24.130724 H: found=0, std=0, add=879, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 881 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 99 TYR OH : rot 165:sc= 0.149 USER MOD Set 1.2: A 117 LYS NZ :NH3+ -136:sc= 0.156 (180deg=0) USER MOD Set 2.1: A 2 GLN : amide:sc= 0.6 K(o=0.6,f=-4.4!) USER MOD Set 2.2: A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 4 THR OG1 : rot 180:sc= 0.0296 USER MOD Single : A 7 ASN : amide:sc= 0.546 K(o=0.55,f=-3.2!) USER MOD Single : A 13 SER OG : rot -70:sc= 0.869 USER MOD Single : A 18 GLN :FLIP amide:sc= 0 F(o=-1.1!,f=0) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 64 HIS : no HE2:sc= 0.827 K(o=0.83,f=-2.6!) USER MOD Single : A 66 SER OG : rot -35:sc= 0.0136 USER MOD Single : A 70 THR OG1 : rot 180:sc= 0.041 USER MOD Single : A 72 SER OG : rot 139:sc= 1.36 USER MOD Single : A 81 SER OG : rot -33:sc= 0.165 USER MOD Single : A 82 GLN : amide:sc= 0.639 K(o=0.64,f=0) USER MOD Single : A 84 LYS NZ :NH3+ -153:sc= 0.965 (180deg=0.701) USER MOD Single : A 88 SER OG : rot 180:sc= 0.0411 USER MOD Single : A 97 ASN : amide:sc= -0.058 X(o=-0.058,f=-0.043) USER MOD Single : A 102 THR OG1 : rot -81:sc= 1.38 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 TYR OH : rot 180:sc= 0 USER MOD Single : A 118 SER OG : rot 58:sc= 1.22 USER MOD Single : A 119 TYR OH : rot 180:sc= 0 USER MOD Single : A 127 SER OG : rot -16:sc= 0.595 USER MOD Single : A 135 ASN :FLIP amide:sc= -1.73! F(o=-2.5,f=-1.7!) USER MOD Single : A 136 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 139 THR OG1 : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot 180:sc= 0.174 USER MOD Single : A 144 ASN : amide:sc= -0.248 K(o=-0.25,f=-1.6!) USER MOD ----------------------------------------------------------------- ATOM 13 N GLN A 2 -12.387 15.061 4.378 1.00 25.00 N ATOM 14 CA GLN A 2 -11.195 14.257 4.039 1.00 25.00 C ATOM 15 C GLN A 2 -9.890 15.045 4.288 1.00 25.00 C ATOM 16 O GLN A 2 -9.884 15.983 5.080 1.00 25.00 O ATOM 17 CB GLN A 2 -11.296 13.615 2.628 1.00 25.00 C ATOM 18 CG GLN A 2 -11.187 14.542 1.411 1.00 25.00 C ATOM 19 CD GLN A 2 -11.345 13.782 0.107 1.00 25.00 C ATOM 20 OE1 GLN A 2 -11.439 12.567 0.095 1.00 25.00 O ATOM 21 NE2 GLN A 2 -11.388 14.494 -0.988 1.00 25.00 N ATOM 0 HA GLN A 2 -11.159 13.409 4.723 1.00 25.00 H new ATOM 0 HB2 GLN A 2 -10.513 12.861 2.546 1.00 25.00 H new ATOM 0 HB3 GLN A 2 -12.250 13.091 2.566 1.00 25.00 H new ATOM 0 HG2 GLN A 2 -11.951 15.317 1.475 1.00 25.00 H new ATOM 0 HG3 GLN A 2 -10.220 15.046 1.423 1.00 25.00 H new ATOM 0 HE21 GLN A 2 -11.306 15.510 -0.940 1.00 25.00 H new ATOM 0 HE22 GLN A 2 -11.504 14.034 -1.891 1.00 25.00 H new ATOM 30 N GLY A 3 -8.786 14.604 3.717 1.00 25.00 N ATOM 31 CA GLY A 3 -7.507 15.226 3.993 1.00 25.00 C ATOM 32 C GLY A 3 -7.162 16.358 3.052 1.00 25.00 C ATOM 33 O GLY A 3 -7.710 16.485 1.959 1.00 25.00 O ATOM 0 H GLY A 3 -8.749 13.822 3.063 1.00 25.00 H new ATOM 0 HA2 GLY A 3 -7.511 15.604 5.015 1.00 25.00 H new ATOM 0 HA3 GLY A 3 -6.726 14.468 3.936 1.00 25.00 H new ATOM 37 N THR A 4 -6.211 17.161 3.489 1.00 25.00 N ATOM 38 CA THR A 4 -5.704 18.298 2.722 1.00 25.00 C ATOM 39 C THR A 4 -4.188 18.248 2.877 1.00 25.00 C ATOM 40 O THR A 4 -3.655 17.258 3.387 1.00 25.00 O ATOM 41 CB THR A 4 -6.341 19.630 3.234 1.00 25.00 C ATOM 42 OG1 THR A 4 -5.919 20.717 2.407 1.00 25.00 O ATOM 43 CG2 THR A 4 -5.968 19.937 4.693 1.00 25.00 C ATOM 0 H THR A 4 -5.759 17.046 4.396 1.00 25.00 H new ATOM 0 HA THR A 4 -5.970 18.252 1.666 1.00 25.00 H new ATOM 0 HB THR A 4 -7.423 19.507 3.185 1.00 25.00 H new ATOM 0 HG1 THR A 4 -6.322 21.550 2.730 1.00 25.00 H new ATOM 0 HG21 THR A 4 -6.436 20.873 4.999 1.00 25.00 H new ATOM 0 HG22 THR A 4 -6.318 19.129 5.336 1.00 25.00 H new ATOM 0 HG23 THR A 4 -4.885 20.027 4.780 1.00 25.00 H new ATOM 51 N ASP A 5 -3.466 19.269 2.444 1.00 25.00 N ATOM 52 CA ASP A 5 -2.016 19.281 2.622 1.00 25.00 C ATOM 53 C ASP A 5 -1.692 19.477 4.101 1.00 25.00 C ATOM 54 O ASP A 5 -2.440 20.115 4.833 1.00 25.00 O ATOM 55 CB ASP A 5 -1.389 20.374 1.763 1.00 25.00 C ATOM 56 CG ASP A 5 -1.425 20.028 0.291 1.00 25.00 C ATOM 57 OD1 ASP A 5 -1.360 18.815 -0.036 1.00 25.00 O ATOM 58 OD2 ASP A 5 -1.531 20.947 -0.537 1.00 25.00 O ATOM 0 H ASP A 5 -3.848 20.089 1.974 1.00 25.00 H new ATOM 0 HA ASP A 5 -1.596 18.328 2.299 1.00 25.00 H new ATOM 0 HB2 ASP A 5 -1.918 21.313 1.928 1.00 25.00 H new ATOM 0 HB3 ASP A 5 -0.356 20.531 2.073 1.00 25.00 H new ATOM 63 N GLY A 6 -0.615 18.860 4.558 1.00 25.00 N ATOM 64 CA GLY A 6 -0.296 18.845 5.980 1.00 25.00 C ATOM 65 C GLY A 6 -0.696 17.511 6.577 1.00 25.00 C ATOM 66 O GLY A 6 -1.096 16.610 5.837 1.00 25.00 O ATOM 0 H GLY A 6 0.053 18.363 3.968 1.00 25.00 H new ATOM 0 HA2 GLY A 6 0.771 19.015 6.125 1.00 25.00 H new ATOM 0 HA3 GLY A 6 -0.820 19.654 6.489 1.00 25.00 H new ATOM 70 N ASN A 7 -0.550 17.338 7.877 1.00 25.00 N ATOM 71 CA ASN A 7 -0.825 16.037 8.510 1.00 25.00 C ATOM 72 C ASN A 7 -2.279 15.970 8.957 1.00 25.00 C ATOM 73 O ASN A 7 -2.761 16.879 9.616 1.00 25.00 O ATOM 74 CB ASN A 7 0.081 15.839 9.732 1.00 25.00 C ATOM 75 CG ASN A 7 1.550 15.708 9.365 1.00 25.00 C ATOM 76 OD1 ASN A 7 1.937 15.725 8.197 1.00 25.00 O ATOM 77 ND2 ASN A 7 2.379 15.604 10.369 1.00 25.00 N ATOM 0 H ASN A 7 -0.246 18.068 8.521 1.00 25.00 H new ATOM 0 HA ASN A 7 -0.629 15.252 7.780 1.00 25.00 H new ATOM 0 HB2 ASN A 7 -0.045 16.682 10.411 1.00 25.00 H new ATOM 0 HB3 ASN A 7 -0.235 14.946 10.271 1.00 25.00 H new ATOM 0 HD21 ASN A 7 3.382 15.534 10.197 1.00 25.00 H new ATOM 0 HD22 ASN A 7 2.023 15.593 11.325 1.00 25.00 H new ATOM 84 N ASP A 8 -2.966 14.885 8.612 1.00 25.00 N ATOM 85 CA ASP A 8 -4.375 14.700 8.974 1.00 25.00 C ATOM 86 C ASP A 8 -4.588 13.396 9.733 1.00 25.00 C ATOM 87 O ASP A 8 -3.863 12.416 9.536 1.00 25.00 O ATOM 88 CB ASP A 8 -5.254 14.626 7.728 1.00 25.00 C ATOM 89 CG ASP A 8 -5.271 15.910 6.945 1.00 25.00 C ATOM 90 OD1 ASP A 8 -5.761 16.928 7.445 1.00 50.00 O ATOM 91 OD2 ASP A 8 -4.827 15.876 5.773 1.00 50.00 O ATOM 0 H ASP A 8 -2.569 14.112 8.078 1.00 25.00 H new ATOM 0 HA ASP A 8 -4.644 15.555 9.595 1.00 25.00 H new ATOM 0 HB2 ASP A 8 -4.898 13.820 7.086 1.00 25.00 H new ATOM 0 HB3 ASP A 8 -6.272 14.373 8.023 1.00 25.00 H new ATOM 96 N VAL A 9 -5.632 13.366 10.546 1.00 25.00 N ATOM 97 CA VAL A 9 -6.081 12.139 11.201 1.00 25.00 C ATOM 98 C VAL A 9 -7.549 12.018 10.821 1.00 25.00 C ATOM 99 O VAL A 9 -8.348 12.894 11.140 1.00 25.00 O ATOM 100 CB VAL A 9 -5.906 12.193 12.744 1.00 25.00 C ATOM 101 CG1 VAL A 9 -6.421 10.895 13.391 1.00 25.00 C ATOM 102 CG2 VAL A 9 -4.420 12.398 13.111 1.00 25.00 C ATOM 0 H VAL A 9 -6.193 14.187 10.773 1.00 25.00 H new ATOM 0 HA VAL A 9 -5.491 11.280 10.882 1.00 25.00 H new ATOM 0 HB VAL A 9 -6.487 13.034 13.122 1.00 25.00 H new ATOM 0 HG11 VAL A 9 -6.291 10.951 14.472 1.00 25.00 H new ATOM 0 HG12 VAL A 9 -7.478 10.768 13.159 1.00 25.00 H new ATOM 0 HG13 VAL A 9 -5.859 10.046 13.001 1.00 25.00 H new ATOM 0 HG21 VAL A 9 -4.315 12.434 14.195 1.00 25.00 H new ATOM 0 HG22 VAL A 9 -3.830 11.571 12.716 1.00 25.00 H new ATOM 0 HG23 VAL A 9 -4.065 13.335 12.681 1.00 25.00 H new ATOM 112 N LEU A 10 -7.873 10.992 10.055 1.00 25.00 N ATOM 113 CA LEU A 10 -9.204 10.825 9.492 1.00 25.00 C ATOM 114 C LEU A 10 -9.762 9.493 9.948 1.00 25.00 C ATOM 115 O LEU A 10 -9.032 8.504 9.986 1.00 25.00 O ATOM 116 CB LEU A 10 -9.105 10.868 7.958 1.00 25.00 C ATOM 117 CG LEU A 10 -8.457 12.140 7.378 1.00 25.00 C ATOM 118 CD1 LEU A 10 -8.157 11.961 5.901 1.00 25.00 C ATOM 119 CD2 LEU A 10 -9.353 13.364 7.578 1.00 25.00 C ATOM 0 H LEU A 10 -7.221 10.249 9.804 1.00 25.00 H new ATOM 0 HA LEU A 10 -9.866 11.623 9.827 1.00 25.00 H new ATOM 0 HB2 LEU A 10 -8.533 10.003 7.622 1.00 25.00 H new ATOM 0 HB3 LEU A 10 -10.108 10.768 7.542 1.00 25.00 H new ATOM 0 HG LEU A 10 -7.524 12.306 7.916 1.00 25.00 H new ATOM 0 HD11 LEU A 10 -7.700 12.870 5.510 1.00 25.00 H new ATOM 0 HD12 LEU A 10 -7.472 11.124 5.768 1.00 25.00 H new ATOM 0 HD13 LEU A 10 -9.084 11.761 5.363 1.00 25.00 H new ATOM 0 HD21 LEU A 10 -8.866 14.244 7.158 1.00 25.00 H new ATOM 0 HD22 LEU A 10 -10.307 13.202 7.076 1.00 25.00 H new ATOM 0 HD23 LEU A 10 -9.525 13.519 8.643 1.00 25.00 H new ATOM 131 N ILE A 11 -11.037 9.474 10.307 1.00 25.00 N ATOM 132 CA ILE A 11 -11.703 8.277 10.817 1.00 25.00 C ATOM 133 C ILE A 11 -12.978 8.070 9.997 1.00 25.00 C ATOM 134 O ILE A 11 -13.733 9.021 9.797 1.00 25.00 O ATOM 135 CB ILE A 11 -12.103 8.452 12.336 1.00 25.00 C ATOM 136 CG1 ILE A 11 -10.862 8.784 13.206 1.00 25.00 C ATOM 137 CG2 ILE A 11 -12.820 7.193 12.875 1.00 25.00 C ATOM 138 CD1 ILE A 11 -9.786 7.667 13.301 1.00 25.00 C ATOM 0 H ILE A 11 -11.645 10.291 10.254 1.00 25.00 H new ATOM 0 HA ILE A 11 -11.027 7.426 10.735 1.00 25.00 H new ATOM 0 HB ILE A 11 -12.797 9.290 12.397 1.00 25.00 H new ATOM 0 HG12 ILE A 11 -10.392 9.683 12.807 1.00 25.00 H new ATOM 0 HG13 ILE A 11 -11.201 9.022 14.214 1.00 25.00 H new ATOM 0 HG21 ILE A 11 -13.082 7.344 13.922 1.00 25.00 H new ATOM 0 HG22 ILE A 11 -13.726 7.014 12.296 1.00 25.00 H new ATOM 0 HG23 ILE A 11 -12.158 6.332 12.788 1.00 25.00 H new ATOM 0 HD11 ILE A 11 -8.965 8.006 13.933 1.00 25.00 H new ATOM 0 HD12 ILE A 11 -10.230 6.770 13.733 1.00 25.00 H new ATOM 0 HD13 ILE A 11 -9.408 7.441 12.304 1.00 25.00 H new ATOM 150 N GLY A 12 -13.194 6.860 9.505 1.00 25.00 N ATOM 151 CA GLY A 12 -14.370 6.562 8.701 1.00 25.00 C ATOM 152 C GLY A 12 -15.549 6.083 9.526 1.00 25.00 C ATOM 153 O GLY A 12 -15.454 5.882 10.735 1.00 25.00 O ATOM 0 H GLY A 12 -12.569 6.067 9.649 1.00 25.00 H new ATOM 0 HA2 GLY A 12 -14.660 7.455 8.148 1.00 25.00 H new ATOM 0 HA3 GLY A 12 -14.116 5.800 7.965 1.00 25.00 H new ATOM 157 N SER A 13 -16.673 5.890 8.850 1.00 25.00 N ATOM 158 CA SER A 13 -17.920 5.444 9.471 1.00 25.00 C ATOM 159 C SER A 13 -18.398 4.152 8.804 1.00 25.00 C ATOM 160 O SER A 13 -17.744 3.644 7.892 1.00 25.00 O ATOM 161 CB SER A 13 -18.982 6.538 9.327 1.00 25.00 C ATOM 162 OG SER A 13 -19.269 6.775 7.966 1.00 25.00 O ATOM 0 H SER A 13 -16.749 6.039 7.844 1.00 25.00 H new ATOM 0 HA SER A 13 -17.750 5.250 10.530 1.00 25.00 H new ATOM 0 HB2 SER A 13 -19.891 6.241 9.850 1.00 25.00 H new ATOM 0 HB3 SER A 13 -18.631 7.457 9.796 1.00 25.00 H new ATOM 0 HG SER A 13 -18.504 7.218 7.543 1.00 25.00 H new ATOM 168 N ASP A 14 -19.526 3.617 9.245 1.00 25.00 N ATOM 169 CA ASP A 14 -20.031 2.339 8.733 1.00 25.00 C ATOM 170 C ASP A 14 -20.480 2.349 7.274 1.00 25.00 C ATOM 171 O ASP A 14 -20.457 1.314 6.616 1.00 25.00 O ATOM 172 CB ASP A 14 -21.213 1.883 9.585 1.00 25.00 C ATOM 173 CG ASP A 14 -20.814 1.612 11.013 1.00 25.00 C ATOM 174 OD1 ASP A 14 -19.909 0.780 11.235 1.00 25.00 O ATOM 175 OD2 ASP A 14 -21.363 2.280 11.909 1.00 25.00 O ATOM 0 H ASP A 14 -20.116 4.045 9.959 1.00 25.00 H new ATOM 0 HA ASP A 14 -19.181 1.659 8.790 1.00 25.00 H new ATOM 0 HB2 ASP A 14 -21.989 2.648 9.565 1.00 25.00 H new ATOM 0 HB3 ASP A 14 -21.644 0.980 9.152 1.00 25.00 H new ATOM 180 N VAL A 15 -20.902 3.501 6.773 1.00 25.00 N ATOM 181 CA VAL A 15 -21.368 3.594 5.383 1.00 25.00 C ATOM 182 C VAL A 15 -20.182 3.585 4.423 1.00 25.00 C ATOM 183 O VAL A 15 -19.035 3.780 4.845 1.00 25.00 O ATOM 184 CB VAL A 15 -22.240 4.865 5.150 1.00 25.00 C ATOM 185 CG1 VAL A 15 -23.494 4.815 6.038 1.00 25.00 C ATOM 186 CG2 VAL A 15 -21.449 6.150 5.446 1.00 25.00 C ATOM 0 H VAL A 15 -20.934 4.377 7.294 1.00 25.00 H new ATOM 0 HA VAL A 15 -21.993 2.723 5.187 1.00 25.00 H new ATOM 0 HB VAL A 15 -22.535 4.879 4.101 1.00 25.00 H new ATOM 0 HG11 VAL A 15 -24.096 5.707 5.868 1.00 25.00 H new ATOM 0 HG12 VAL A 15 -24.080 3.929 5.791 1.00 25.00 H new ATOM 0 HG13 VAL A 15 -23.196 4.773 7.086 1.00 25.00 H new ATOM 0 HG21 VAL A 15 -22.086 7.017 5.274 1.00 25.00 H new ATOM 0 HG22 VAL A 15 -21.119 6.143 6.485 1.00 25.00 H new ATOM 0 HG23 VAL A 15 -20.580 6.202 4.790 1.00 25.00 H new ATOM 196 N GLY A 16 -20.443 3.376 3.140 1.00 25.00 N ATOM 197 CA GLY A 16 -19.375 3.421 2.150 1.00 25.00 C ATOM 198 C GLY A 16 -18.881 4.841 1.971 1.00 25.00 C ATOM 199 O GLY A 16 -19.685 5.777 1.959 1.00 25.00 O ATOM 0 H GLY A 16 -21.370 3.177 2.764 1.00 25.00 H new ATOM 0 HA2 GLY A 16 -18.552 2.780 2.464 1.00 25.00 H new ATOM 0 HA3 GLY A 16 -19.736 3.032 1.198 1.00 25.00 H new ATOM 203 N GLU A 17 -17.565 5.017 1.882 1.00 25.00 N ATOM 204 CA GLU A 17 -16.955 6.349 1.834 1.00 25.00 C ATOM 205 C GLU A 17 -15.785 6.407 0.856 1.00 25.00 C ATOM 206 O GLU A 17 -15.255 5.385 0.431 1.00 25.00 O ATOM 207 CB GLU A 17 -16.432 6.730 3.228 1.00 25.00 C ATOM 208 CG GLU A 17 -17.523 6.948 4.271 1.00 25.00 C ATOM 209 CD GLU A 17 -17.008 6.770 5.680 1.00 25.00 C ATOM 210 OE1 GLU A 17 -16.534 5.655 5.988 1.00 50.00 O ATOM 211 OE2 GLU A 17 -17.138 7.690 6.510 1.00 50.00 O ATOM 0 H GLU A 17 -16.894 4.250 1.841 1.00 25.00 H new ATOM 0 HA GLU A 17 -17.726 7.044 1.501 1.00 25.00 H new ATOM 0 HB2 GLU A 17 -15.762 5.945 3.579 1.00 25.00 H new ATOM 0 HB3 GLU A 17 -15.839 7.641 3.144 1.00 25.00 H new ATOM 0 HG2 GLU A 17 -17.934 7.951 4.160 1.00 25.00 H new ATOM 0 HG3 GLU A 17 -18.339 6.248 4.093 1.00 25.00 H new ATOM 218 N GLN A 18 -15.355 7.623 0.545 1.00 25.00 N ATOM 219 CA GLN A 18 -14.185 7.863 -0.288 1.00 25.00 C ATOM 220 C GLN A 18 -13.369 8.906 0.468 1.00 25.00 C ATOM 221 O GLN A 18 -13.878 9.989 0.754 1.00 25.00 O ATOM 222 CB GLN A 18 -14.627 8.362 -1.664 1.00 25.00 C ATOM 223 CG GLN A 18 -13.475 8.683 -2.628 1.00 25.00 C ATOM 224 CD GLN A 18 -13.948 9.053 -4.035 1.00 25.00 C ATOM 225 OE1 GLN A 18 -15.239 9.033 -4.258 1.00 25.00 O flip ATOM 226 NE2 GLN A 18 -13.150 9.349 -4.906 1.00 25.00 N flip ATOM 0 H GLN A 18 -15.812 8.476 0.866 1.00 25.00 H new ATOM 0 HA GLN A 18 -13.593 6.965 -0.466 1.00 25.00 H new ATOM 0 HB2 GLN A 18 -15.267 7.607 -2.122 1.00 25.00 H new ATOM 0 HB3 GLN A 18 -15.234 9.258 -1.533 1.00 25.00 H new ATOM 0 HG2 GLN A 18 -12.889 9.507 -2.221 1.00 25.00 H new ATOM 0 HG3 GLN A 18 -12.812 7.820 -2.690 1.00 25.00 H new ATOM 0 HE21 GLN A 18 -12.151 9.355 -4.701 1.00 25.00 H new ATOM 0 HE22 GLN A 18 -13.481 9.590 -5.840 1.00 25.00 H new ATOM 235 N ILE A 19 -12.161 8.535 0.878 1.00 25.00 N ATOM 236 CA ILE A 19 -11.340 9.392 1.736 1.00 25.00 C ATOM 237 C ILE A 19 -9.895 9.425 1.240 1.00 25.00 C ATOM 238 O ILE A 19 -9.197 8.416 1.252 1.00 25.00 O ATOM 239 CB ILE A 19 -11.322 8.876 3.218 1.00 25.00 C ATOM 240 CG1 ILE A 19 -12.759 8.605 3.734 1.00 25.00 C ATOM 241 CG2 ILE A 19 -10.612 9.900 4.140 1.00 25.00 C ATOM 242 CD1 ILE A 19 -12.834 7.937 5.121 1.00 25.00 C ATOM 0 H ILE A 19 -11.725 7.646 0.632 1.00 25.00 H new ATOM 0 HA ILE A 19 -11.782 10.388 1.698 1.00 25.00 H new ATOM 0 HB ILE A 19 -10.769 7.937 3.237 1.00 25.00 H new ATOM 0 HG12 ILE A 19 -13.300 9.550 3.772 1.00 25.00 H new ATOM 0 HG13 ILE A 19 -13.275 7.971 3.013 1.00 25.00 H new ATOM 0 HG21 ILE A 19 -10.608 9.526 5.164 1.00 25.00 H new ATOM 0 HG22 ILE A 19 -9.586 10.043 3.802 1.00 25.00 H new ATOM 0 HG23 ILE A 19 -11.142 10.852 4.103 1.00 25.00 H new ATOM 0 HD11 ILE A 19 -13.878 7.788 5.397 1.00 25.00 H new ATOM 0 HD12 ILE A 19 -12.326 6.973 5.089 1.00 25.00 H new ATOM 0 HD13 ILE A 19 -12.351 8.577 5.860 1.00 25.00 H new ATOM 254 N SER A 20 -9.436 10.592 0.833 1.00 25.00 N ATOM 255 CA SER A 20 -8.046 10.775 0.418 1.00 25.00 C ATOM 256 C SER A 20 -7.318 11.567 1.492 1.00 25.00 C ATOM 257 O SER A 20 -7.919 12.398 2.170 1.00 25.00 O ATOM 258 CB SER A 20 -7.981 11.499 -0.926 1.00 25.00 C ATOM 259 OG SER A 20 -8.494 12.817 -0.825 1.00 25.00 O ATOM 0 H SER A 20 -10.004 11.437 0.778 1.00 25.00 H new ATOM 0 HA SER A 20 -7.567 9.804 0.294 1.00 25.00 H new ATOM 0 HB2 SER A 20 -6.948 11.534 -1.274 1.00 25.00 H new ATOM 0 HB3 SER A 20 -8.549 10.941 -1.670 1.00 25.00 H new ATOM 0 HG SER A 20 -8.439 13.257 -1.699 1.00 25.00 H new ATOM 265 N GLY A 21 -6.033 11.293 1.671 1.00 25.00 N ATOM 266 CA GLY A 21 -5.252 11.980 2.693 1.00 25.00 C ATOM 267 C GLY A 21 -4.492 13.189 2.183 1.00 25.00 C ATOM 268 O GLY A 21 -4.129 14.071 2.964 1.00 25.00 O ATOM 0 H GLY A 21 -5.512 10.606 1.127 1.00 25.00 H new ATOM 0 HA2 GLY A 21 -5.920 12.296 3.494 1.00 25.00 H new ATOM 0 HA3 GLY A 21 -4.543 11.276 3.128 1.00 25.00 H new ATOM 272 N GLY A 22 -4.212 13.234 0.887 1.00 25.00 N ATOM 273 CA GLY A 22 -3.438 14.331 0.328 1.00 25.00 C ATOM 274 C GLY A 22 -1.970 14.233 0.712 1.00 25.00 C ATOM 275 O GLY A 22 -1.490 13.156 1.106 1.00 25.00 O ATOM 0 H GLY A 22 -4.507 12.530 0.210 1.00 25.00 H new ATOM 0 HA2 GLY A 22 -3.532 14.327 -0.758 1.00 25.00 H new ATOM 0 HA3 GLY A 22 -3.844 15.280 0.679 1.00 25.00 H new ATOM 279 N ALA A 23 -1.238 15.335 0.620 1.00 25.00 N ATOM 280 CA ALA A 23 0.171 15.337 1.010 1.00 25.00 C ATOM 281 C ALA A 23 0.278 15.270 2.540 1.00 25.00 C ATOM 282 O ALA A 23 -0.732 15.342 3.243 1.00 25.00 O ATOM 283 CB ALA A 23 0.870 16.595 0.484 1.00 25.00 C ATOM 0 H ALA A 23 -1.589 16.232 0.283 1.00 25.00 H new ATOM 0 HA ALA A 23 0.662 14.466 0.576 1.00 25.00 H new ATOM 0 HB1 ALA A 23 1.918 16.581 0.783 1.00 25.00 H new ATOM 0 HB2 ALA A 23 0.803 16.620 -0.604 1.00 25.00 H new ATOM 0 HB3 ALA A 23 0.387 17.480 0.898 1.00 25.00 H new ATOM 289 N GLY A 24 1.494 15.139 3.043 1.00 25.00 N ATOM 290 CA GLY A 24 1.726 15.074 4.482 1.00 25.00 C ATOM 291 C GLY A 24 1.542 13.686 5.062 1.00 25.00 C ATOM 292 O GLY A 24 1.083 12.769 4.363 1.00 25.00 O ATOM 0 H GLY A 24 2.340 15.075 2.477 1.00 25.00 H new ATOM 0 HA2 GLY A 24 2.739 15.417 4.695 1.00 25.00 H new ATOM 0 HA3 GLY A 24 1.045 15.762 4.983 1.00 25.00 H new ATOM 296 N ASP A 25 1.918 13.526 6.323 1.00 25.00 N ATOM 297 CA ASP A 25 1.831 12.241 7.016 1.00 25.00 C ATOM 298 C ASP A 25 0.429 12.085 7.567 1.00 25.00 C ATOM 299 O ASP A 25 0.027 12.828 8.458 1.00 25.00 O ATOM 300 CB ASP A 25 2.802 12.189 8.196 1.00 25.00 C ATOM 301 CG ASP A 25 4.222 11.873 7.776 1.00 25.00 C ATOM 302 OD1 ASP A 25 4.585 12.023 6.581 1.00 25.00 O ATOM 303 OD2 ASP A 25 4.984 11.401 8.657 1.00 25.00 O ATOM 0 H ASP A 25 2.292 14.281 6.898 1.00 25.00 H new ATOM 0 HA ASP A 25 2.078 11.449 6.309 1.00 25.00 H new ATOM 0 HB2 ASP A 25 2.787 13.147 8.715 1.00 25.00 H new ATOM 0 HB3 ASP A 25 2.462 11.436 8.907 1.00 25.00 H new ATOM 308 N ASP A 26 -0.326 11.136 7.041 1.00 25.00 N ATOM 309 CA ASP A 26 -1.724 10.996 7.422 1.00 25.00 C ATOM 310 C ASP A 26 -2.053 9.664 8.077 1.00 25.00 C ATOM 311 O ASP A 26 -1.348 8.664 7.898 1.00 25.00 O ATOM 312 CB ASP A 26 -2.606 11.161 6.186 1.00 25.00 C ATOM 313 CG ASP A 26 -2.348 12.462 5.465 1.00 25.00 C ATOM 314 OD1 ASP A 26 -2.375 13.530 6.103 1.00 50.00 O ATOM 315 OD2 ASP A 26 -2.095 12.434 4.241 1.00 50.00 O ATOM 0 H ASP A 26 0.000 10.456 6.355 1.00 25.00 H new ATOM 0 HA ASP A 26 -1.916 11.773 8.162 1.00 25.00 H new ATOM 0 HB2 ASP A 26 -2.430 10.329 5.504 1.00 25.00 H new ATOM 0 HB3 ASP A 26 -3.654 11.114 6.482 1.00 25.00 H new ATOM 320 N ARG A 27 -3.173 9.653 8.781 1.00 25.00 N ATOM 321 CA ARG A 27 -3.759 8.432 9.319 1.00 25.00 C ATOM 322 C ARG A 27 -5.155 8.410 8.745 1.00 25.00 C ATOM 323 O ARG A 27 -5.856 9.410 8.837 1.00 25.00 O ATOM 324 CB ARG A 27 -3.827 8.477 10.844 1.00 25.00 C ATOM 325 CG ARG A 27 -2.482 8.671 11.518 1.00 25.00 C ATOM 326 CD ARG A 27 -2.639 8.533 13.019 1.00 25.00 C ATOM 327 NE ARG A 27 -1.405 8.907 13.735 1.00 25.00 N ATOM 328 CZ ARG A 27 -1.203 8.755 15.041 1.00 25.00 C ATOM 329 NH1 ARG A 27 -2.108 8.223 15.831 1.00 25.00 N ATOM 330 NH2 ARG A 27 -0.071 9.147 15.560 1.00 25.00 N ATOM 0 H ARG A 27 -3.706 10.495 8.998 1.00 25.00 H new ATOM 0 HA ARG A 27 -3.172 7.550 9.061 1.00 25.00 H new ATOM 0 HB2 ARG A 27 -4.492 9.287 11.144 1.00 25.00 H new ATOM 0 HB3 ARG A 27 -4.272 7.550 11.205 1.00 25.00 H new ATOM 0 HG2 ARG A 27 -1.769 7.934 11.148 1.00 25.00 H new ATOM 0 HG3 ARG A 27 -2.080 9.654 11.273 1.00 25.00 H new ATOM 0 HD2 ARG A 27 -3.461 9.163 13.358 1.00 25.00 H new ATOM 0 HD3 ARG A 27 -2.904 7.504 13.264 1.00 25.00 H new ATOM 0 HE ARG A 27 -0.648 9.314 13.186 1.00 25.00 H new ATOM 0 HH11 ARG A 27 -3.000 7.911 15.447 1.00 25.00 H new ATOM 0 HH12 ARG A 27 -1.919 8.122 16.828 1.00 25.00 H new ATOM 0 HH21 ARG A 27 0.645 9.564 14.966 1.00 25.00 H new ATOM 0 HH22 ARG A 27 0.097 9.036 16.560 1.00 25.00 H new ATOM 344 N LEU A 28 -5.531 7.315 8.118 1.00 25.00 N ATOM 345 CA LEU A 28 -6.840 7.182 7.494 1.00 25.00 C ATOM 346 C LEU A 28 -7.448 5.904 8.023 1.00 25.00 C ATOM 347 O LEU A 28 -6.736 4.921 8.251 1.00 25.00 O ATOM 348 CB LEU A 28 -6.723 7.076 5.968 1.00 25.00 C ATOM 349 CG LEU A 28 -6.187 8.290 5.194 1.00 25.00 C ATOM 350 CD1 LEU A 28 -4.665 8.235 5.006 1.00 25.00 C ATOM 351 CD2 LEU A 28 -6.859 8.340 3.825 1.00 25.00 C ATOM 0 H LEU A 28 -4.940 6.489 8.024 1.00 25.00 H new ATOM 0 HA LEU A 28 -7.448 8.057 7.723 1.00 25.00 H new ATOM 0 HB2 LEU A 28 -6.079 6.226 5.742 1.00 25.00 H new ATOM 0 HB3 LEU A 28 -7.712 6.840 5.574 1.00 25.00 H new ATOM 0 HG LEU A 28 -6.415 9.184 5.775 1.00 25.00 H new ATOM 0 HD11 LEU A 28 -4.335 9.115 4.454 1.00 25.00 H new ATOM 0 HD12 LEU A 28 -4.178 8.215 5.981 1.00 25.00 H new ATOM 0 HD13 LEU A 28 -4.399 7.336 4.450 1.00 25.00 H new ATOM 0 HD21 LEU A 28 -6.485 9.199 3.267 1.00 25.00 H new ATOM 0 HD22 LEU A 28 -6.635 7.425 3.276 1.00 25.00 H new ATOM 0 HD23 LEU A 28 -7.938 8.432 3.952 1.00 25.00 H new ATOM 363 N ASP A 29 -8.755 5.906 8.174 1.00 25.00 N ATOM 364 CA ASP A 29 -9.496 4.725 8.577 1.00 25.00 C ATOM 365 C ASP A 29 -10.771 4.760 7.754 1.00 25.00 C ATOM 366 O ASP A 29 -11.314 5.827 7.502 1.00 25.00 O ATOM 367 CB ASP A 29 -9.814 4.751 10.081 1.00 25.00 C ATOM 368 CG ASP A 29 -10.177 3.372 10.626 1.00 25.00 C ATOM 369 OD1 ASP A 29 -10.864 2.601 9.917 1.00 25.00 O ATOM 370 OD2 ASP A 29 -9.752 3.053 11.752 1.00 25.00 O ATOM 0 H ASP A 29 -9.338 6.729 8.021 1.00 25.00 H new ATOM 0 HA ASP A 29 -8.923 3.813 8.408 1.00 25.00 H new ATOM 0 HB2 ASP A 29 -8.952 5.138 10.625 1.00 25.00 H new ATOM 0 HB3 ASP A 29 -10.640 5.439 10.263 1.00 25.00 H new ATOM 375 N GLY A 30 -11.206 3.604 7.301 1.00 25.00 N ATOM 376 CA GLY A 30 -12.402 3.492 6.494 1.00 25.00 C ATOM 377 C GLY A 30 -13.575 2.965 7.293 1.00 25.00 C ATOM 378 O GLY A 30 -14.725 3.171 6.927 1.00 25.00 O ATOM 0 H GLY A 30 -10.740 2.715 7.482 1.00 25.00 H new ATOM 0 HA2 GLY A 30 -12.654 4.469 6.081 1.00 25.00 H new ATOM 0 HA3 GLY A 30 -12.210 2.829 5.651 1.00 25.00 H new ATOM 382 N GLY A 31 -13.300 2.257 8.379 1.00 25.00 N ATOM 383 CA GLY A 31 -14.365 1.640 9.150 1.00 25.00 C ATOM 384 C GLY A 31 -15.069 0.549 8.356 1.00 25.00 C ATOM 385 O GLY A 31 -14.511 -0.002 7.395 1.00 25.00 O ATOM 0 H GLY A 31 -12.360 2.098 8.741 1.00 25.00 H new ATOM 0 HA2 GLY A 31 -13.954 1.217 10.066 1.00 25.00 H new ATOM 0 HA3 GLY A 31 -15.088 2.400 9.446 1.00 25.00 H new ATOM 389 N ALA A 32 -16.295 0.223 8.736 1.00 25.00 N ATOM 390 CA ALA A 32 -17.064 -0.788 8.019 1.00 25.00 C ATOM 391 C ALA A 32 -17.531 -0.231 6.659 1.00 25.00 C ATOM 392 O ALA A 32 -17.322 0.949 6.339 1.00 25.00 O ATOM 393 CB ALA A 32 -18.260 -1.241 8.870 1.00 25.00 C ATOM 0 H ALA A 32 -16.778 0.640 9.532 1.00 25.00 H new ATOM 0 HA ALA A 32 -16.431 -1.655 7.832 1.00 25.00 H new ATOM 0 HB1 ALA A 32 -18.828 -1.996 8.326 1.00 25.00 H new ATOM 0 HB2 ALA A 32 -17.900 -1.664 9.808 1.00 25.00 H new ATOM 0 HB3 ALA A 32 -18.902 -0.385 9.080 1.00 25.00 H new ATOM 399 N GLY A 33 -18.126 -1.096 5.854 1.00 25.00 N ATOM 400 CA GLY A 33 -18.576 -0.712 4.528 1.00 25.00 C ATOM 401 C GLY A 33 -17.446 -0.717 3.521 1.00 25.00 C ATOM 402 O GLY A 33 -16.270 -0.800 3.897 1.00 25.00 O ATOM 0 H GLY A 33 -18.308 -2.070 6.097 1.00 25.00 H new ATOM 0 HA2 GLY A 33 -19.358 -1.396 4.199 1.00 25.00 H new ATOM 0 HA3 GLY A 33 -19.020 0.283 4.570 1.00 25.00 H new ATOM 406 N ASP A 34 -17.790 -0.651 2.246 1.00 0.00 N ATOM 407 CA ASP A 34 -16.797 -0.679 1.172 1.00 25.00 C ATOM 408 C ASP A 34 -16.248 0.735 1.034 1.00 25.00 C ATOM 409 O ASP A 34 -17.020 1.692 1.029 1.00 25.00 O ATOM 410 CB ASP A 34 -17.466 -1.122 -0.137 1.00 25.00 C ATOM 411 CG ASP A 34 -18.048 -2.532 -0.052 1.00 25.00 C ATOM 412 OD1 ASP A 34 -17.669 -3.302 0.870 1.00 25.00 O ATOM 413 OD2 ASP A 34 -18.940 -2.842 -0.861 1.00 25.00 O ATOM 0 H ASP A 34 -18.754 -0.577 1.922 1.00 0.00 H new ATOM 0 HA ASP A 34 -15.994 -1.381 1.395 1.00 25.00 H new ATOM 0 HB2 ASP A 34 -18.260 -0.420 -0.390 1.00 25.00 H new ATOM 0 HB3 ASP A 34 -16.736 -1.083 -0.945 1.00 25.00 H new ATOM 418 N ASP A 35 -14.932 0.895 1.015 1.00 25.00 N ATOM 419 CA ASP A 35 -14.332 2.235 1.028 1.00 25.00 C ATOM 420 C ASP A 35 -13.212 2.416 0.014 1.00 25.00 C ATOM 421 O ASP A 35 -12.504 1.473 -0.330 1.00 25.00 O ATOM 422 CB ASP A 35 -13.763 2.532 2.423 1.00 25.00 C ATOM 423 CG ASP A 35 -14.817 2.480 3.508 1.00 25.00 C ATOM 424 OD1 ASP A 35 -15.789 3.262 3.467 1.00 50.00 O ATOM 425 OD2 ASP A 35 -14.657 1.691 4.471 1.00 50.00 O ATOM 0 H ASP A 35 -14.261 0.128 0.991 1.00 25.00 H new ATOM 0 HA ASP A 35 -15.133 2.924 0.760 1.00 25.00 H new ATOM 0 HB2 ASP A 35 -12.977 1.812 2.651 1.00 25.00 H new ATOM 0 HB3 ASP A 35 -13.300 3.519 2.419 1.00 25.00 H new ATOM 430 N LEU A 36 -13.029 3.654 -0.423 1.00 25.00 N ATOM 431 CA LEU A 36 -11.944 4.013 -1.340 1.00 25.00 C ATOM 432 C LEU A 36 -10.979 4.909 -0.568 1.00 25.00 C ATOM 433 O LEU A 36 -11.378 5.975 -0.092 1.00 25.00 O ATOM 434 CB LEU A 36 -12.487 4.777 -2.556 1.00 25.00 C ATOM 435 CG LEU A 36 -13.485 4.036 -3.458 1.00 25.00 C ATOM 436 CD1 LEU A 36 -14.942 4.349 -3.082 1.00 25.00 C ATOM 437 CD2 LEU A 36 -13.239 4.438 -4.919 1.00 25.00 C ATOM 0 H LEU A 36 -13.623 4.439 -0.156 1.00 25.00 H new ATOM 0 HA LEU A 36 -11.449 3.113 -1.704 1.00 25.00 H new ATOM 0 HB2 LEU A 36 -12.967 5.688 -2.197 1.00 25.00 H new ATOM 0 HB3 LEU A 36 -11.640 5.084 -3.169 1.00 25.00 H new ATOM 0 HG LEU A 36 -13.329 2.966 -3.323 1.00 25.00 H new ATOM 0 HD11 LEU A 36 -15.614 3.804 -3.745 1.00 25.00 H new ATOM 0 HD12 LEU A 36 -15.125 4.046 -2.051 1.00 25.00 H new ATOM 0 HD13 LEU A 36 -15.122 5.419 -3.183 1.00 25.00 H new ATOM 0 HD21 LEU A 36 -13.945 3.915 -5.564 1.00 25.00 H new ATOM 0 HD22 LEU A 36 -13.376 5.514 -5.028 1.00 25.00 H new ATOM 0 HD23 LEU A 36 -12.221 4.171 -5.203 1.00 25.00 H new ATOM 449 N LEU A 37 -9.736 4.480 -0.405 1.00 25.00 N ATOM 450 CA LEU A 37 -8.756 5.223 0.401 1.00 25.00 C ATOM 451 C LEU A 37 -7.472 5.541 -0.380 1.00 25.00 C ATOM 452 O LEU A 37 -6.800 4.642 -0.877 1.00 25.00 O ATOM 453 CB LEU A 37 -8.419 4.423 1.676 1.00 25.00 C ATOM 454 CG LEU A 37 -9.034 4.932 3.000 1.00 25.00 C ATOM 455 CD1 LEU A 37 -10.557 4.811 3.031 1.00 25.00 C ATOM 456 CD2 LEU A 37 -8.457 4.145 4.177 1.00 25.00 C ATOM 0 H LEU A 37 -9.374 3.620 -0.818 1.00 25.00 H new ATOM 0 HA LEU A 37 -9.209 6.177 0.670 1.00 25.00 H new ATOM 0 HB2 LEU A 37 -8.741 3.393 1.526 1.00 25.00 H new ATOM 0 HB3 LEU A 37 -7.335 4.405 1.789 1.00 25.00 H new ATOM 0 HG LEU A 37 -8.780 5.989 3.076 1.00 25.00 H new ATOM 0 HD11 LEU A 37 -10.932 5.183 3.984 1.00 25.00 H new ATOM 0 HD12 LEU A 37 -10.985 5.398 2.218 1.00 25.00 H new ATOM 0 HD13 LEU A 37 -10.841 3.765 2.913 1.00 25.00 H new ATOM 0 HD21 LEU A 37 -8.894 4.508 5.107 1.00 25.00 H new ATOM 0 HD22 LEU A 37 -8.689 3.087 4.056 1.00 25.00 H new ATOM 0 HD23 LEU A 37 -7.376 4.278 4.208 1.00 25.00 H new ATOM 468 N ASP A 38 -7.110 6.818 -0.437 1.00 25.00 N ATOM 469 CA ASP A 38 -5.897 7.252 -1.160 1.00 25.00 C ATOM 470 C ASP A 38 -4.884 7.873 -0.201 1.00 25.00 C ATOM 471 O ASP A 38 -5.192 8.821 0.524 1.00 25.00 O ATOM 472 CB ASP A 38 -6.236 8.282 -2.244 1.00 25.00 C ATOM 473 CG ASP A 38 -6.732 7.642 -3.534 1.00 25.00 C ATOM 474 OD1 ASP A 38 -7.634 6.780 -3.477 1.00 25.00 O ATOM 475 OD2 ASP A 38 -6.239 8.038 -4.609 1.00 25.00 O ATOM 0 H ASP A 38 -7.630 7.576 0.004 1.00 25.00 H new ATOM 0 HA ASP A 38 -5.468 6.364 -1.625 1.00 25.00 H new ATOM 0 HB2 ASP A 38 -6.998 8.963 -1.866 1.00 25.00 H new ATOM 0 HB3 ASP A 38 -5.351 8.881 -2.458 1.00 25.00 H new ATOM 480 N GLY A 39 -3.661 7.352 -0.193 1.00 25.00 N ATOM 481 CA GLY A 39 -2.652 7.844 0.736 1.00 25.00 C ATOM 482 C GLY A 39 -1.985 9.152 0.337 1.00 25.00 C ATOM 483 O GLY A 39 -1.779 10.045 1.177 1.00 25.00 O ATOM 0 H GLY A 39 -3.349 6.601 -0.809 1.00 25.00 H new ATOM 0 HA2 GLY A 39 -3.115 7.975 1.714 1.00 25.00 H new ATOM 0 HA3 GLY A 39 -1.881 7.081 0.847 1.00 25.00 H new ATOM 487 N GLY A 40 -1.620 9.273 -0.931 1.00 25.00 N ATOM 488 CA GLY A 40 -0.940 10.474 -1.411 1.00 25.00 C ATOM 489 C GLY A 40 0.493 10.579 -0.912 1.00 25.00 C ATOM 490 O GLY A 40 1.030 9.636 -0.302 1.00 25.00 O ATOM 0 H GLY A 40 -1.780 8.562 -1.644 1.00 25.00 H new ATOM 0 HA2 GLY A 40 -0.941 10.476 -2.501 1.00 25.00 H new ATOM 0 HA3 GLY A 40 -1.497 11.354 -1.090 1.00 25.00 H new ATOM 494 N ALA A 41 1.118 11.723 -1.148 1.00 25.00 N ATOM 495 CA ALA A 41 2.502 11.961 -0.727 1.00 25.00 C ATOM 496 C ALA A 41 2.630 11.933 0.810 1.00 25.00 C ATOM 497 O ALA A 41 1.636 12.109 1.522 1.00 25.00 O ATOM 498 CB ALA A 41 2.991 13.306 -1.284 1.00 25.00 C ATOM 0 H ALA A 41 0.689 12.511 -1.633 1.00 25.00 H new ATOM 0 HA ALA A 41 3.126 11.161 -1.126 1.00 25.00 H new ATOM 0 HB1 ALA A 41 4.020 13.478 -0.968 1.00 25.00 H new ATOM 0 HB2 ALA A 41 2.944 13.288 -2.373 1.00 25.00 H new ATOM 0 HB3 ALA A 41 2.357 14.108 -0.907 1.00 25.00 H new ATOM 504 N GLY A 42 3.839 11.695 1.300 1.00 25.00 N ATOM 505 CA GLY A 42 4.079 11.554 2.737 1.00 25.00 C ATOM 506 C GLY A 42 3.909 10.100 3.146 1.00 25.00 C ATOM 507 O GLY A 42 3.470 9.297 2.317 1.00 25.00 O ATOM 0 H GLY A 42 4.675 11.595 0.724 1.00 25.00 H new ATOM 0 HA2 GLY A 42 5.085 11.895 2.982 1.00 25.00 H new ATOM 0 HA3 GLY A 42 3.384 12.182 3.295 1.00 25.00 H new ATOM 511 N ARG A 43 4.246 9.746 4.380 1.00 25.00 N ATOM 512 CA ARG A 43 4.105 8.352 4.848 1.00 25.00 C ATOM 513 C ARG A 43 2.769 8.244 5.571 1.00 25.00 C ATOM 514 O ARG A 43 2.416 9.107 6.365 1.00 25.00 O ATOM 515 CB ARG A 43 5.289 7.938 5.744 1.00 25.00 C ATOM 516 CG ARG A 43 5.424 8.744 7.012 1.00 25.00 C ATOM 517 CD ARG A 43 6.733 8.531 7.743 1.00 25.00 C ATOM 518 NE ARG A 43 7.875 9.072 6.992 1.00 25.00 N ATOM 519 CZ ARG A 43 8.272 10.342 6.980 1.00 25.00 C ATOM 520 NH1 ARG A 43 7.651 11.298 7.625 1.00 25.00 N ATOM 521 NH2 ARG A 43 9.329 10.650 6.283 1.00 25.00 N ATOM 0 H ARG A 43 4.617 10.391 5.078 1.00 25.00 H new ATOM 0 HA ARG A 43 4.121 7.662 4.004 1.00 25.00 H new ATOM 0 HB2 ARG A 43 5.179 6.886 6.007 1.00 25.00 H new ATOM 0 HB3 ARG A 43 6.212 8.029 5.171 1.00 25.00 H new ATOM 0 HG2 ARG A 43 5.323 9.802 6.770 1.00 25.00 H new ATOM 0 HG3 ARG A 43 4.601 8.490 7.681 1.00 25.00 H new ATOM 0 HD2 ARG A 43 6.684 9.008 8.722 1.00 25.00 H new ATOM 0 HD3 ARG A 43 6.884 7.465 7.915 1.00 25.00 H new ATOM 0 HE ARG A 43 8.412 8.413 6.428 1.00 25.00 H new ATOM 0 HH11 ARG A 43 6.817 11.086 8.173 1.00 25.00 H new ATOM 0 HH12 ARG A 43 8.001 12.255 7.580 1.00 25.00 H new ATOM 0 HH21 ARG A 43 9.828 9.926 5.766 1.00 25.00 H new ATOM 0 HH22 ARG A 43 9.658 11.615 6.254 1.00 25.00 H new ATOM 535 N ASP A 44 1.984 7.245 5.210 1.00 25.00 N ATOM 536 CA ASP A 44 0.589 7.171 5.632 1.00 25.00 C ATOM 537 C ASP A 44 0.230 5.818 6.216 1.00 25.00 C ATOM 538 O ASP A 44 0.956 4.843 6.047 1.00 25.00 O ATOM 539 CB ASP A 44 -0.305 7.456 4.424 1.00 25.00 C ATOM 540 CG ASP A 44 0.049 8.759 3.742 1.00 25.00 C ATOM 541 OD1 ASP A 44 -0.093 9.818 4.383 1.00 50.00 O ATOM 542 OD2 ASP A 44 0.462 8.761 2.556 1.00 50.00 O ATOM 0 H ASP A 44 2.287 6.468 4.623 1.00 25.00 H new ATOM 0 HA ASP A 44 0.437 7.912 6.417 1.00 25.00 H new ATOM 0 HB2 ASP A 44 -0.217 6.638 3.709 1.00 25.00 H new ATOM 0 HB3 ASP A 44 -1.346 7.488 4.745 1.00 25.00 H new ATOM 547 N ARG A 45 -0.898 5.772 6.909 1.00 25.00 N ATOM 548 CA ARG A 45 -1.409 4.542 7.516 1.00 25.00 C ATOM 549 C ARG A 45 -2.866 4.475 7.114 1.00 25.00 C ATOM 550 O ARG A 45 -3.572 5.466 7.273 1.00 25.00 O ATOM 551 CB ARG A 45 -1.280 4.574 9.046 1.00 25.00 C ATOM 552 CG ARG A 45 0.168 4.641 9.557 1.00 25.00 C ATOM 553 CD ARG A 45 0.656 6.088 9.688 1.00 25.00 C ATOM 554 NE ARG A 45 2.080 6.174 10.056 1.00 25.00 N ATOM 555 CZ ARG A 45 2.847 7.248 9.886 1.00 25.00 C ATOM 556 NH1 ARG A 45 2.396 8.351 9.348 1.00 25.00 N ATOM 557 NH2 ARG A 45 4.095 7.210 10.271 1.00 25.00 N ATOM 0 H ARG A 45 -1.490 6.587 7.069 1.00 25.00 H new ATOM 0 HA ARG A 45 -0.845 3.672 7.180 1.00 25.00 H new ATOM 0 HB2 ARG A 45 -1.828 5.436 9.427 1.00 25.00 H new ATOM 0 HB3 ARG A 45 -1.758 3.685 9.458 1.00 25.00 H new ATOM 0 HG2 ARG A 45 0.236 4.145 10.525 1.00 25.00 H new ATOM 0 HG3 ARG A 45 0.821 4.097 8.874 1.00 25.00 H new ATOM 0 HD2 ARG A 45 0.496 6.608 8.744 1.00 25.00 H new ATOM 0 HD3 ARG A 45 0.058 6.603 10.440 1.00 25.00 H new ATOM 0 HE ARG A 45 2.510 5.348 10.472 1.00 25.00 H new ATOM 0 HH11 ARG A 45 1.425 8.409 9.042 1.00 25.00 H new ATOM 0 HH12 ARG A 45 3.015 9.153 9.235 1.00 25.00 H new ATOM 0 HH21 ARG A 45 4.472 6.363 10.697 1.00 25.00 H new ATOM 0 HH22 ARG A 45 4.692 8.027 10.146 1.00 25.00 H new ATOM 571 N LEU A 46 -3.283 3.371 6.519 1.00 25.00 N ATOM 572 CA LEU A 46 -4.623 3.260 5.934 1.00 25.00 C ATOM 573 C LEU A 46 -5.362 2.028 6.453 1.00 25.00 C ATOM 574 O LEU A 46 -5.097 0.927 6.010 1.00 25.00 O ATOM 575 CB LEU A 46 -4.501 3.169 4.400 1.00 25.00 C ATOM 576 CG LEU A 46 -3.802 4.364 3.728 1.00 25.00 C ATOM 577 CD1 LEU A 46 -2.450 3.933 3.152 1.00 25.00 C ATOM 578 CD2 LEU A 46 -4.666 4.946 2.617 1.00 25.00 C ATOM 0 H LEU A 46 -2.714 2.530 6.424 1.00 25.00 H new ATOM 0 HA LEU A 46 -5.193 4.144 6.221 1.00 25.00 H new ATOM 0 HB2 LEU A 46 -3.955 2.260 4.148 1.00 25.00 H new ATOM 0 HB3 LEU A 46 -5.501 3.068 3.977 1.00 25.00 H new ATOM 0 HG LEU A 46 -3.645 5.131 4.487 1.00 25.00 H new ATOM 0 HD11 LEU A 46 -1.967 4.788 2.680 1.00 25.00 H new ATOM 0 HD12 LEU A 46 -1.816 3.555 3.955 1.00 25.00 H new ATOM 0 HD13 LEU A 46 -2.604 3.148 2.411 1.00 25.00 H new ATOM 0 HD21 LEU A 46 -4.149 5.789 2.158 1.00 25.00 H new ATOM 0 HD22 LEU A 46 -4.853 4.181 1.863 1.00 25.00 H new ATOM 0 HD23 LEU A 46 -5.615 5.285 3.033 1.00 25.00 H new ATOM 590 N THR A 47 -6.279 2.216 7.382 1.00 25.00 N ATOM 591 CA THR A 47 -7.044 1.096 7.928 1.00 25.00 C ATOM 592 C THR A 47 -8.282 0.851 7.074 1.00 25.00 C ATOM 593 O THR A 47 -9.124 1.730 6.928 1.00 25.00 O ATOM 594 CB THR A 47 -7.486 1.390 9.377 1.00 25.00 C ATOM 595 OG1 THR A 47 -6.346 1.759 10.157 1.00 25.00 O ATOM 596 CG2 THR A 47 -8.123 0.181 10.027 1.00 25.00 C ATOM 0 H THR A 47 -6.517 3.126 7.777 1.00 25.00 H new ATOM 0 HA THR A 47 -6.405 0.213 7.922 1.00 25.00 H new ATOM 0 HB THR A 47 -8.217 2.197 9.337 1.00 25.00 H new ATOM 0 HG1 THR A 47 -6.626 1.948 11.077 1.00 25.00 H new ATOM 0 HG21 THR A 47 -8.420 0.430 11.046 1.00 25.00 H new ATOM 0 HG22 THR A 47 -9.002 -0.119 9.456 1.00 25.00 H new ATOM 0 HG23 THR A 47 -7.407 -0.640 10.048 1.00 25.00 H new ATOM 604 N GLY A 48 -8.376 -0.326 6.469 1.00 25.00 N ATOM 605 CA GLY A 48 -9.519 -0.619 5.611 1.00 25.00 C ATOM 606 C GLY A 48 -10.704 -1.131 6.398 1.00 25.00 C ATOM 607 O GLY A 48 -11.851 -0.729 6.148 1.00 25.00 O ATOM 0 H GLY A 48 -7.692 -1.078 6.552 1.00 25.00 H new ATOM 0 HA2 GLY A 48 -9.806 0.283 5.070 1.00 25.00 H new ATOM 0 HA3 GLY A 48 -9.232 -1.361 4.866 1.00 25.00 H new ATOM 611 N GLY A 49 -10.442 -2.021 7.341 1.00 25.00 N ATOM 612 CA GLY A 49 -11.507 -2.600 8.144 1.00 25.00 C ATOM 613 C GLY A 49 -12.393 -3.523 7.326 1.00 25.00 C ATOM 614 O GLY A 49 -12.025 -3.962 6.226 1.00 25.00 O ATOM 0 H GLY A 49 -9.506 -2.357 7.569 1.00 25.00 H new ATOM 0 HA2 GLY A 49 -11.074 -3.155 8.976 1.00 25.00 H new ATOM 0 HA3 GLY A 49 -12.112 -1.802 8.574 1.00 25.00 H new ATOM 618 N LEU A 50 -13.582 -3.809 7.840 1.00 25.00 N ATOM 619 CA LEU A 50 -14.538 -4.673 7.143 1.00 25.00 C ATOM 620 C LEU A 50 -14.997 -4.036 5.839 1.00 25.00 C ATOM 621 O LEU A 50 -14.944 -2.809 5.671 1.00 25.00 O ATOM 622 CB LEU A 50 -15.764 -4.942 8.022 1.00 25.00 C ATOM 623 CG LEU A 50 -15.513 -5.786 9.279 1.00 25.00 C ATOM 624 CD1 LEU A 50 -16.765 -5.781 10.154 1.00 25.00 C ATOM 625 CD2 LEU A 50 -15.141 -7.228 8.917 1.00 25.00 C ATOM 0 H LEU A 50 -13.912 -3.457 8.739 1.00 25.00 H new ATOM 0 HA LEU A 50 -14.031 -5.613 6.925 1.00 25.00 H new ATOM 0 HB2 LEU A 50 -16.185 -3.984 8.329 1.00 25.00 H new ATOM 0 HB3 LEU A 50 -16.519 -5.443 7.416 1.00 25.00 H new ATOM 0 HG LEU A 50 -14.677 -5.348 9.824 1.00 25.00 H new ATOM 0 HD11 LEU A 50 -16.587 -6.380 11.047 1.00 25.00 H new ATOM 0 HD12 LEU A 50 -17.001 -4.758 10.445 1.00 25.00 H new ATOM 0 HD13 LEU A 50 -17.601 -6.202 9.595 1.00 25.00 H new ATOM 0 HD21 LEU A 50 -14.970 -7.799 9.829 1.00 25.00 H new ATOM 0 HD22 LEU A 50 -15.954 -7.683 8.351 1.00 25.00 H new ATOM 0 HD23 LEU A 50 -14.234 -7.229 8.313 1.00 25.00 H new ATOM 637 N GLY A 51 -15.454 -4.880 4.929 1.00 25.00 N ATOM 638 CA GLY A 51 -15.906 -4.434 3.618 1.00 25.00 C ATOM 639 C GLY A 51 -14.813 -4.595 2.579 1.00 25.00 C ATOM 640 O GLY A 51 -13.640 -4.788 2.943 1.00 25.00 O ATOM 0 H GLY A 51 -15.523 -5.887 5.075 1.00 25.00 H new ATOM 0 HA2 GLY A 51 -16.784 -5.007 3.318 1.00 25.00 H new ATOM 0 HA3 GLY A 51 -16.210 -3.389 3.671 1.00 25.00 H new ATOM 644 N ALA A 52 -15.188 -4.526 1.310 1.00 25.00 N ATOM 645 CA ALA A 52 -14.248 -4.628 0.200 1.00 25.00 C ATOM 646 C ALA A 52 -13.704 -3.217 -0.037 1.00 25.00 C ATOM 647 O ALA A 52 -14.432 -2.311 -0.422 1.00 25.00 O ATOM 648 CB ALA A 52 -14.962 -5.163 -1.051 1.00 25.00 C ATOM 0 H ALA A 52 -16.157 -4.397 1.019 1.00 25.00 H new ATOM 0 HA ALA A 52 -13.437 -5.321 0.424 1.00 25.00 H new ATOM 0 HB1 ALA A 52 -14.250 -5.235 -1.873 1.00 25.00 H new ATOM 0 HB2 ALA A 52 -15.374 -6.150 -0.841 1.00 25.00 H new ATOM 0 HB3 ALA A 52 -15.769 -4.484 -1.328 1.00 25.00 H new ATOM 654 N ASP A 53 -12.438 -3.021 0.277 1.00 25.00 N ATOM 655 CA ASP A 53 -11.832 -1.700 0.224 1.00 25.00 C ATOM 656 C ASP A 53 -10.840 -1.635 -0.913 1.00 25.00 C ATOM 657 O ASP A 53 -10.183 -2.622 -1.223 1.00 25.00 O ATOM 658 CB ASP A 53 -11.113 -1.415 1.537 1.00 25.00 C ATOM 659 CG ASP A 53 -12.017 -1.547 2.731 1.00 25.00 C ATOM 660 OD1 ASP A 53 -13.021 -0.813 2.830 1.00 50.00 O ATOM 661 OD2 ASP A 53 -11.732 -2.390 3.611 1.00 50.00 O ATOM 0 H ASP A 53 -11.804 -3.763 0.573 1.00 25.00 H new ATOM 0 HA ASP A 53 -12.613 -0.956 0.065 1.00 25.00 H new ATOM 0 HB2 ASP A 53 -10.273 -2.102 1.644 1.00 25.00 H new ATOM 0 HB3 ASP A 53 -10.699 -0.407 1.509 1.00 25.00 H new ATOM 666 N THR A 54 -10.680 -0.472 -1.509 1.00 25.00 N ATOM 667 CA THR A 54 -9.683 -0.304 -2.552 1.00 25.00 C ATOM 668 C THR A 54 -8.765 0.836 -2.174 1.00 25.00 C ATOM 669 O THR A 54 -9.185 1.846 -1.597 1.00 25.00 O ATOM 670 CB THR A 54 -10.316 -0.109 -3.958 1.00 25.00 C ATOM 671 OG1 THR A 54 -9.279 -0.054 -4.939 1.00 25.00 O ATOM 672 CG2 THR A 54 -11.146 1.155 -4.055 1.00 25.00 C ATOM 0 H THR A 54 -11.221 0.366 -1.294 1.00 25.00 H new ATOM 0 HA THR A 54 -9.099 -1.221 -2.628 1.00 25.00 H new ATOM 0 HB THR A 54 -10.980 -0.956 -4.132 1.00 25.00 H new ATOM 0 HG1 THR A 54 -9.675 0.067 -5.827 1.00 25.00 H new ATOM 0 HG21 THR A 54 -11.564 1.240 -5.058 1.00 25.00 H new ATOM 0 HG22 THR A 54 -11.956 1.115 -3.327 1.00 25.00 H new ATOM 0 HG23 THR A 54 -10.516 2.021 -3.850 1.00 25.00 H new ATOM 680 N PHE A 55 -7.491 0.633 -2.436 1.00 25.00 N ATOM 681 CA PHE A 55 -6.468 1.596 -2.088 1.00 25.00 C ATOM 682 C PHE A 55 -5.778 1.967 -3.372 1.00 25.00 C ATOM 683 O PHE A 55 -5.402 1.086 -4.152 1.00 25.00 O ATOM 684 CB PHE A 55 -5.491 0.985 -1.085 1.00 25.00 C ATOM 685 CG PHE A 55 -6.167 0.457 0.152 1.00 25.00 C ATOM 686 CD1 PHE A 55 -6.401 1.296 1.255 1.00 25.00 C ATOM 687 CD2 PHE A 55 -6.599 -0.888 0.213 1.00 25.00 C ATOM 688 CE1 PHE A 55 -7.052 0.809 2.411 1.00 25.00 C ATOM 689 CE2 PHE A 55 -7.265 -1.377 1.362 1.00 25.00 C ATOM 690 CZ PHE A 55 -7.483 -0.527 2.458 1.00 25.00 C ATOM 0 H PHE A 55 -7.135 -0.205 -2.896 1.00 25.00 H new ATOM 0 HA PHE A 55 -6.892 2.482 -1.615 1.00 25.00 H new ATOM 0 HB2 PHE A 55 -4.944 0.174 -1.567 1.00 25.00 H new ATOM 0 HB3 PHE A 55 -4.757 1.738 -0.797 1.00 25.00 H new ATOM 0 HD1 PHE A 55 -6.079 2.326 1.219 1.00 25.00 H new ATOM 0 HD2 PHE A 55 -6.419 -1.547 -0.624 1.00 25.00 H new ATOM 0 HE1 PHE A 55 -7.218 1.462 3.255 1.00 25.00 H new ATOM 0 HE2 PHE A 55 -7.605 -2.402 1.396 1.00 25.00 H new ATOM 0 HZ PHE A 55 -7.983 -0.901 3.339 1.00 25.00 H new ATOM 700 N ARG A 56 -5.674 3.257 -3.645 1.00 25.00 N ATOM 701 CA ARG A 56 -5.182 3.705 -4.943 1.00 25.00 C ATOM 702 C ARG A 56 -4.017 4.666 -4.825 1.00 25.00 C ATOM 703 O ARG A 56 -3.914 5.454 -3.882 1.00 25.00 O ATOM 704 CB ARG A 56 -6.345 4.351 -5.702 1.00 25.00 C ATOM 705 CG ARG A 56 -6.085 4.615 -7.171 1.00 25.00 C ATOM 706 CD ARG A 56 -7.339 5.144 -7.825 1.00 25.00 C ATOM 707 NE ARG A 56 -7.114 5.516 -9.235 1.00 25.00 N ATOM 708 CZ ARG A 56 -7.214 4.697 -10.277 1.00 25.00 C ATOM 709 NH1 ARG A 56 -7.505 3.428 -10.162 1.00 25.00 N ATOM 710 NH2 ARG A 56 -7.015 5.171 -11.476 1.00 25.00 N ATOM 0 H ARG A 56 -5.919 4.006 -2.997 1.00 25.00 H new ATOM 0 HA ARG A 56 -4.804 2.840 -5.488 1.00 25.00 H new ATOM 0 HB2 ARG A 56 -7.219 3.706 -5.614 1.00 25.00 H new ATOM 0 HB3 ARG A 56 -6.595 5.295 -5.218 1.00 25.00 H new ATOM 0 HG2 ARG A 56 -5.274 5.335 -7.283 1.00 25.00 H new ATOM 0 HG3 ARG A 56 -5.766 3.697 -7.664 1.00 25.00 H new ATOM 0 HD2 ARG A 56 -8.123 4.388 -7.770 1.00 25.00 H new ATOM 0 HD3 ARG A 56 -7.696 6.014 -7.273 1.00 25.00 H new ATOM 0 HE ARG A 56 -6.860 6.485 -9.427 1.00 25.00 H new ATOM 0 HH11 ARG A 56 -7.667 3.024 -9.240 1.00 25.00 H new ATOM 0 HH12 ARG A 56 -7.570 2.842 -10.994 1.00 25.00 H new ATOM 0 HH21 ARG A 56 -6.786 6.157 -11.603 1.00 25.00 H new ATOM 0 HH22 ARG A 56 -7.088 4.556 -12.286 1.00 25.00 H new ATOM 724 N PHE A 57 -3.113 4.562 -5.787 1.00 25.00 N ATOM 725 CA PHE A 57 -1.983 5.463 -5.882 1.00 25.00 C ATOM 726 C PHE A 57 -2.463 6.822 -6.376 1.00 25.00 C ATOM 727 O PHE A 57 -3.383 6.908 -7.188 1.00 25.00 O ATOM 728 CB PHE A 57 -0.955 4.908 -6.884 1.00 25.00 C ATOM 729 CG PHE A 57 -1.482 4.832 -8.310 1.00 25.00 C ATOM 730 CD1 PHE A 57 -2.159 3.686 -8.768 1.00 25.00 C ATOM 731 CD2 PHE A 57 -1.321 5.925 -9.184 1.00 25.00 C ATOM 732 CE1 PHE A 57 -2.684 3.626 -10.081 1.00 25.00 C ATOM 733 CE2 PHE A 57 -1.843 5.876 -10.500 1.00 25.00 C ATOM 734 CZ PHE A 57 -2.529 4.719 -10.949 1.00 25.00 C ATOM 0 H PHE A 57 -3.145 3.853 -6.519 1.00 25.00 H new ATOM 0 HA PHE A 57 -1.521 5.561 -4.899 1.00 25.00 H new ATOM 0 HB2 PHE A 57 -0.065 5.537 -6.866 1.00 25.00 H new ATOM 0 HB3 PHE A 57 -0.648 3.912 -6.564 1.00 25.00 H new ATOM 0 HD1 PHE A 57 -2.280 2.840 -8.108 1.00 25.00 H new ATOM 0 HD2 PHE A 57 -0.796 6.807 -8.848 1.00 25.00 H new ATOM 0 HE1 PHE A 57 -3.204 2.740 -10.415 1.00 25.00 H new ATOM 0 HE2 PHE A 57 -1.718 6.720 -11.162 1.00 25.00 H new ATOM 0 HZ PHE A 57 -2.929 4.679 -11.951 1.00 25.00 H new ATOM 744 N ALA A 58 -1.766 7.870 -5.977 1.00 25.00 N ATOM 745 CA ALA A 58 -1.953 9.192 -6.563 1.00 25.00 C ATOM 746 C ALA A 58 -0.679 9.497 -7.360 1.00 25.00 C ATOM 747 O ALA A 58 -0.725 10.011 -8.477 1.00 25.00 O ATOM 748 CB ALA A 58 -2.186 10.240 -5.466 1.00 25.00 C ATOM 0 H ALA A 58 -1.058 7.834 -5.243 1.00 25.00 H new ATOM 0 HA ALA A 58 -2.829 9.219 -7.211 1.00 25.00 H new ATOM 0 HB1 ALA A 58 -2.323 11.220 -5.923 1.00 25.00 H new ATOM 0 HB2 ALA A 58 -3.077 9.977 -4.895 1.00 25.00 H new ATOM 0 HB3 ALA A 58 -1.323 10.268 -4.800 1.00 25.00 H new ATOM 754 N LEU A 59 0.456 9.118 -6.786 1.00 25.00 N ATOM 755 CA LEU A 59 1.757 9.292 -7.419 1.00 25.00 C ATOM 756 C LEU A 59 2.621 8.076 -7.084 1.00 25.00 C ATOM 757 O LEU A 59 2.435 7.445 -6.055 1.00 25.00 O ATOM 758 CB LEU A 59 2.406 10.583 -6.889 1.00 25.00 C ATOM 759 CG LEU A 59 3.728 11.055 -7.520 1.00 25.00 C ATOM 760 CD1 LEU A 59 3.577 11.350 -9.015 1.00 25.00 C ATOM 761 CD2 LEU A 59 4.228 12.301 -6.796 1.00 25.00 C ATOM 0 H LEU A 59 0.500 8.680 -5.866 1.00 25.00 H new ATOM 0 HA LEU A 59 1.655 9.374 -8.501 1.00 25.00 H new ATOM 0 HB2 LEU A 59 1.680 11.388 -7.000 1.00 25.00 H new ATOM 0 HB3 LEU A 59 2.577 10.453 -5.820 1.00 25.00 H new ATOM 0 HG LEU A 59 4.452 10.247 -7.415 1.00 25.00 H new ATOM 0 HD11 LEU A 59 4.534 11.680 -9.419 1.00 25.00 H new ATOM 0 HD12 LEU A 59 3.256 10.447 -9.534 1.00 25.00 H new ATOM 0 HD13 LEU A 59 2.833 12.134 -9.158 1.00 25.00 H new ATOM 0 HD21 LEU A 59 5.164 12.632 -7.246 1.00 25.00 H new ATOM 0 HD22 LEU A 59 3.485 13.094 -6.880 1.00 25.00 H new ATOM 0 HD23 LEU A 59 4.393 12.069 -5.744 1.00 25.00 H new ATOM 773 N ARG A 60 3.585 7.764 -7.935 1.00 25.00 N ATOM 774 CA ARG A 60 4.505 6.638 -7.696 1.00 25.00 C ATOM 775 C ARG A 60 5.326 6.805 -6.415 1.00 25.00 C ATOM 776 O ARG A 60 5.777 5.843 -5.813 1.00 25.00 O ATOM 777 CB ARG A 60 5.452 6.475 -8.902 1.00 25.00 C ATOM 778 CG ARG A 60 6.439 7.635 -9.099 1.00 25.00 C ATOM 779 CD ARG A 60 7.165 7.555 -10.422 1.00 25.00 C ATOM 780 NE ARG A 60 8.070 8.711 -10.579 1.00 25.00 N ATOM 781 CZ ARG A 60 8.751 9.010 -11.677 1.00 25.00 C ATOM 782 NH1 ARG A 60 8.672 8.296 -12.776 1.00 25.00 N ATOM 783 NH2 ARG A 60 9.523 10.055 -11.668 1.00 25.00 N ATOM 0 H ARG A 60 3.760 8.270 -8.803 1.00 25.00 H new ATOM 0 HA ARG A 60 3.893 5.745 -7.571 1.00 25.00 H new ATOM 0 HB2 ARG A 60 6.017 5.551 -8.782 1.00 25.00 H new ATOM 0 HB3 ARG A 60 4.853 6.367 -9.806 1.00 25.00 H new ATOM 0 HG2 ARG A 60 5.900 8.581 -9.040 1.00 25.00 H new ATOM 0 HG3 ARG A 60 7.167 7.631 -8.287 1.00 25.00 H new ATOM 0 HD2 ARG A 60 7.735 6.628 -10.476 1.00 25.00 H new ATOM 0 HD3 ARG A 60 6.444 7.535 -11.240 1.00 25.00 H new ATOM 0 HE ARG A 60 8.181 9.331 -9.777 1.00 25.00 H new ATOM 0 HH11 ARG A 60 8.069 7.474 -12.808 1.00 25.00 H new ATOM 0 HH12 ARG A 60 9.214 8.563 -13.598 1.00 25.00 H new ATOM 0 HH21 ARG A 60 9.596 10.628 -10.827 1.00 25.00 H new ATOM 0 HH22 ARG A 60 10.056 10.303 -12.502 1.00 25.00 H new ATOM 797 N GLU A 61 5.508 8.047 -6.000 1.00 25.00 N ATOM 798 CA GLU A 61 6.346 8.378 -4.849 1.00 25.00 C ATOM 799 C GLU A 61 5.576 8.233 -3.542 1.00 25.00 C ATOM 800 O GLU A 61 6.113 8.450 -2.460 1.00 25.00 O ATOM 801 CB GLU A 61 6.886 9.803 -5.017 1.00 25.00 C ATOM 802 CG GLU A 61 7.637 9.968 -6.347 1.00 25.00 C ATOM 803 CD GLU A 61 8.167 11.368 -6.595 1.00 25.00 C ATOM 804 OE1 GLU A 61 8.095 12.229 -5.699 1.00 25.00 O ATOM 805 OE2 GLU A 61 8.645 11.596 -7.733 1.00 25.00 O ATOM 0 H GLU A 61 5.081 8.858 -6.448 1.00 25.00 H new ATOM 0 HA GLU A 61 7.181 7.679 -4.804 1.00 25.00 H new ATOM 0 HB2 GLU A 61 6.060 10.513 -4.974 1.00 25.00 H new ATOM 0 HB3 GLU A 61 7.554 10.040 -4.189 1.00 25.00 H new ATOM 0 HG2 GLU A 61 8.471 9.267 -6.369 1.00 25.00 H new ATOM 0 HG3 GLU A 61 6.969 9.695 -7.164 1.00 25.00 H new ATOM 812 N ASP A 62 4.323 7.810 -3.634 1.00 25.00 N ATOM 813 CA ASP A 62 3.496 7.590 -2.451 1.00 25.00 C ATOM 814 C ASP A 62 4.023 6.414 -1.634 1.00 25.00 C ATOM 815 O ASP A 62 3.726 6.313 -0.435 1.00 25.00 O ATOM 816 CB ASP A 62 2.050 7.261 -2.846 1.00 25.00 C ATOM 817 CG ASP A 62 1.318 8.446 -3.444 1.00 25.00 C ATOM 818 OD1 ASP A 62 1.826 9.583 -3.353 1.00 25.00 O ATOM 819 OD2 ASP A 62 0.197 8.247 -3.950 1.00 25.00 O ATOM 0 H ASP A 62 3.854 7.611 -4.518 1.00 25.00 H new ATOM 0 HA ASP A 62 3.530 8.509 -1.865 1.00 25.00 H new ATOM 0 HB2 ASP A 62 2.052 6.441 -3.565 1.00 25.00 H new ATOM 0 HB3 ASP A 62 1.509 6.912 -1.967 1.00 25.00 H new ATOM 824 N SER A 63 4.761 5.524 -2.294 1.00 25.00 N ATOM 825 CA SER A 63 5.248 4.272 -1.696 1.00 25.00 C ATOM 826 C SER A 63 6.773 4.093 -1.805 1.00 25.00 C ATOM 827 O SER A 63 7.271 3.015 -2.128 1.00 25.00 O ATOM 828 CB SER A 63 4.554 3.099 -2.386 1.00 25.00 C ATOM 829 OG SER A 63 3.147 3.265 -2.355 1.00 25.00 O ATOM 0 H SER A 63 5.043 5.648 -3.266 1.00 25.00 H new ATOM 0 HA SER A 63 5.013 4.309 -0.632 1.00 25.00 H new ATOM 0 HB2 SER A 63 4.894 3.024 -3.419 1.00 25.00 H new ATOM 0 HB3 SER A 63 4.827 2.166 -1.892 1.00 25.00 H new ATOM 0 HG SER A 63 2.718 2.506 -2.803 1.00 25.00 H new ATOM 835 N HIS A 64 7.510 5.165 -1.557 1.00 25.00 N ATOM 836 CA HIS A 64 8.971 5.150 -1.703 1.00 25.00 C ATOM 837 C HIS A 64 9.716 4.994 -0.364 1.00 25.00 C ATOM 838 O HIS A 64 9.321 5.569 0.649 1.00 25.00 O ATOM 839 CB HIS A 64 9.389 6.462 -2.377 1.00 25.00 C ATOM 840 CG HIS A 64 10.868 6.611 -2.548 1.00 25.00 C ATOM 841 ND1 HIS A 64 11.683 5.693 -3.166 1.00 25.00 N ATOM 842 CD2 HIS A 64 11.707 7.616 -2.160 1.00 25.00 C ATOM 843 CE1 HIS A 64 12.933 6.151 -3.125 1.00 25.00 C ATOM 844 NE2 HIS A 64 13.007 7.327 -2.531 1.00 25.00 N ATOM 0 H HIS A 64 7.127 6.060 -1.253 1.00 25.00 H new ATOM 0 HA HIS A 64 9.242 4.282 -2.304 1.00 25.00 H new ATOM 0 HB2 HIS A 64 8.912 6.525 -3.355 1.00 25.00 H new ATOM 0 HB3 HIS A 64 9.015 7.298 -1.786 1.00 25.00 H new ATOM 0 HD1 HIS A 64 11.382 4.813 -3.584 1.00 25.00 H new ATOM 0 HD2 HIS A 64 11.399 8.510 -1.638 1.00 25.00 H new ATOM 0 HE1 HIS A 64 13.784 5.623 -3.529 1.00 25.00 H new ATOM 852 N ARG A 65 10.816 4.243 -0.359 1.00 25.00 N ATOM 853 CA ARG A 65 11.691 4.137 0.819 1.00 25.00 C ATOM 854 C ARG A 65 13.132 4.243 0.348 1.00 25.00 C ATOM 855 O ARG A 65 13.431 3.915 -0.799 1.00 25.00 O ATOM 856 CB ARG A 65 11.503 2.802 1.556 1.00 25.00 C ATOM 857 CG ARG A 65 10.086 2.549 2.049 1.00 25.00 C ATOM 858 CD ARG A 65 10.032 1.504 3.165 1.00 25.00 C ATOM 859 NE ARG A 65 10.688 0.241 2.793 1.00 25.00 N ATOM 860 CZ ARG A 65 10.458 -0.944 3.344 1.00 25.00 C ATOM 861 NH1 ARG A 65 9.584 -1.124 4.301 1.00 25.00 N ATOM 862 NH2 ARG A 65 11.130 -1.970 2.915 1.00 25.00 N ATOM 0 H ARG A 65 11.128 3.694 -1.160 1.00 25.00 H new ATOM 0 HA ARG A 65 11.437 4.938 1.514 1.00 25.00 H new ATOM 0 HB2 ARG A 65 11.793 1.989 0.890 1.00 25.00 H new ATOM 0 HB3 ARG A 65 12.182 2.773 2.408 1.00 25.00 H new ATOM 0 HG2 ARG A 65 9.658 3.484 2.410 1.00 25.00 H new ATOM 0 HG3 ARG A 65 9.468 2.217 1.215 1.00 25.00 H new ATOM 0 HD2 ARG A 65 10.509 1.907 4.058 1.00 25.00 H new ATOM 0 HD3 ARG A 65 8.991 1.306 3.422 1.00 25.00 H new ATOM 0 HE ARG A 65 11.381 0.280 2.045 1.00 25.00 H new ATOM 0 HH11 ARG A 65 9.045 -0.334 4.654 1.00 25.00 H new ATOM 0 HH12 ARG A 65 9.442 -2.055 4.694 1.00 25.00 H new ATOM 0 HH21 ARG A 65 11.817 -1.854 2.170 1.00 25.00 H new ATOM 0 HH22 ARG A 65 10.971 -2.891 3.323 1.00 25.00 H new ATOM 876 N SER A 66 14.014 4.674 1.238 1.00 25.00 N ATOM 877 CA SER A 66 15.439 4.803 0.944 1.00 25.00 C ATOM 878 C SER A 66 16.163 4.492 2.254 1.00 25.00 C ATOM 879 O SER A 66 15.519 4.443 3.306 1.00 25.00 O ATOM 880 CB SER A 66 15.739 6.229 0.471 1.00 25.00 C ATOM 881 OG SER A 66 15.603 7.157 1.534 1.00 25.00 O ATOM 0 H SER A 66 13.763 4.946 2.189 1.00 25.00 H new ATOM 0 HA SER A 66 15.763 4.128 0.152 1.00 25.00 H new ATOM 0 HB2 SER A 66 16.751 6.277 0.069 1.00 25.00 H new ATOM 0 HB3 SER A 66 15.061 6.497 -0.339 1.00 25.00 H new ATOM 0 HG SER A 66 14.869 6.878 2.120 1.00 25.00 H new ATOM 887 N PRO A 67 17.500 4.301 2.239 1.00 25.00 N ATOM 888 CA PRO A 67 18.117 4.047 3.550 1.00 25.00 C ATOM 889 C PRO A 67 18.125 5.277 4.471 1.00 25.00 C ATOM 890 O PRO A 67 18.390 5.170 5.662 1.00 25.00 O ATOM 891 CB PRO A 67 19.547 3.635 3.182 1.00 25.00 C ATOM 892 CG PRO A 67 19.817 4.366 1.922 1.00 25.00 C ATOM 893 CD PRO A 67 18.510 4.286 1.160 1.00 25.00 C ATOM 0 HA PRO A 67 17.565 3.297 4.116 1.00 25.00 H new ATOM 0 HB2 PRO A 67 20.255 3.911 3.963 1.00 25.00 H new ATOM 0 HB3 PRO A 67 19.629 2.557 3.044 1.00 25.00 H new ATOM 0 HG2 PRO A 67 20.103 5.400 2.115 1.00 25.00 H new ATOM 0 HG3 PRO A 67 20.633 3.908 1.363 1.00 25.00 H new ATOM 0 HD2 PRO A 67 18.387 5.128 0.479 1.00 25.00 H new ATOM 0 HD3 PRO A 67 18.447 3.379 0.560 1.00 25.00 H new ATOM 901 N LEU A 68 17.805 6.439 3.917 1.00 25.00 N ATOM 902 CA LEU A 68 17.757 7.679 4.685 1.00 25.00 C ATOM 903 C LEU A 68 16.399 7.853 5.361 1.00 25.00 C ATOM 904 O LEU A 68 16.207 8.774 6.150 1.00 25.00 O ATOM 905 CB LEU A 68 18.028 8.872 3.766 1.00 25.00 C ATOM 906 CG LEU A 68 19.366 8.842 3.006 1.00 25.00 C ATOM 907 CD1 LEU A 68 19.421 10.026 2.051 1.00 25.00 C ATOM 908 CD2 LEU A 68 20.568 8.885 3.964 1.00 25.00 C ATOM 0 H LEU A 68 17.573 6.550 2.930 1.00 25.00 H new ATOM 0 HA LEU A 68 18.524 7.629 5.458 1.00 25.00 H new ATOM 0 HB2 LEU A 68 17.220 8.936 3.038 1.00 25.00 H new ATOM 0 HB3 LEU A 68 17.992 9.783 4.364 1.00 25.00 H new ATOM 0 HG LEU A 68 19.424 7.906 2.451 1.00 25.00 H new ATOM 0 HD11 LEU A 68 20.366 10.012 1.508 1.00 25.00 H new ATOM 0 HD12 LEU A 68 18.595 9.961 1.343 1.00 25.00 H new ATOM 0 HD13 LEU A 68 19.341 10.954 2.617 1.00 25.00 H new ATOM 0 HD21 LEU A 68 21.493 8.862 3.388 1.00 25.00 H new ATOM 0 HD22 LEU A 68 20.530 9.801 4.554 1.00 25.00 H new ATOM 0 HD23 LEU A 68 20.534 8.023 4.630 1.00 25.00 H new ATOM 920 N GLY A 69 15.452 6.980 5.046 1.00 25.00 N ATOM 921 CA GLY A 69 14.137 7.053 5.663 1.00 25.00 C ATOM 922 C GLY A 69 13.031 6.467 4.809 1.00 25.00 C ATOM 923 O GLY A 69 13.206 6.209 3.620 1.00 25.00 O ATOM 0 H GLY A 69 15.568 6.221 4.374 1.00 25.00 H new ATOM 0 HA2 GLY A 69 14.164 6.528 6.618 1.00 25.00 H new ATOM 0 HA3 GLY A 69 13.904 8.096 5.879 1.00 25.00 H new ATOM 927 N THR A 70 11.874 6.268 5.418 1.00 25.00 N ATOM 928 CA THR A 70 10.717 5.730 4.707 1.00 25.00 C ATOM 929 C THR A 70 9.736 6.853 4.420 1.00 25.00 C ATOM 930 O THR A 70 9.581 7.769 5.226 1.00 25.00 O ATOM 931 CB THR A 70 10.010 4.605 5.528 1.00 25.00 C ATOM 932 OG1 THR A 70 8.836 4.172 4.831 1.00 25.00 O ATOM 933 CG2 THR A 70 9.585 5.075 6.925 1.00 25.00 C ATOM 0 H THR A 70 11.707 6.470 6.404 1.00 25.00 H new ATOM 0 HA THR A 70 11.065 5.290 3.772 1.00 25.00 H new ATOM 0 HB THR A 70 10.730 3.795 5.642 1.00 25.00 H new ATOM 0 HG1 THR A 70 8.393 3.465 5.345 1.00 25.00 H new ATOM 0 HG21 THR A 70 9.099 4.254 7.453 1.00 25.00 H new ATOM 0 HG22 THR A 70 10.464 5.396 7.484 1.00 25.00 H new ATOM 0 HG23 THR A 70 8.890 5.909 6.832 1.00 25.00 H new ATOM 941 N PHE A 71 9.081 6.778 3.276 1.00 25.00 N ATOM 942 CA PHE A 71 8.075 7.748 2.876 1.00 25.00 C ATOM 943 C PHE A 71 6.885 6.954 2.351 1.00 25.00 C ATOM 944 O PHE A 71 5.982 7.490 1.719 1.00 25.00 O ATOM 945 CB PHE A 71 8.649 8.674 1.805 1.00 25.00 C ATOM 946 CG PHE A 71 10.003 9.236 2.165 1.00 25.00 C ATOM 947 CD1 PHE A 71 10.105 10.417 2.930 1.00 25.00 C ATOM 948 CD2 PHE A 71 11.182 8.572 1.765 1.00 25.00 C ATOM 949 CE1 PHE A 71 11.369 10.925 3.312 1.00 25.00 C ATOM 950 CE2 PHE A 71 12.454 9.071 2.137 1.00 25.00 C ATOM 951 CZ PHE A 71 12.547 10.249 2.918 1.00 25.00 C ATOM 0 H PHE A 71 9.233 6.037 2.592 1.00 25.00 H new ATOM 0 HA PHE A 71 7.765 8.378 3.710 1.00 25.00 H new ATOM 0 HB2 PHE A 71 8.729 8.127 0.866 1.00 25.00 H new ATOM 0 HB3 PHE A 71 7.955 9.497 1.636 1.00 25.00 H new ATOM 0 HD1 PHE A 71 9.208 10.939 3.227 1.00 25.00 H new ATOM 0 HD2 PHE A 71 11.114 7.674 1.169 1.00 25.00 H new ATOM 0 HE1 PHE A 71 11.434 11.827 3.903 1.00 25.00 H new ATOM 0 HE2 PHE A 71 13.350 8.555 1.826 1.00 25.00 H new ATOM 0 HZ PHE A 71 13.514 10.630 3.212 1.00 25.00 H new ATOM 961 N SER A 72 6.933 5.649 2.601 1.00 25.00 N ATOM 962 CA SER A 72 5.935 4.710 2.100 1.00 25.00 C ATOM 963 C SER A 72 4.814 4.515 3.106 1.00 25.00 C ATOM 964 O SER A 72 4.838 5.088 4.196 1.00 25.00 O ATOM 965 CB SER A 72 6.594 3.367 1.797 1.00 25.00 C ATOM 966 OG SER A 72 5.740 2.549 1.024 1.00 25.00 O ATOM 0 H SER A 72 7.667 5.212 3.158 1.00 25.00 H new ATOM 0 HA SER A 72 5.507 5.123 1.186 1.00 25.00 H new ATOM 0 HB2 SER A 72 7.530 3.529 1.263 1.00 25.00 H new ATOM 0 HB3 SER A 72 6.843 2.861 2.730 1.00 25.00 H new ATOM 0 HG SER A 72 6.262 2.095 0.330 1.00 25.00 H new ATOM 972 N ASP A 73 3.828 3.721 2.723 1.00 25.00 N ATOM 973 CA ASP A 73 2.601 3.570 3.498 1.00 25.00 C ATOM 974 C ASP A 73 2.412 2.161 4.025 1.00 25.00 C ATOM 975 O ASP A 73 2.944 1.195 3.472 1.00 25.00 O ATOM 976 CB ASP A 73 1.406 3.932 2.617 1.00 25.00 C ATOM 977 CG ASP A 73 1.486 5.346 2.096 1.00 25.00 C ATOM 978 OD1 ASP A 73 2.238 6.157 2.672 1.00 50.00 O ATOM 979 OD2 ASP A 73 0.837 5.684 1.078 1.00 50.00 O ATOM 0 H ASP A 73 3.852 3.163 1.869 1.00 25.00 H new ATOM 0 HA ASP A 73 2.675 4.236 4.358 1.00 25.00 H new ATOM 0 HB2 ASP A 73 1.354 3.240 1.777 1.00 25.00 H new ATOM 0 HB3 ASP A 73 0.486 3.809 3.188 1.00 25.00 H new ATOM 984 N LEU A 74 1.606 2.058 5.068 1.00 25.00 N ATOM 985 CA LEU A 74 1.201 0.773 5.633 1.00 25.00 C ATOM 986 C LEU A 74 -0.309 0.705 5.528 1.00 25.00 C ATOM 987 O LEU A 74 -0.996 1.670 5.866 1.00 25.00 O ATOM 988 CB LEU A 74 1.589 0.662 7.113 1.00 25.00 C ATOM 989 CG LEU A 74 2.989 0.111 7.431 1.00 25.00 C ATOM 990 CD1 LEU A 74 4.113 1.092 7.059 1.00 25.00 C ATOM 991 CD2 LEU A 74 3.065 -0.211 8.924 1.00 25.00 C ATOM 0 H LEU A 74 1.210 2.864 5.552 1.00 25.00 H new ATOM 0 HA LEU A 74 1.695 -0.035 5.094 1.00 25.00 H new ATOM 0 HB2 LEU A 74 1.506 1.653 7.560 1.00 25.00 H new ATOM 0 HB3 LEU A 74 0.855 0.027 7.608 1.00 25.00 H new ATOM 0 HG LEU A 74 3.137 -0.786 6.829 1.00 25.00 H new ATOM 0 HD11 LEU A 74 5.078 0.650 7.306 1.00 25.00 H new ATOM 0 HD12 LEU A 74 4.073 1.303 5.990 1.00 25.00 H new ATOM 0 HD13 LEU A 74 3.986 2.020 7.617 1.00 25.00 H new ATOM 0 HD21 LEU A 74 4.054 -0.603 9.162 1.00 25.00 H new ATOM 0 HD22 LEU A 74 2.886 0.696 9.501 1.00 25.00 H new ATOM 0 HD23 LEU A 74 2.310 -0.956 9.174 1.00 25.00 H new ATOM 1003 N ILE A 75 -0.829 -0.428 5.093 1.00 25.00 N ATOM 1004 CA ILE A 75 -2.277 -0.630 5.061 1.00 25.00 C ATOM 1005 C ILE A 75 -2.547 -1.562 6.219 1.00 25.00 C ATOM 1006 O ILE A 75 -1.742 -2.441 6.512 1.00 25.00 O ATOM 1007 CB ILE A 75 -2.778 -1.252 3.740 1.00 25.00 C ATOM 1008 CG1 ILE A 75 -2.277 -0.409 2.538 1.00 25.00 C ATOM 1009 CG2 ILE A 75 -4.328 -1.339 3.722 1.00 25.00 C ATOM 1010 CD1 ILE A 75 -2.664 -0.953 1.143 1.00 25.00 C ATOM 0 H ILE A 75 -0.281 -1.220 4.758 1.00 25.00 H new ATOM 0 HA ILE A 75 -2.803 0.322 5.134 1.00 25.00 H new ATOM 0 HB ILE A 75 -2.379 -2.263 3.661 1.00 25.00 H new ATOM 0 HG12 ILE A 75 -2.669 0.603 2.637 1.00 25.00 H new ATOM 0 HG13 ILE A 75 -1.191 -0.337 2.593 1.00 25.00 H new ATOM 0 HG21 ILE A 75 -4.657 -1.781 2.781 1.00 25.00 H new ATOM 0 HG22 ILE A 75 -4.667 -1.959 4.552 1.00 25.00 H new ATOM 0 HG23 ILE A 75 -4.750 -0.339 3.820 1.00 25.00 H new ATOM 0 HD11 ILE A 75 -2.267 -0.293 0.372 1.00 25.00 H new ATOM 0 HD12 ILE A 75 -2.249 -1.953 1.014 1.00 25.00 H new ATOM 0 HD13 ILE A 75 -3.750 -0.998 1.058 1.00 25.00 H new ATOM 1022 N LEU A 76 -3.649 -1.323 6.894 1.00 25.00 N ATOM 1023 CA LEU A 76 -4.041 -2.045 8.105 1.00 25.00 C ATOM 1024 C LEU A 76 -5.350 -2.763 7.830 1.00 25.00 C ATOM 1025 O LEU A 76 -6.225 -2.216 7.149 1.00 25.00 O ATOM 1026 CB LEU A 76 -4.249 -1.043 9.255 1.00 25.00 C ATOM 1027 CG LEU A 76 -3.109 -0.765 10.249 1.00 25.00 C ATOM 1028 CD1 LEU A 76 -2.867 -1.992 11.123 1.00 25.00 C ATOM 1029 CD2 LEU A 76 -1.816 -0.322 9.549 1.00 25.00 C ATOM 0 H LEU A 76 -4.320 -0.606 6.618 1.00 25.00 H new ATOM 0 HA LEU A 76 -3.265 -2.759 8.383 1.00 25.00 H new ATOM 0 HB2 LEU A 76 -4.528 -0.089 8.807 1.00 25.00 H new ATOM 0 HB3 LEU A 76 -5.107 -1.387 9.833 1.00 25.00 H new ATOM 0 HG LEU A 76 -3.419 0.067 10.881 1.00 25.00 H new ATOM 0 HD11 LEU A 76 -2.058 -1.786 11.824 1.00 25.00 H new ATOM 0 HD12 LEU A 76 -3.775 -2.229 11.677 1.00 25.00 H new ATOM 0 HD13 LEU A 76 -2.595 -2.839 10.493 1.00 25.00 H new ATOM 0 HD21 LEU A 76 -1.043 -0.138 10.295 1.00 25.00 H new ATOM 0 HD22 LEU A 76 -1.484 -1.106 8.868 1.00 25.00 H new ATOM 0 HD23 LEU A 76 -2.002 0.593 8.987 1.00 25.00 H new ATOM 1041 N ASP A 77 -5.477 -3.969 8.372 1.00 25.00 N ATOM 1042 CA ASP A 77 -6.691 -4.789 8.260 1.00 25.00 C ATOM 1043 C ASP A 77 -7.052 -5.006 6.793 1.00 25.00 C ATOM 1044 O ASP A 77 -8.210 -4.826 6.365 1.00 25.00 O ATOM 1045 CB ASP A 77 -7.847 -4.158 9.047 1.00 25.00 C ATOM 1046 CG ASP A 77 -7.514 -3.987 10.521 1.00 25.00 C ATOM 1047 OD1 ASP A 77 -6.781 -4.835 11.076 1.00 25.00 O ATOM 1048 OD2 ASP A 77 -7.969 -2.991 11.118 1.00 25.00 O ATOM 0 H ASP A 77 -4.734 -4.416 8.909 1.00 25.00 H new ATOM 0 HA ASP A 77 -6.497 -5.767 8.700 1.00 25.00 H new ATOM 0 HB2 ASP A 77 -8.090 -3.187 8.616 1.00 25.00 H new ATOM 0 HB3 ASP A 77 -8.735 -4.782 8.947 1.00 25.00 H new ATOM 1053 N PHE A 78 -6.039 -5.357 6.016 1.00 25.00 N ATOM 1054 CA PHE A 78 -6.209 -5.615 4.593 1.00 25.00 C ATOM 1055 C PHE A 78 -6.701 -7.047 4.387 1.00 25.00 C ATOM 1056 O PHE A 78 -6.111 -8.009 4.890 1.00 25.00 O ATOM 1057 CB PHE A 78 -4.887 -5.412 3.859 1.00 25.00 C ATOM 1058 CG PHE A 78 -4.996 -5.610 2.372 1.00 25.00 C ATOM 1059 CD1 PHE A 78 -5.396 -4.550 1.539 1.00 25.00 C ATOM 1060 CD2 PHE A 78 -4.713 -6.863 1.799 1.00 25.00 C ATOM 1061 CE1 PHE A 78 -5.521 -4.738 0.142 1.00 25.00 C ATOM 1062 CE2 PHE A 78 -4.841 -7.065 0.403 1.00 25.00 C ATOM 1063 CZ PHE A 78 -5.252 -6.000 -0.426 1.00 25.00 C ATOM 0 H PHE A 78 -5.082 -5.471 6.350 1.00 25.00 H new ATOM 0 HA PHE A 78 -6.944 -4.918 4.191 1.00 25.00 H new ATOM 0 HB2 PHE A 78 -4.519 -4.405 4.059 1.00 25.00 H new ATOM 0 HB3 PHE A 78 -4.148 -6.106 4.258 1.00 25.00 H new ATOM 0 HD1 PHE A 78 -5.610 -3.583 1.970 1.00 25.00 H new ATOM 0 HD2 PHE A 78 -4.395 -7.680 2.430 1.00 25.00 H new ATOM 0 HE1 PHE A 78 -5.822 -3.915 -0.489 1.00 25.00 H new ATOM 0 HE2 PHE A 78 -4.624 -8.032 -0.026 1.00 25.00 H new ATOM 0 HZ PHE A 78 -5.360 -6.151 -1.490 1.00 25.00 H new ATOM 1073 N ASP A 79 -7.769 -7.181 3.623 1.00 25.00 N ATOM 1074 CA ASP A 79 -8.359 -8.486 3.324 1.00 25.00 C ATOM 1075 C ASP A 79 -7.906 -8.954 1.947 1.00 25.00 C ATOM 1076 O ASP A 79 -8.457 -8.512 0.952 1.00 25.00 O ATOM 1077 CB ASP A 79 -9.885 -8.376 3.300 1.00 25.00 C ATOM 1078 CG ASP A 79 -10.464 -8.023 4.641 1.00 25.00 C ATOM 1079 OD1 ASP A 79 -10.176 -8.725 5.621 1.00 25.00 O ATOM 1080 OD2 ASP A 79 -11.218 -7.019 4.709 1.00 25.00 O ATOM 0 H ASP A 79 -8.255 -6.396 3.190 1.00 25.00 H new ATOM 0 HA ASP A 79 -8.041 -9.191 4.092 1.00 25.00 H new ATOM 0 HB2 ASP A 79 -10.179 -7.620 2.572 1.00 25.00 H new ATOM 0 HB3 ASP A 79 -10.308 -9.323 2.965 1.00 25.00 H new ATOM 1085 N PRO A 80 -6.957 -9.899 1.858 1.00 25.00 N ATOM 1086 CA PRO A 80 -6.525 -10.373 0.529 1.00 25.00 C ATOM 1087 C PRO A 80 -7.559 -11.214 -0.244 1.00 25.00 C ATOM 1088 O PRO A 80 -7.272 -11.749 -1.311 1.00 25.00 O ATOM 1089 CB PRO A 80 -5.286 -11.204 0.865 1.00 25.00 C ATOM 1090 CG PRO A 80 -5.561 -11.718 2.212 1.00 25.00 C ATOM 1091 CD PRO A 80 -6.206 -10.578 2.927 1.00 25.00 C ATOM 0 HA PRO A 80 -6.357 -9.534 -0.147 1.00 25.00 H new ATOM 0 HB2 PRO A 80 -5.142 -12.014 0.150 1.00 25.00 H new ATOM 0 HB3 PRO A 80 -4.381 -10.597 0.846 1.00 25.00 H new ATOM 0 HG2 PRO A 80 -6.218 -12.587 2.178 1.00 25.00 H new ATOM 0 HG3 PRO A 80 -4.644 -12.031 2.711 1.00 25.00 H new ATOM 0 HD2 PRO A 80 -6.863 -10.922 3.726 1.00 25.00 H new ATOM 0 HD3 PRO A 80 -5.468 -9.918 3.383 1.00 25.00 H new ATOM 1099 N SER A 81 -8.764 -11.297 0.301 1.00 25.00 N ATOM 1100 CA SER A 81 -9.873 -12.004 -0.336 1.00 25.00 C ATOM 1101 C SER A 81 -10.953 -11.021 -0.822 1.00 25.00 C ATOM 1102 O SER A 81 -11.933 -11.429 -1.439 1.00 25.00 O ATOM 1103 CB SER A 81 -10.482 -12.992 0.672 1.00 25.00 C ATOM 1104 OG SER A 81 -11.378 -13.897 0.055 1.00 25.00 O ATOM 0 H SER A 81 -9.004 -10.876 1.199 1.00 25.00 H new ATOM 0 HA SER A 81 -9.493 -12.541 -1.205 1.00 25.00 H new ATOM 0 HB2 SER A 81 -9.683 -13.550 1.160 1.00 25.00 H new ATOM 0 HB3 SER A 81 -11.006 -12.438 1.451 1.00 25.00 H new ATOM 0 HG SER A 81 -11.835 -13.450 -0.688 1.00 25.00 H new ATOM 1110 N GLN A 82 -10.797 -9.738 -0.492 1.00 25.00 N ATOM 1111 CA GLN A 82 -11.828 -8.728 -0.810 1.00 25.00 C ATOM 1112 C GLN A 82 -11.263 -7.375 -1.244 1.00 25.00 C ATOM 1113 O GLN A 82 -11.876 -6.669 -2.035 1.00 25.00 O ATOM 1114 CB GLN A 82 -12.703 -8.468 0.430 1.00 25.00 C ATOM 1115 CG GLN A 82 -13.623 -9.623 0.837 1.00 25.00 C ATOM 1116 CD GLN A 82 -14.830 -9.747 -0.070 1.00 25.00 C ATOM 1117 OE1 GLN A 82 -15.851 -9.126 0.164 1.00 25.00 O ATOM 1118 NE2 GLN A 82 -14.722 -10.547 -1.096 1.00 25.00 N ATOM 0 H GLN A 82 -9.978 -9.368 -0.009 1.00 25.00 H new ATOM 0 HA GLN A 82 -12.392 -9.147 -1.643 1.00 25.00 H new ATOM 0 HB2 GLN A 82 -12.051 -8.231 1.271 1.00 25.00 H new ATOM 0 HB3 GLN A 82 -13.316 -7.586 0.243 1.00 25.00 H new ATOM 0 HG2 GLN A 82 -13.060 -10.556 0.818 1.00 25.00 H new ATOM 0 HG3 GLN A 82 -13.957 -9.473 1.864 1.00 25.00 H new ATOM 0 HE21 GLN A 82 -13.851 -11.051 -1.260 1.00 25.00 H new ATOM 0 HE22 GLN A 82 -15.509 -10.668 -1.733 1.00 25.00 H new ATOM 1127 N ASP A 83 -10.139 -6.988 -0.662 1.00 25.00 N ATOM 1128 CA ASP A 83 -9.577 -5.659 -0.877 1.00 25.00 C ATOM 1129 C ASP A 83 -8.644 -5.646 -2.093 1.00 25.00 C ATOM 1130 O ASP A 83 -8.129 -6.685 -2.509 1.00 25.00 O ATOM 1131 CB ASP A 83 -8.794 -5.204 0.362 1.00 25.00 C ATOM 1132 CG ASP A 83 -9.678 -5.019 1.596 1.00 25.00 C ATOM 1133 OD1 ASP A 83 -10.915 -5.062 1.509 1.00 50.00 O ATOM 1134 OD2 ASP A 83 -9.126 -4.858 2.705 1.00 50.00 O ATOM 0 H ASP A 83 -9.593 -7.577 -0.033 1.00 25.00 H new ATOM 0 HA ASP A 83 -10.406 -4.975 -1.059 1.00 25.00 H new ATOM 0 HB2 ASP A 83 -8.019 -5.938 0.584 1.00 25.00 H new ATOM 0 HB3 ASP A 83 -8.289 -4.264 0.140 1.00 25.00 H new ATOM 1139 N LYS A 84 -8.419 -4.465 -2.654 1.00 25.00 N ATOM 1140 CA LYS A 84 -7.579 -4.319 -3.850 1.00 25.00 C ATOM 1141 C LYS A 84 -6.577 -3.180 -3.686 1.00 25.00 C ATOM 1142 O LYS A 84 -6.892 -2.172 -3.059 1.00 25.00 O ATOM 1143 CB LYS A 84 -8.491 -4.037 -5.053 1.00 25.00 C ATOM 1144 CG LYS A 84 -7.816 -4.165 -6.423 1.00 25.00 C ATOM 1145 CD LYS A 84 -7.538 -5.622 -6.773 1.00 25.00 C ATOM 1146 CE LYS A 84 -6.758 -5.708 -8.072 1.00 25.00 C ATOM 1147 NZ LYS A 84 -6.574 -7.131 -8.488 1.00 25.00 N ATOM 0 H LYS A 84 -8.805 -3.588 -2.304 1.00 25.00 H new ATOM 0 HA LYS A 84 -7.015 -5.239 -4.003 1.00 25.00 H new ATOM 0 HB2 LYS A 84 -9.337 -4.723 -5.017 1.00 25.00 H new ATOM 0 HB3 LYS A 84 -8.893 -3.029 -4.956 1.00 25.00 H new ATOM 0 HG2 LYS A 84 -8.454 -3.721 -7.187 1.00 25.00 H new ATOM 0 HG3 LYS A 84 -6.881 -3.605 -6.423 1.00 25.00 H new ATOM 0 HD2 LYS A 84 -6.974 -6.096 -5.969 1.00 25.00 H new ATOM 0 HD3 LYS A 84 -8.477 -6.167 -6.867 1.00 25.00 H new ATOM 0 HE2 LYS A 84 -7.284 -5.161 -8.854 1.00 25.00 H new ATOM 0 HE3 LYS A 84 -5.785 -5.232 -7.949 1.00 25.00 H new ATOM 0 HZ1 LYS A 84 -5.711 -7.216 -9.062 1.00 25.00 H new ATOM 0 HZ2 LYS A 84 -6.488 -7.731 -7.643 1.00 25.00 H new ATOM 0 HZ3 LYS A 84 -7.394 -7.438 -9.049 1.00 25.00 H new ATOM 1161 N ILE A 85 -5.393 -3.319 -4.274 1.00 25.00 N ATOM 1162 CA ILE A 85 -4.400 -2.243 -4.255 1.00 25.00 C ATOM 1163 C ILE A 85 -4.013 -1.893 -5.693 1.00 25.00 C ATOM 1164 O ILE A 85 -3.367 -2.688 -6.397 1.00 25.00 O ATOM 1165 CB ILE A 85 -3.099 -2.616 -3.468 1.00 25.00 C ATOM 1166 CG1 ILE A 85 -3.433 -3.291 -2.123 1.00 25.00 C ATOM 1167 CG2 ILE A 85 -2.262 -1.332 -3.211 1.00 25.00 C ATOM 1168 CD1 ILE A 85 -2.204 -3.862 -1.374 1.00 25.00 C ATOM 0 H ILE A 85 -5.096 -4.160 -4.768 1.00 25.00 H new ATOM 0 HA ILE A 85 -4.861 -1.398 -3.744 1.00 25.00 H new ATOM 0 HB ILE A 85 -2.526 -3.321 -4.070 1.00 25.00 H new ATOM 0 HG12 ILE A 85 -3.931 -2.566 -1.480 1.00 25.00 H new ATOM 0 HG13 ILE A 85 -4.143 -4.099 -2.302 1.00 25.00 H new ATOM 0 HG21 ILE A 85 -1.356 -1.592 -2.663 1.00 25.00 H new ATOM 0 HG22 ILE A 85 -1.992 -0.877 -4.164 1.00 25.00 H new ATOM 0 HG23 ILE A 85 -2.850 -0.625 -2.625 1.00 25.00 H new ATOM 0 HD11 ILE A 85 -2.528 -4.319 -0.439 1.00 25.00 H new ATOM 0 HD12 ILE A 85 -1.716 -4.613 -1.995 1.00 25.00 H new ATOM 0 HD13 ILE A 85 -1.502 -3.056 -1.160 1.00 25.00 H new ATOM 1180 N ASP A 86 -4.390 -0.701 -6.128 1.00 25.00 N ATOM 1181 CA ASP A 86 -4.007 -0.225 -7.450 1.00 25.00 C ATOM 1182 C ASP A 86 -2.571 0.273 -7.341 1.00 25.00 C ATOM 1183 O ASP A 86 -2.269 1.155 -6.536 1.00 25.00 O ATOM 1184 CB ASP A 86 -4.922 0.906 -7.925 1.00 25.00 C ATOM 1185 CG ASP A 86 -6.253 0.401 -8.455 1.00 25.00 C ATOM 1186 OD1 ASP A 86 -6.312 -0.752 -8.930 1.00 25.00 O ATOM 1187 OD2 ASP A 86 -7.215 1.196 -8.482 1.00 25.00 O ATOM 0 H ASP A 86 -4.958 -0.047 -5.589 1.00 25.00 H new ATOM 0 HA ASP A 86 -4.096 -1.030 -8.179 1.00 25.00 H new ATOM 0 HB2 ASP A 86 -5.102 1.593 -7.098 1.00 25.00 H new ATOM 0 HB3 ASP A 86 -4.416 1.473 -8.706 1.00 25.00 H new ATOM 1192 N VAL A 87 -1.682 -0.318 -8.131 1.00 25.00 N ATOM 1193 CA VAL A 87 -0.247 -0.005 -8.057 1.00 25.00 C ATOM 1194 C VAL A 87 0.336 0.294 -9.442 1.00 25.00 C ATOM 1195 O VAL A 87 1.529 0.101 -9.698 1.00 25.00 O ATOM 1196 CB VAL A 87 0.545 -1.189 -7.405 1.00 25.00 C ATOM 1197 CG1 VAL A 87 0.192 -1.312 -5.926 1.00 25.00 C ATOM 1198 CG2 VAL A 87 0.250 -2.520 -8.122 1.00 25.00 C ATOM 0 H VAL A 87 -1.923 -1.018 -8.833 1.00 25.00 H new ATOM 0 HA VAL A 87 -0.144 0.886 -7.437 1.00 25.00 H new ATOM 0 HB VAL A 87 1.609 -0.973 -7.506 1.00 25.00 H new ATOM 0 HG11 VAL A 87 0.750 -2.139 -5.486 1.00 25.00 H new ATOM 0 HG12 VAL A 87 0.450 -0.386 -5.412 1.00 25.00 H new ATOM 0 HG13 VAL A 87 -0.877 -1.499 -5.821 1.00 25.00 H new ATOM 0 HG21 VAL A 87 0.814 -3.322 -7.647 1.00 25.00 H new ATOM 0 HG22 VAL A 87 -0.816 -2.739 -8.059 1.00 25.00 H new ATOM 0 HG23 VAL A 87 0.543 -2.442 -9.169 1.00 25.00 H new ATOM 1208 N SER A 88 -0.510 0.763 -10.348 1.00 25.00 N ATOM 1209 CA SER A 88 -0.091 0.992 -11.735 1.00 25.00 C ATOM 1210 C SER A 88 1.046 1.998 -11.890 1.00 25.00 C ATOM 1211 O SER A 88 1.846 1.889 -12.807 1.00 25.00 O ATOM 1212 CB SER A 88 -1.289 1.457 -12.550 1.00 25.00 C ATOM 1213 OG SER A 88 -2.484 0.893 -12.034 1.00 25.00 O ATOM 0 H SER A 88 -1.485 0.993 -10.156 1.00 25.00 H new ATOM 0 HA SER A 88 0.295 0.040 -12.098 1.00 25.00 H new ATOM 0 HB2 SER A 88 -1.353 2.545 -12.527 1.00 25.00 H new ATOM 0 HB3 SER A 88 -1.163 1.167 -13.593 1.00 25.00 H new ATOM 0 HG SER A 88 -3.247 1.201 -12.566 1.00 25.00 H new ATOM 1219 N ALA A 89 1.133 2.957 -10.982 1.00 25.00 N ATOM 1220 CA ALA A 89 2.188 3.973 -11.049 1.00 25.00 C ATOM 1221 C ALA A 89 3.565 3.436 -10.640 1.00 25.00 C ATOM 1222 O ALA A 89 4.583 4.046 -10.953 1.00 25.00 O ATOM 1223 CB ALA A 89 1.822 5.163 -10.178 1.00 25.00 C ATOM 0 H ALA A 89 0.494 3.059 -10.193 1.00 25.00 H new ATOM 0 HA ALA A 89 2.262 4.279 -12.092 1.00 25.00 H new ATOM 0 HB1 ALA A 89 2.612 5.912 -10.235 1.00 25.00 H new ATOM 0 HB2 ALA A 89 0.885 5.596 -10.529 1.00 25.00 H new ATOM 0 HB3 ALA A 89 1.706 4.836 -9.145 1.00 25.00 H new ATOM 1229 N LEU A 90 3.590 2.321 -9.919 1.00 25.00 N ATOM 1230 CA LEU A 90 4.858 1.720 -9.477 1.00 25.00 C ATOM 1231 C LEU A 90 5.350 0.874 -10.631 1.00 25.00 C ATOM 1232 O LEU A 90 6.534 0.736 -10.870 1.00 25.00 O ATOM 1233 CB LEU A 90 4.651 0.865 -8.227 1.00 25.00 C ATOM 1234 CG LEU A 90 3.736 1.483 -7.165 1.00 25.00 C ATOM 1235 CD1 LEU A 90 3.629 0.571 -5.949 1.00 25.00 C ATOM 1236 CD2 LEU A 90 4.219 2.855 -6.694 1.00 25.00 C ATOM 0 H LEU A 90 2.756 1.812 -9.626 1.00 25.00 H new ATOM 0 HA LEU A 90 5.585 2.488 -9.212 1.00 25.00 H new ATOM 0 HB2 LEU A 90 4.236 -0.097 -8.528 1.00 25.00 H new ATOM 0 HB3 LEU A 90 5.623 0.666 -7.776 1.00 25.00 H new ATOM 0 HG LEU A 90 2.763 1.604 -7.642 1.00 25.00 H new ATOM 0 HD11 LEU A 90 2.975 1.029 -5.207 1.00 25.00 H new ATOM 0 HD12 LEU A 90 3.217 -0.392 -6.251 1.00 25.00 H new ATOM 0 HD13 LEU A 90 4.619 0.423 -5.517 1.00 25.00 H new ATOM 0 HD21 LEU A 90 3.532 3.244 -5.942 1.00 25.00 H new ATOM 0 HD22 LEU A 90 5.215 2.761 -6.262 1.00 25.00 H new ATOM 0 HD23 LEU A 90 4.254 3.539 -7.542 1.00 25.00 H new ATOM 1248 N GLY A 91 4.381 0.397 -11.393 1.00 25.00 N ATOM 1249 CA GLY A 91 4.662 -0.191 -12.698 1.00 25.00 C ATOM 1250 C GLY A 91 5.524 -1.435 -12.718 1.00 25.00 C ATOM 1251 O GLY A 91 6.452 -1.524 -13.509 1.00 25.00 O ATOM 0 H GLY A 91 3.394 0.404 -11.135 1.00 25.00 H new ATOM 0 HA2 GLY A 91 3.711 -0.430 -13.174 1.00 25.00 H new ATOM 0 HA3 GLY A 91 5.146 0.567 -13.314 1.00 25.00 H new ATOM 1327 N ASN A 97 11.552 -10.889 -8.684 1.00 25.00 N ATOM 1328 CA ASN A 97 13.025 -10.874 -8.447 1.00 25.00 C ATOM 1329 C ASN A 97 13.314 -9.812 -7.369 1.00 25.00 C ATOM 1330 O ASN A 97 14.051 -10.048 -6.423 1.00 25.00 O ATOM 1331 CB ASN A 97 13.860 -10.583 -9.718 1.00 25.00 C ATOM 1332 CG ASN A 97 15.250 -10.093 -9.407 1.00 25.00 C ATOM 1333 OD1 ASN A 97 15.991 -10.706 -8.664 1.00 25.00 O ATOM 1334 ND2 ASN A 97 15.617 -8.991 -9.999 1.00 25.00 N ATOM 0 HA ASN A 97 13.324 -11.871 -8.125 1.00 25.00 H new ATOM 0 HB2 ASN A 97 13.926 -11.490 -10.319 1.00 25.00 H new ATOM 0 HB3 ASN A 97 13.344 -9.837 -10.323 1.00 25.00 H new ATOM 0 HD21 ASN A 97 16.553 -8.617 -9.845 1.00 25.00 H new ATOM 0 HD22 ASN A 97 14.968 -8.503 -10.616 1.00 25.00 H new ATOM 1341 N GLY A 98 12.664 -8.664 -7.489 1.00 25.00 N ATOM 1342 CA GLY A 98 12.773 -7.605 -6.490 1.00 25.00 C ATOM 1343 C GLY A 98 13.618 -6.425 -6.927 1.00 25.00 C ATOM 1344 O GLY A 98 13.759 -5.443 -6.192 1.00 25.00 O ATOM 0 H GLY A 98 12.051 -8.439 -8.273 1.00 25.00 H new ATOM 0 HA2 GLY A 98 11.773 -7.250 -6.243 1.00 25.00 H new ATOM 0 HA3 GLY A 98 13.197 -8.024 -5.577 1.00 25.00 H new ATOM 1348 N TYR A 99 14.175 -6.510 -8.124 1.00 25.00 N ATOM 1349 CA TYR A 99 14.996 -5.443 -8.697 1.00 25.00 C ATOM 1350 C TYR A 99 14.655 -5.318 -10.171 1.00 25.00 C ATOM 1351 O TYR A 99 14.120 -6.261 -10.743 1.00 25.00 O ATOM 1352 CB TYR A 99 16.490 -5.762 -8.529 1.00 25.00 C ATOM 1353 CG TYR A 99 16.932 -5.901 -7.084 1.00 25.00 C ATOM 1354 CD1 TYR A 99 16.846 -7.141 -6.414 1.00 25.00 C ATOM 1355 CD2 TYR A 99 17.438 -4.792 -6.372 1.00 25.00 C ATOM 1356 CE1 TYR A 99 17.241 -7.264 -5.054 1.00 25.00 C ATOM 1357 CE2 TYR A 99 17.833 -4.914 -5.017 1.00 25.00 C ATOM 1358 CZ TYR A 99 17.722 -6.146 -4.372 1.00 25.00 C ATOM 1359 OH TYR A 99 18.100 -6.254 -3.053 1.00 25.00 O ATOM 0 H TYR A 99 14.073 -7.322 -8.732 1.00 25.00 H new ATOM 0 HA TYR A 99 14.791 -4.505 -8.181 1.00 25.00 H new ATOM 0 HB2 TYR A 99 16.715 -6.688 -9.058 1.00 25.00 H new ATOM 0 HB3 TYR A 99 17.075 -4.974 -9.003 1.00 25.00 H new ATOM 0 HD1 TYR A 99 16.475 -8.007 -6.942 1.00 25.00 H new ATOM 0 HD2 TYR A 99 17.525 -3.836 -6.868 1.00 25.00 H new ATOM 0 HE1 TYR A 99 17.169 -8.217 -4.552 1.00 25.00 H new ATOM 0 HE2 TYR A 99 18.219 -4.057 -4.485 1.00 25.00 H new ATOM 0 HH TYR A 99 18.627 -5.468 -2.798 1.00 25.00 H new ATOM 1369 N ALA A 100 14.963 -4.167 -10.763 1.00 25.00 N ATOM 1370 CA ALA A 100 14.677 -3.871 -12.173 1.00 25.00 C ATOM 1371 C ALA A 100 13.175 -3.984 -12.507 1.00 25.00 C ATOM 1372 O ALA A 100 12.802 -4.610 -13.489 1.00 25.00 O ATOM 1373 CB ALA A 100 15.530 -4.776 -13.107 1.00 25.00 C ATOM 0 H ALA A 100 15.425 -3.400 -10.274 1.00 25.00 H new ATOM 0 HA ALA A 100 14.956 -2.832 -12.346 1.00 25.00 H new ATOM 0 HB1 ALA A 100 15.304 -4.541 -14.147 1.00 25.00 H new ATOM 0 HB2 ALA A 100 16.589 -4.599 -12.917 1.00 25.00 H new ATOM 0 HB3 ALA A 100 15.296 -5.823 -12.912 1.00 25.00 H new ATOM 1379 N GLY A 101 12.333 -3.360 -11.689 1.00 25.00 N ATOM 1380 CA GLY A 101 10.907 -3.296 -11.984 1.00 25.00 C ATOM 1381 C GLY A 101 10.166 -4.596 -11.757 1.00 25.00 C ATOM 1382 O GLY A 101 9.146 -4.864 -12.393 1.00 25.00 O ATOM 0 H GLY A 101 12.611 -2.896 -10.824 1.00 25.00 H new ATOM 0 HA2 GLY A 101 10.454 -2.520 -11.366 1.00 25.00 H new ATOM 0 HA3 GLY A 101 10.776 -2.993 -13.023 1.00 25.00 H new ATOM 1386 N THR A 102 10.678 -5.418 -10.854 1.00 25.00 N ATOM 1387 CA THR A 102 10.060 -6.705 -10.534 1.00 25.00 C ATOM 1388 C THR A 102 9.847 -6.758 -9.028 1.00 25.00 C ATOM 1389 O THR A 102 10.510 -6.031 -8.296 1.00 25.00 O ATOM 1390 CB THR A 102 10.960 -7.869 -10.940 1.00 25.00 C ATOM 1391 OG1 THR A 102 12.122 -7.856 -10.124 1.00 25.00 O ATOM 1392 CG2 THR A 102 11.421 -7.748 -12.377 1.00 25.00 C ATOM 0 H THR A 102 11.526 -5.219 -10.324 1.00 25.00 H new ATOM 0 HA THR A 102 9.120 -6.794 -11.078 1.00 25.00 H new ATOM 0 HB THR A 102 10.385 -8.788 -10.823 1.00 25.00 H new ATOM 0 HG1 THR A 102 12.762 -7.204 -10.477 1.00 25.00 H new ATOM 0 HG21 THR A 102 12.059 -8.596 -12.627 1.00 25.00 H new ATOM 0 HG22 THR A 102 10.554 -7.739 -13.038 1.00 25.00 H new ATOM 0 HG23 THR A 102 11.982 -6.822 -12.502 1.00 25.00 H new ATOM 1400 N LEU A 103 8.917 -7.582 -8.560 1.00 25.00 N ATOM 1401 CA LEU A 103 8.568 -7.612 -7.129 1.00 25.00 C ATOM 1402 C LEU A 103 9.252 -8.719 -6.322 1.00 25.00 C ATOM 1403 O LEU A 103 9.690 -9.726 -6.866 1.00 25.00 O ATOM 1404 CB LEU A 103 7.054 -7.792 -6.986 1.00 25.00 C ATOM 1405 CG LEU A 103 6.249 -6.559 -6.547 1.00 25.00 C ATOM 1406 CD1 LEU A 103 4.759 -6.911 -6.560 1.00 25.00 C ATOM 1407 CD2 LEU A 103 6.644 -6.085 -5.138 1.00 25.00 C ATOM 0 H LEU A 103 8.390 -8.237 -9.138 1.00 25.00 H new ATOM 0 HA LEU A 103 8.921 -6.664 -6.723 1.00 25.00 H new ATOM 0 HB2 LEU A 103 6.660 -8.132 -7.944 1.00 25.00 H new ATOM 0 HB3 LEU A 103 6.873 -8.590 -6.266 1.00 25.00 H new ATOM 0 HG LEU A 103 6.464 -5.748 -7.243 1.00 25.00 H new ATOM 0 HD11 LEU A 103 4.177 -6.043 -6.250 1.00 25.00 H new ATOM 0 HD12 LEU A 103 4.463 -7.205 -7.567 1.00 25.00 H new ATOM 0 HD13 LEU A 103 4.574 -7.736 -5.872 1.00 25.00 H new ATOM 0 HD21 LEU A 103 6.050 -5.212 -4.868 1.00 25.00 H new ATOM 0 HD22 LEU A 103 6.460 -6.884 -4.420 1.00 25.00 H new ATOM 0 HD23 LEU A 103 7.702 -5.823 -5.126 1.00 25.00 H new ATOM 1419 N ALA A 104 9.263 -8.540 -5.008 1.00 25.00 N ATOM 1420 CA ALA A 104 9.695 -9.550 -4.049 1.00 25.00 C ATOM 1421 C ALA A 104 8.825 -9.304 -2.815 1.00 25.00 C ATOM 1422 O ALA A 104 8.387 -8.177 -2.590 1.00 25.00 O ATOM 1423 CB ALA A 104 11.186 -9.395 -3.719 1.00 25.00 C ATOM 0 H ALA A 104 8.965 -7.669 -4.568 1.00 25.00 H new ATOM 0 HA ALA A 104 9.582 -10.563 -4.435 1.00 25.00 H new ATOM 0 HB1 ALA A 104 11.481 -10.161 -3.002 1.00 25.00 H new ATOM 0 HB2 ALA A 104 11.774 -9.505 -4.630 1.00 25.00 H new ATOM 0 HB3 ALA A 104 11.363 -8.409 -3.290 1.00 25.00 H new ATOM 1429 N VAL A 105 8.554 -10.350 -2.048 1.00 25.00 N ATOM 1430 CA VAL A 105 7.657 -10.267 -0.900 1.00 25.00 C ATOM 1431 C VAL A 105 8.270 -10.995 0.304 1.00 25.00 C ATOM 1432 O VAL A 105 9.114 -11.879 0.137 1.00 25.00 O ATOM 1433 CB VAL A 105 6.267 -10.874 -1.299 1.00 25.00 C ATOM 1434 CG1 VAL A 105 6.349 -12.398 -1.494 1.00 25.00 C ATOM 1435 CG2 VAL A 105 5.167 -10.519 -0.282 1.00 25.00 C ATOM 0 H VAL A 105 8.947 -11.278 -2.202 1.00 25.00 H new ATOM 0 HA VAL A 105 7.512 -9.227 -0.609 1.00 25.00 H new ATOM 0 HB VAL A 105 5.995 -10.423 -2.253 1.00 25.00 H new ATOM 0 HG11 VAL A 105 5.367 -12.783 -1.770 1.00 25.00 H new ATOM 0 HG12 VAL A 105 7.063 -12.626 -2.285 1.00 25.00 H new ATOM 0 HG13 VAL A 105 6.675 -12.867 -0.565 1.00 25.00 H new ATOM 0 HG21 VAL A 105 4.222 -10.960 -0.599 1.00 25.00 H new ATOM 0 HG22 VAL A 105 5.439 -10.909 0.699 1.00 25.00 H new ATOM 0 HG23 VAL A 105 5.060 -9.436 -0.225 1.00 25.00 H new ATOM 1445 N SER A 106 7.874 -10.600 1.503 1.00 25.00 N ATOM 1446 CA SER A 106 8.328 -11.220 2.747 1.00 25.00 C ATOM 1447 C SER A 106 7.190 -11.142 3.755 1.00 25.00 C ATOM 1448 O SER A 106 6.287 -10.328 3.597 1.00 25.00 O ATOM 1449 CB SER A 106 9.549 -10.484 3.285 1.00 25.00 C ATOM 1450 OG SER A 106 10.582 -10.490 2.318 1.00 25.00 O ATOM 0 H SER A 106 7.220 -9.830 1.646 1.00 25.00 H new ATOM 0 HA SER A 106 8.606 -12.259 2.569 1.00 25.00 H new ATOM 0 HB2 SER A 106 9.283 -9.458 3.539 1.00 25.00 H new ATOM 0 HB3 SER A 106 9.896 -10.960 4.203 1.00 25.00 H new ATOM 0 HG SER A 106 11.363 -10.014 2.670 1.00 25.00 H new ATOM 1456 N LEU A 107 7.241 -11.970 4.787 1.00 25.00 N ATOM 1457 CA LEU A 107 6.221 -11.999 5.835 1.00 25.00 C ATOM 1458 C LEU A 107 6.917 -12.006 7.184 1.00 25.00 C ATOM 1459 O LEU A 107 8.082 -12.392 7.273 1.00 25.00 O ATOM 1460 CB LEU A 107 5.374 -13.273 5.699 1.00 25.00 C ATOM 1461 CG LEU A 107 4.287 -13.278 4.612 1.00 25.00 C ATOM 1462 CD1 LEU A 107 3.870 -14.711 4.300 1.00 25.00 C ATOM 1463 CD2 LEU A 107 3.068 -12.483 5.067 1.00 25.00 C ATOM 0 H LEU A 107 7.993 -12.645 4.926 1.00 25.00 H new ATOM 0 HA LEU A 107 5.574 -11.127 5.745 1.00 25.00 H new ATOM 0 HB2 LEU A 107 6.048 -14.108 5.508 1.00 25.00 H new ATOM 0 HB3 LEU A 107 4.894 -13.464 6.659 1.00 25.00 H new ATOM 0 HG LEU A 107 4.697 -12.813 3.715 1.00 25.00 H new ATOM 0 HD11 LEU A 107 3.100 -14.706 3.529 1.00 25.00 H new ATOM 0 HD12 LEU A 107 4.734 -15.273 3.946 1.00 25.00 H new ATOM 0 HD13 LEU A 107 3.477 -15.180 5.202 1.00 25.00 H new ATOM 0 HD21 LEU A 107 2.310 -12.499 4.284 1.00 25.00 H new ATOM 0 HD22 LEU A 107 2.661 -12.929 5.975 1.00 25.00 H new ATOM 0 HD23 LEU A 107 3.360 -11.452 5.268 1.00 25.00 H new ATOM 1534 N ARG A 113 2.404 -9.458 9.536 1.00 25.00 N ATOM 1535 CA ARG A 113 2.870 -8.340 8.720 1.00 25.00 C ATOM 1536 C ARG A 113 3.430 -8.881 7.426 1.00 25.00 C ATOM 1537 O ARG A 113 4.001 -9.967 7.404 1.00 25.00 O ATOM 1538 CB ARG A 113 3.947 -7.520 9.437 1.00 25.00 C ATOM 1539 CG ARG A 113 3.429 -6.750 10.626 1.00 25.00 C ATOM 1540 CD ARG A 113 4.426 -5.700 11.082 1.00 25.00 C ATOM 1541 NE ARG A 113 3.734 -4.637 11.822 1.00 25.00 N ATOM 1542 CZ ARG A 113 3.779 -4.423 13.129 1.00 25.00 C ATOM 1543 NH1 ARG A 113 4.517 -5.142 13.939 1.00 25.00 N ATOM 1544 NH2 ARG A 113 3.051 -3.466 13.621 1.00 25.00 N ATOM 0 HA ARG A 113 2.024 -7.680 8.529 1.00 25.00 H new ATOM 0 HB2 ARG A 113 4.742 -8.189 9.766 1.00 25.00 H new ATOM 0 HB3 ARG A 113 4.392 -6.821 8.728 1.00 25.00 H new ATOM 0 HG2 ARG A 113 2.485 -6.270 10.368 1.00 25.00 H new ATOM 0 HG3 ARG A 113 3.223 -7.438 11.446 1.00 25.00 H new ATOM 0 HD2 ARG A 113 5.186 -6.159 11.714 1.00 25.00 H new ATOM 0 HD3 ARG A 113 4.942 -5.278 10.220 1.00 25.00 H new ATOM 0 HE ARG A 113 3.159 -3.997 11.273 1.00 25.00 H new ATOM 0 HH11 ARG A 113 5.088 -5.902 13.569 1.00 25.00 H new ATOM 0 HH12 ARG A 113 4.521 -4.941 14.939 1.00 25.00 H new ATOM 0 HH21 ARG A 113 2.465 -2.903 13.005 1.00 25.00 H new ATOM 0 HH22 ARG A 113 3.065 -3.278 14.623 1.00 25.00 H new ATOM 1558 N THR A 114 3.293 -8.093 6.375 1.00 25.00 N ATOM 1559 CA THR A 114 3.792 -8.438 5.050 1.00 25.00 C ATOM 1560 C THR A 114 4.661 -7.280 4.596 1.00 25.00 C ATOM 1561 O THR A 114 4.393 -6.135 4.947 1.00 25.00 O ATOM 1562 CB THR A 114 2.617 -8.623 4.057 1.00 25.00 C ATOM 1563 OG1 THR A 114 1.600 -9.410 4.676 1.00 25.00 O ATOM 1564 CG2 THR A 114 3.052 -9.319 2.773 1.00 25.00 C ATOM 0 H THR A 114 2.828 -7.186 6.414 1.00 25.00 H new ATOM 0 HA THR A 114 4.352 -9.372 5.083 1.00 25.00 H new ATOM 0 HB THR A 114 2.247 -7.631 3.798 1.00 25.00 H new ATOM 0 HG1 THR A 114 0.853 -9.529 4.053 1.00 25.00 H new ATOM 0 HG21 THR A 114 2.194 -9.426 2.109 1.00 25.00 H new ATOM 0 HG22 THR A 114 3.821 -8.725 2.280 1.00 25.00 H new ATOM 0 HG23 THR A 114 3.452 -10.305 3.011 1.00 25.00 H new ATOM 1572 N TYR A 115 5.694 -7.558 3.825 1.00 25.00 N ATOM 1573 CA TYR A 115 6.588 -6.521 3.321 1.00 25.00 C ATOM 1574 C TYR A 115 6.819 -6.790 1.850 1.00 25.00 C ATOM 1575 O TYR A 115 6.851 -7.945 1.448 1.00 25.00 O ATOM 1576 CB TYR A 115 7.920 -6.573 4.075 1.00 25.00 C ATOM 1577 CG TYR A 115 7.752 -6.649 5.580 1.00 25.00 C ATOM 1578 CD1 TYR A 115 7.465 -5.495 6.341 1.00 25.00 C ATOM 1579 CD2 TYR A 115 7.875 -7.878 6.254 1.00 25.00 C ATOM 1580 CE1 TYR A 115 7.315 -5.571 7.756 1.00 25.00 C ATOM 1581 CE2 TYR A 115 7.723 -7.961 7.665 1.00 25.00 C ATOM 1582 CZ TYR A 115 7.452 -6.803 8.397 1.00 25.00 C ATOM 1583 OH TYR A 115 7.312 -6.876 9.765 1.00 25.00 O ATOM 0 H TYR A 115 5.941 -8.502 3.529 1.00 25.00 H new ATOM 0 HA TYR A 115 6.149 -5.534 3.465 1.00 25.00 H new ATOM 0 HB2 TYR A 115 8.489 -7.439 3.735 1.00 25.00 H new ATOM 0 HB3 TYR A 115 8.506 -5.688 3.826 1.00 25.00 H new ATOM 0 HD1 TYR A 115 7.358 -4.542 5.844 1.00 25.00 H new ATOM 0 HD2 TYR A 115 8.089 -8.774 5.690 1.00 25.00 H new ATOM 0 HE1 TYR A 115 7.097 -4.681 8.328 1.00 25.00 H new ATOM 0 HE2 TYR A 115 7.816 -8.913 8.167 1.00 25.00 H new ATOM 0 HH TYR A 115 7.435 -7.803 10.057 1.00 25.00 H new ATOM 1593 N LEU A 116 6.958 -5.748 1.049 1.00 25.00 N ATOM 1594 CA LEU A 116 7.169 -5.902 -0.389 1.00 25.00 C ATOM 1595 C LEU A 116 8.303 -4.997 -0.831 1.00 25.00 C ATOM 1596 O LEU A 116 8.465 -3.894 -0.299 1.00 25.00 O ATOM 1597 CB LEU A 116 5.900 -5.527 -1.163 1.00 25.00 C ATOM 1598 CG LEU A 116 4.662 -6.397 -0.886 1.00 25.00 C ATOM 1599 CD1 LEU A 116 3.651 -5.658 -0.011 1.00 25.00 C ATOM 1600 CD2 LEU A 116 4.007 -6.802 -2.201 1.00 25.00 C ATOM 0 H LEU A 116 6.929 -4.779 1.367 1.00 25.00 H new ATOM 0 HA LEU A 116 7.416 -6.943 -0.595 1.00 25.00 H new ATOM 0 HB2 LEU A 116 5.651 -4.491 -0.934 1.00 25.00 H new ATOM 0 HB3 LEU A 116 6.121 -5.573 -2.229 1.00 25.00 H new ATOM 0 HG LEU A 116 4.988 -7.289 -0.351 1.00 25.00 H new ATOM 0 HD11 LEU A 116 2.787 -6.299 0.167 1.00 25.00 H new ATOM 0 HD12 LEU A 116 4.114 -5.400 0.941 1.00 25.00 H new ATOM 0 HD13 LEU A 116 3.329 -4.747 -0.516 1.00 25.00 H new ATOM 0 HD21 LEU A 116 3.131 -7.418 -1.997 1.00 25.00 H new ATOM 0 HD22 LEU A 116 3.703 -5.909 -2.746 1.00 25.00 H new ATOM 0 HD23 LEU A 116 4.718 -7.370 -2.802 1.00 25.00 H new ATOM 1612 N LYS A 117 9.069 -5.450 -1.810 1.00 25.00 N ATOM 1613 CA LYS A 117 10.173 -4.664 -2.364 1.00 25.00 C ATOM 1614 C LYS A 117 10.209 -4.782 -3.874 1.00 25.00 C ATOM 1615 O LYS A 117 10.217 -5.880 -4.410 1.00 25.00 O ATOM 1616 CB LYS A 117 11.513 -5.152 -1.806 1.00 25.00 C ATOM 1617 CG LYS A 117 12.705 -4.524 -2.515 1.00 25.00 C ATOM 1618 CD LYS A 117 13.952 -4.635 -1.707 1.00 25.00 C ATOM 1619 CE LYS A 117 15.102 -3.964 -2.444 1.00 25.00 C ATOM 1620 NZ LYS A 117 16.355 -3.963 -1.631 1.00 25.00 N ATOM 0 H LYS A 117 8.949 -6.365 -2.244 1.00 25.00 H new ATOM 0 HA LYS A 117 10.012 -3.624 -2.081 1.00 25.00 H new ATOM 0 HB2 LYS A 117 11.565 -4.922 -0.742 1.00 25.00 H new ATOM 0 HB3 LYS A 117 11.569 -6.236 -1.900 1.00 25.00 H new ATOM 0 HG2 LYS A 117 12.852 -5.011 -3.479 1.00 25.00 H new ATOM 0 HG3 LYS A 117 12.495 -3.474 -2.717 1.00 25.00 H new ATOM 0 HD2 LYS A 117 13.809 -4.167 -0.733 1.00 25.00 H new ATOM 0 HD3 LYS A 117 14.187 -5.684 -1.525 1.00 25.00 H new ATOM 0 HE2 LYS A 117 15.281 -4.481 -3.387 1.00 25.00 H new ATOM 0 HE3 LYS A 117 14.827 -2.938 -2.690 1.00 25.00 H new ATOM 0 HZ1 LYS A 117 16.808 -3.029 -1.692 1.00 25.00 H new ATOM 0 HZ2 LYS A 117 16.125 -4.172 -0.639 1.00 25.00 H new ATOM 0 HZ3 LYS A 117 17.006 -4.687 -1.996 1.00 25.00 H new ATOM 1634 N SER A 118 10.319 -3.647 -4.544 1.00 25.00 N ATOM 1635 CA SER A 118 10.581 -3.618 -5.967 1.00 25.00 C ATOM 1636 C SER A 118 11.528 -2.467 -6.232 1.00 25.00 C ATOM 1637 O SER A 118 11.136 -1.306 -6.197 1.00 25.00 O ATOM 1638 CB SER A 118 9.291 -3.427 -6.760 1.00 25.00 C ATOM 1639 OG SER A 118 9.542 -3.496 -8.152 1.00 25.00 O ATOM 0 H SER A 118 10.229 -2.725 -4.116 1.00 25.00 H new ATOM 0 HA SER A 118 11.019 -4.565 -6.283 1.00 25.00 H new ATOM 0 HB2 SER A 118 8.568 -4.193 -6.478 1.00 25.00 H new ATOM 0 HB3 SER A 118 8.846 -2.463 -6.513 1.00 25.00 H new ATOM 0 HG SER A 118 9.952 -4.359 -8.368 1.00 25.00 H new ATOM 1645 N TYR A 119 12.797 -2.771 -6.436 1.00 25.00 N ATOM 1646 CA TYR A 119 13.747 -1.726 -6.757 1.00 25.00 C ATOM 1647 C TYR A 119 13.546 -1.434 -8.230 1.00 25.00 C ATOM 1648 O TYR A 119 13.485 -2.354 -9.044 1.00 25.00 O ATOM 1649 CB TYR A 119 15.184 -2.146 -6.464 1.00 25.00 C ATOM 1650 CG TYR A 119 16.079 -0.959 -6.167 1.00 25.00 C ATOM 1651 CD1 TYR A 119 16.420 -0.041 -7.181 1.00 25.00 C ATOM 1652 CD2 TYR A 119 16.571 -0.733 -4.865 1.00 25.00 C ATOM 1653 CE1 TYR A 119 17.215 1.097 -6.899 1.00 25.00 C ATOM 1654 CE2 TYR A 119 17.376 0.408 -4.583 1.00 25.00 C ATOM 1655 CZ TYR A 119 17.679 1.310 -5.601 1.00 25.00 C ATOM 1656 OH TYR A 119 18.437 2.420 -5.324 1.00 25.00 O ATOM 0 H TYR A 119 13.186 -3.713 -6.386 1.00 25.00 H new ATOM 0 HA TYR A 119 13.578 -0.842 -6.143 1.00 25.00 H new ATOM 0 HB2 TYR A 119 15.195 -2.829 -5.614 1.00 25.00 H new ATOM 0 HB3 TYR A 119 15.582 -2.694 -7.318 1.00 25.00 H new ATOM 0 HD1 TYR A 119 16.070 -0.208 -8.189 1.00 25.00 H new ATOM 0 HD2 TYR A 119 16.336 -1.431 -4.075 1.00 25.00 H new ATOM 0 HE1 TYR A 119 17.461 1.796 -7.685 1.00 25.00 H new ATOM 0 HE2 TYR A 119 17.750 0.573 -3.583 1.00 25.00 H new ATOM 0 HH TYR A 119 18.680 2.422 -4.375 1.00 25.00 H new ATOM 1758 N SER A 127 13.176 3.196 -5.664 1.00 25.00 N ATOM 1759 CA SER A 127 12.673 1.916 -5.186 1.00 25.00 C ATOM 1760 C SER A 127 11.268 2.066 -4.599 1.00 25.00 C ATOM 1761 O SER A 127 11.020 2.956 -3.767 1.00 25.00 O ATOM 1762 CB SER A 127 13.618 1.383 -4.113 1.00 25.00 C ATOM 1763 OG SER A 127 14.148 2.460 -3.349 1.00 25.00 O ATOM 0 HA SER A 127 12.622 1.222 -6.025 1.00 25.00 H new ATOM 0 HB2 SER A 127 13.086 0.691 -3.460 1.00 25.00 H new ATOM 0 HB3 SER A 127 14.429 0.823 -4.578 1.00 25.00 H new ATOM 0 HG SER A 127 14.004 3.303 -3.828 1.00 25.00 H new ATOM 1769 N PHE A 128 10.373 1.182 -5.003 1.00 25.00 N ATOM 1770 CA PHE A 128 9.010 1.158 -4.498 1.00 25.00 C ATOM 1771 C PHE A 128 8.917 0.003 -3.508 1.00 25.00 C ATOM 1772 O PHE A 128 8.981 -1.167 -3.887 1.00 25.00 O ATOM 1773 CB PHE A 128 8.027 0.971 -5.654 1.00 25.00 C ATOM 1774 CG PHE A 128 8.175 2.000 -6.739 1.00 25.00 C ATOM 1775 CD1 PHE A 128 8.045 3.376 -6.450 1.00 25.00 C ATOM 1776 CD2 PHE A 128 8.462 1.605 -8.059 1.00 25.00 C ATOM 1777 CE1 PHE A 128 8.207 4.347 -7.469 1.00 25.00 C ATOM 1778 CE2 PHE A 128 8.618 2.563 -9.087 1.00 25.00 C ATOM 1779 CZ PHE A 128 8.495 3.936 -8.791 1.00 25.00 C ATOM 0 H PHE A 128 10.571 0.458 -5.693 1.00 25.00 H new ATOM 0 HA PHE A 128 8.756 2.096 -4.005 1.00 25.00 H new ATOM 0 HB2 PHE A 128 8.168 -0.021 -6.083 1.00 25.00 H new ATOM 0 HB3 PHE A 128 7.009 1.009 -5.265 1.00 25.00 H new ATOM 0 HD1 PHE A 128 7.820 3.692 -5.442 1.00 25.00 H new ATOM 0 HD2 PHE A 128 8.565 0.555 -8.290 1.00 25.00 H new ATOM 0 HE1 PHE A 128 8.111 5.397 -7.237 1.00 25.00 H new ATOM 0 HE2 PHE A 128 8.831 2.244 -10.097 1.00 25.00 H new ATOM 0 HZ PHE A 128 8.620 4.672 -9.572 1.00 25.00 H new ATOM 1789 N GLU A 129 8.829 0.326 -2.232 1.00 25.00 N ATOM 1790 CA GLU A 129 8.823 -0.691 -1.184 1.00 25.00 C ATOM 1791 C GLU A 129 7.642 -0.412 -0.273 1.00 25.00 C ATOM 1792 O GLU A 129 7.367 0.739 0.050 1.00 25.00 O ATOM 1793 CB GLU A 129 10.134 -0.650 -0.397 1.00 25.00 C ATOM 1794 CG GLU A 129 11.387 -0.874 -1.242 1.00 25.00 C ATOM 1795 CD GLU A 129 12.646 -0.980 -0.392 1.00 25.00 C ATOM 1796 OE1 GLU A 129 12.576 -0.663 0.821 1.00 25.00 O ATOM 1797 OE2 GLU A 129 13.693 -1.422 -0.915 1.00 25.00 O ATOM 0 H GLU A 129 8.760 1.285 -1.890 1.00 25.00 H new ATOM 0 HA GLU A 129 8.732 -1.686 -1.620 1.00 25.00 H new ATOM 0 HB2 GLU A 129 10.214 0.317 0.100 1.00 25.00 H new ATOM 0 HB3 GLU A 129 10.098 -1.409 0.385 1.00 25.00 H new ATOM 0 HG2 GLU A 129 11.269 -1.785 -1.828 1.00 25.00 H new ATOM 0 HG3 GLU A 129 11.497 -0.052 -1.950 1.00 25.00 H new ATOM 1804 N LEU A 130 6.901 -1.451 0.079 1.00 25.00 N ATOM 1805 CA LEU A 130 5.639 -1.303 0.800 1.00 25.00 C ATOM 1806 C LEU A 130 5.598 -2.230 2.004 1.00 25.00 C ATOM 1807 O LEU A 130 6.422 -3.142 2.118 1.00 25.00 O ATOM 1808 CB LEU A 130 4.457 -1.645 -0.130 1.00 25.00 C ATOM 1809 CG LEU A 130 4.333 -0.826 -1.426 1.00 25.00 C ATOM 1810 CD1 LEU A 130 4.987 -1.542 -2.627 1.00 25.00 C ATOM 1811 CD2 LEU A 130 2.860 -0.571 -1.739 1.00 25.00 C ATOM 0 H LEU A 130 7.153 -2.418 -0.124 1.00 25.00 H new ATOM 0 HA LEU A 130 5.561 -0.269 1.137 1.00 25.00 H new ATOM 0 HB2 LEU A 130 4.531 -2.698 -0.400 1.00 25.00 H new ATOM 0 HB3 LEU A 130 3.534 -1.526 0.437 1.00 25.00 H new ATOM 0 HG LEU A 130 4.856 0.117 -1.266 1.00 25.00 H new ATOM 0 HD11 LEU A 130 4.876 -0.928 -3.521 1.00 25.00 H new ATOM 0 HD12 LEU A 130 6.046 -1.699 -2.424 1.00 25.00 H new ATOM 0 HD13 LEU A 130 4.501 -2.505 -2.785 1.00 25.00 H new ATOM 0 HD21 LEU A 130 2.779 0.010 -2.658 1.00 25.00 H new ATOM 0 HD22 LEU A 130 2.345 -1.523 -1.864 1.00 25.00 H new ATOM 0 HD23 LEU A 130 2.404 -0.017 -0.918 1.00 25.00 H new ATOM 1823 N ALA A 131 4.622 -2.025 2.878 1.00 25.00 N ATOM 1824 CA ALA A 131 4.407 -2.903 4.018 1.00 25.00 C ATOM 1825 C ALA A 131 2.902 -2.971 4.289 1.00 25.00 C ATOM 1826 O ALA A 131 2.173 -2.030 3.964 1.00 25.00 O ATOM 1827 CB ALA A 131 5.160 -2.381 5.245 1.00 25.00 C ATOM 0 H ALA A 131 3.961 -1.250 2.817 1.00 25.00 H new ATOM 0 HA ALA A 131 4.788 -3.901 3.802 1.00 25.00 H new ATOM 0 HB1 ALA A 131 4.988 -3.049 6.089 1.00 25.00 H new ATOM 0 HB2 ALA A 131 6.227 -2.339 5.026 1.00 25.00 H new ATOM 0 HB3 ALA A 131 4.801 -1.382 5.494 1.00 25.00 H new ATOM 1833 N LEU A 132 2.449 -4.076 4.845 1.00 25.00 N ATOM 1834 CA LEU A 132 1.040 -4.285 5.154 1.00 25.00 C ATOM 1835 C LEU A 132 0.971 -4.909 6.539 1.00 25.00 C ATOM 1836 O LEU A 132 1.809 -5.751 6.867 1.00 25.00 O ATOM 1837 CB LEU A 132 0.401 -5.248 4.145 1.00 25.00 C ATOM 1838 CG LEU A 132 0.511 -4.927 2.643 1.00 25.00 C ATOM 1839 CD1 LEU A 132 0.052 -6.132 1.823 1.00 25.00 C ATOM 1840 CD2 LEU A 132 -0.326 -3.722 2.260 1.00 25.00 C ATOM 0 H LEU A 132 3.048 -4.862 5.099 1.00 25.00 H new ATOM 0 HA LEU A 132 0.505 -3.336 5.110 1.00 25.00 H new ATOM 0 HB2 LEU A 132 0.839 -6.233 4.305 1.00 25.00 H new ATOM 0 HB3 LEU A 132 -0.658 -5.327 4.389 1.00 25.00 H new ATOM 0 HG LEU A 132 1.556 -4.698 2.432 1.00 25.00 H new ATOM 0 HD11 LEU A 132 0.131 -5.901 0.761 1.00 25.00 H new ATOM 0 HD12 LEU A 132 0.681 -6.991 2.055 1.00 25.00 H new ATOM 0 HD13 LEU A 132 -0.984 -6.365 2.067 1.00 25.00 H new ATOM 0 HD21 LEU A 132 -0.220 -3.530 1.192 1.00 25.00 H new ATOM 0 HD22 LEU A 132 -1.373 -3.918 2.491 1.00 25.00 H new ATOM 0 HD23 LEU A 132 0.013 -2.851 2.821 1.00 25.00 H new ATOM 1852 N ASP A 133 -0.019 -4.532 7.328 1.00 25.00 N ATOM 1853 CA ASP A 133 -0.197 -5.083 8.673 1.00 25.00 C ATOM 1854 C ASP A 133 -1.587 -5.718 8.752 1.00 25.00 C ATOM 1855 O ASP A 133 -2.535 -5.234 8.129 1.00 25.00 O ATOM 1856 CB ASP A 133 -0.129 -3.967 9.729 1.00 25.00 C ATOM 1857 CG ASP A 133 1.300 -3.538 10.076 1.00 25.00 C ATOM 1858 OD1 ASP A 133 2.247 -3.770 9.301 1.00 25.00 O ATOM 1859 OD2 ASP A 133 1.480 -2.992 11.189 1.00 25.00 O ATOM 0 H ASP A 133 -0.721 -3.841 7.064 1.00 25.00 H new ATOM 0 HA ASP A 133 0.591 -5.812 8.864 1.00 25.00 H new ATOM 0 HB2 ASP A 133 -0.682 -3.100 9.366 1.00 25.00 H new ATOM 0 HB3 ASP A 133 -0.628 -4.306 10.637 1.00 25.00 H new ATOM 1864 N GLY A 134 -1.728 -6.774 9.545 1.00 25.00 N ATOM 1865 CA GLY A 134 -3.043 -7.364 9.774 1.00 25.00 C ATOM 1866 C GLY A 134 -3.641 -8.016 8.544 1.00 25.00 C ATOM 1867 O GLY A 134 -4.781 -7.753 8.188 1.00 25.00 O ATOM 0 H GLY A 134 -0.960 -7.234 10.034 1.00 25.00 H new ATOM 0 HA2 GLY A 134 -2.965 -8.108 10.567 1.00 25.00 H new ATOM 0 HA3 GLY A 134 -3.722 -6.589 10.130 1.00 25.00 H new ATOM 1871 N ASN A 135 -2.867 -8.849 7.868 1.00 25.00 N ATOM 1872 CA ASN A 135 -3.348 -9.520 6.660 1.00 25.00 C ATOM 1873 C ASN A 135 -3.836 -10.923 7.003 1.00 25.00 C ATOM 1874 O ASN A 135 -3.248 -11.608 7.840 1.00 25.00 O ATOM 1875 CB ASN A 135 -2.224 -9.642 5.620 1.00 25.00 C ATOM 1876 CG ASN A 135 -1.991 -8.368 4.836 1.00 25.00 C ATOM 1877 OD1 ASN A 135 -2.177 -7.237 5.455 1.00 25.00 O flip ATOM 1878 ND2 ASN A 135 -1.638 -8.423 3.670 1.00 25.00 N flip ATOM 0 H ASN A 135 -1.908 -9.079 8.129 1.00 25.00 H new ATOM 0 HA ASN A 135 -4.163 -8.924 6.249 1.00 25.00 H new ATOM 0 HB2 ASN A 135 -1.300 -9.923 6.125 1.00 25.00 H new ATOM 0 HB3 ASN A 135 -2.466 -10.448 4.927 1.00 25.00 H new ATOM 0 HD21 ASN A 135 -1.503 -9.328 3.220 1.00 25.00 H new ATOM 0 HD22 ASN A 135 -1.478 -7.564 3.145 1.00 25.00 H new ATOM 1885 N HIS A 136 -4.870 -11.380 6.314 1.00 25.00 N ATOM 1886 CA HIS A 136 -5.326 -12.762 6.451 1.00 25.00 C ATOM 1887 C HIS A 136 -4.390 -13.669 5.683 1.00 25.00 C ATOM 1888 O HIS A 136 -4.607 -13.952 4.520 1.00 25.00 O ATOM 1889 CB HIS A 136 -6.760 -12.930 5.959 1.00 25.00 C ATOM 1890 CG HIS A 136 -7.789 -12.325 6.867 1.00 25.00 C ATOM 1891 ND1 HIS A 136 -8.247 -11.029 6.799 1.00 25.00 N ATOM 1892 CD2 HIS A 136 -8.484 -12.883 7.899 1.00 25.00 C ATOM 1893 CE1 HIS A 136 -9.164 -10.861 7.744 1.00 25.00 C ATOM 1894 NE2 HIS A 136 -9.342 -11.960 8.448 1.00 25.00 N ATOM 0 H HIS A 136 -5.410 -10.819 5.655 1.00 25.00 H new ATOM 0 HA HIS A 136 -5.315 -13.031 7.507 1.00 25.00 H new ATOM 0 HB2 HIS A 136 -6.850 -12.478 4.971 1.00 25.00 H new ATOM 0 HB3 HIS A 136 -6.972 -13.993 5.843 1.00 25.00 H new ATOM 0 HD2 HIS A 136 -8.376 -13.903 8.236 1.00 25.00 H new ATOM 0 HE1 HIS A 136 -9.698 -9.938 7.914 1.00 25.00 H new ATOM 0 HE2 HIS A 136 -9.980 -12.097 9.232 1.00 25.00 H new ATOM 1902 N ALA A 137 -3.370 -14.167 6.369 1.00 25.00 N ATOM 1903 CA ALA A 137 -2.440 -15.128 5.784 1.00 25.00 C ATOM 1904 C ALA A 137 -3.210 -16.401 5.415 1.00 25.00 C ATOM 1905 O ALA A 137 -2.868 -17.098 4.469 1.00 25.00 O ATOM 1906 CB ALA A 137 -1.309 -15.442 6.776 1.00 25.00 C ATOM 0 H ALA A 137 -3.164 -13.920 7.337 1.00 25.00 H new ATOM 0 HA ALA A 137 -1.990 -14.708 4.885 1.00 25.00 H new ATOM 0 HB1 ALA A 137 -0.622 -16.160 6.329 1.00 25.00 H new ATOM 0 HB2 ALA A 137 -0.771 -14.525 7.016 1.00 25.00 H new ATOM 0 HB3 ALA A 137 -1.732 -15.864 7.688 1.00 25.00 H new ATOM 1912 N ALA A 138 -4.296 -16.642 6.137 1.00 25.00 N ATOM 1913 CA ALA A 138 -5.172 -17.774 5.867 1.00 25.00 C ATOM 1914 C ALA A 138 -5.783 -17.689 4.461 1.00 25.00 C ATOM 1915 O ALA A 138 -6.132 -18.710 3.881 1.00 25.00 O ATOM 1916 CB ALA A 138 -6.281 -17.833 6.924 1.00 25.00 C ATOM 0 H ALA A 138 -4.593 -16.062 6.922 1.00 25.00 H new ATOM 0 HA ALA A 138 -4.575 -18.685 5.914 1.00 25.00 H new ATOM 0 HB1 ALA A 138 -6.934 -18.681 6.719 1.00 25.00 H new ATOM 0 HB2 ALA A 138 -5.836 -17.949 7.912 1.00 25.00 H new ATOM 0 HB3 ALA A 138 -6.862 -16.911 6.893 1.00 25.00 H new ATOM 1922 N THR A 139 -5.923 -16.475 3.932 1.00 25.00 N ATOM 1923 CA THR A 139 -6.483 -16.287 2.585 1.00 25.00 C ATOM 1924 C THR A 139 -5.571 -15.447 1.685 1.00 25.00 C ATOM 1925 O THR A 139 -6.049 -14.733 0.805 1.00 25.00 O ATOM 1926 CB THR A 139 -7.885 -15.617 2.650 1.00 25.00 C ATOM 1927 OG1 THR A 139 -7.798 -14.358 3.321 1.00 25.00 O ATOM 1928 CG2 THR A 139 -8.870 -16.486 3.426 1.00 25.00 C ATOM 0 H THR A 139 -5.661 -15.611 4.406 1.00 25.00 H new ATOM 0 HA THR A 139 -6.570 -17.283 2.152 1.00 25.00 H new ATOM 0 HB THR A 139 -8.232 -15.486 1.625 1.00 25.00 H new ATOM 0 HG1 THR A 139 -8.685 -13.944 3.355 1.00 25.00 H new ATOM 0 HG21 THR A 139 -9.843 -15.995 3.457 1.00 25.00 H new ATOM 0 HG22 THR A 139 -8.968 -17.454 2.934 1.00 25.00 H new ATOM 0 HG23 THR A 139 -8.505 -16.631 4.443 1.00 25.00 H new ATOM 1936 N LEU A 140 -4.262 -15.515 1.911 1.00 25.00 N ATOM 1937 CA LEU A 140 -3.319 -14.726 1.112 1.00 25.00 C ATOM 1938 C LEU A 140 -3.374 -15.126 -0.365 1.00 25.00 C ATOM 1939 O LEU A 140 -3.609 -16.283 -0.708 1.00 25.00 O ATOM 1940 CB LEU A 140 -1.878 -14.824 1.662 1.00 25.00 C ATOM 1941 CG LEU A 140 -1.075 -16.127 1.457 1.00 25.00 C ATOM 1942 CD1 LEU A 140 -0.279 -16.121 0.138 1.00 25.00 C ATOM 1943 CD2 LEU A 140 -0.091 -16.327 2.620 1.00 25.00 C ATOM 0 H LEU A 140 -3.831 -16.098 2.629 1.00 25.00 H new ATOM 0 HA LEU A 140 -3.625 -13.683 1.189 1.00 25.00 H new ATOM 0 HB2 LEU A 140 -1.302 -14.012 1.218 1.00 25.00 H new ATOM 0 HB3 LEU A 140 -1.923 -14.633 2.734 1.00 25.00 H new ATOM 0 HG LEU A 140 -1.798 -16.942 1.419 1.00 25.00 H new ATOM 0 HD11 LEU A 140 0.269 -17.058 0.039 1.00 25.00 H new ATOM 0 HD12 LEU A 140 -0.966 -16.012 -0.701 1.00 25.00 H new ATOM 0 HD13 LEU A 140 0.424 -15.288 0.141 1.00 25.00 H new ATOM 0 HD21 LEU A 140 0.471 -17.248 2.467 1.00 25.00 H new ATOM 0 HD22 LEU A 140 0.599 -15.484 2.662 1.00 25.00 H new ATOM 0 HD23 LEU A 140 -0.644 -16.391 3.557 1.00 25.00 H new ATOM 1955 N SER A 141 -3.147 -14.157 -1.238 1.00 25.00 N ATOM 1956 CA SER A 141 -3.177 -14.380 -2.679 1.00 25.00 C ATOM 1957 C SER A 141 -2.318 -13.326 -3.362 1.00 25.00 C ATOM 1958 O SER A 141 -2.202 -12.209 -2.870 1.00 25.00 O ATOM 1959 CB SER A 141 -4.617 -14.274 -3.191 1.00 25.00 C ATOM 1960 OG SER A 141 -4.680 -14.414 -4.603 1.00 25.00 O ATOM 0 H SER A 141 -2.937 -13.195 -0.971 1.00 25.00 H new ATOM 0 HA SER A 141 -2.791 -15.375 -2.902 1.00 25.00 H new ATOM 0 HB2 SER A 141 -5.229 -15.044 -2.721 1.00 25.00 H new ATOM 0 HB3 SER A 141 -5.037 -13.311 -2.901 1.00 25.00 H new ATOM 0 HG SER A 141 -5.612 -14.343 -4.897 1.00 25.00 H new ATOM 1966 N ALA A 142 -1.746 -13.666 -4.510 1.00 25.00 N ATOM 1967 CA ALA A 142 -0.954 -12.710 -5.289 1.00 25.00 C ATOM 1968 C ALA A 142 -1.861 -11.773 -6.101 1.00 25.00 C ATOM 1969 O ALA A 142 -1.420 -10.765 -6.640 1.00 25.00 O ATOM 1970 CB ALA A 142 -0.005 -13.470 -6.237 1.00 25.00 C ATOM 0 H ALA A 142 -1.813 -14.595 -4.926 1.00 25.00 H new ATOM 0 HA ALA A 142 -0.371 -12.104 -4.596 1.00 25.00 H new ATOM 0 HB1 ALA A 142 0.582 -12.755 -6.814 1.00 25.00 H new ATOM 0 HB2 ALA A 142 0.664 -14.101 -5.653 1.00 25.00 H new ATOM 0 HB3 ALA A 142 -0.589 -14.091 -6.915 1.00 25.00 H new ATOM 1976 N GLY A 143 -3.133 -12.123 -6.180 1.00 25.00 N ATOM 1977 CA GLY A 143 -4.082 -11.404 -7.026 1.00 25.00 C ATOM 1978 C GLY A 143 -4.493 -10.013 -6.570 1.00 25.00 C ATOM 1979 O GLY A 143 -5.296 -9.359 -7.231 1.00 25.00 O ATOM 0 H GLY A 143 -3.539 -12.905 -5.667 1.00 25.00 H new ATOM 0 HA2 GLY A 143 -3.651 -11.320 -8.024 1.00 25.00 H new ATOM 0 HA3 GLY A 143 -4.983 -12.011 -7.117 1.00 25.00 H new ATOM 1983 N ASN A 144 -3.946 -9.539 -5.463 1.00 25.00 N ATOM 1984 CA ASN A 144 -4.293 -8.212 -4.935 1.00 25.00 C ATOM 1985 C ASN A 144 -3.753 -7.074 -5.801 1.00 25.00 C ATOM 1986 O ASN A 144 -4.220 -5.938 -5.707 1.00 25.00 O ATOM 1987 CB ASN A 144 -3.739 -8.055 -3.518 1.00 25.00 C ATOM 1988 CG ASN A 144 -4.370 -9.006 -2.556 1.00 25.00 C ATOM 1989 OD1 ASN A 144 -5.567 -9.108 -2.479 1.00 25.00 O ATOM 1990 ND2 ASN A 144 -3.565 -9.730 -1.838 1.00 25.00 N ATOM 0 H ASN A 144 -3.259 -10.047 -4.906 1.00 25.00 H new ATOM 0 HA ASN A 144 -5.381 -8.148 -4.936 1.00 25.00 H new ATOM 0 HB2 ASN A 144 -2.661 -8.217 -3.531 1.00 25.00 H new ATOM 0 HB3 ASN A 144 -3.904 -7.033 -3.177 1.00 25.00 H new ATOM 0 HD21 ASN A 144 -3.942 -10.413 -1.181 1.00 25.00 H new ATOM 0 HD22 ASN A 144 -2.556 -9.615 -1.931 1.00 25.00 H new ATOM 1997 N ILE A 145 -2.747 -7.366 -6.615 1.00 25.00 N ATOM 1998 CA ILE A 145 -2.116 -6.353 -7.458 1.00 25.00 C ATOM 1999 C ILE A 145 -2.987 -6.028 -8.679 1.00 25.00 C ATOM 2000 O ILE A 145 -3.760 -6.866 -9.153 1.00 25.00 O ATOM 2001 CB ILE A 145 -0.690 -6.798 -7.916 1.00 25.00 C ATOM 2002 CG1 ILE A 145 -0.774 -8.029 -8.850 1.00 25.00 C ATOM 2003 CG2 ILE A 145 0.184 -7.107 -6.669 1.00 25.00 C ATOM 2004 CD1 ILE A 145 0.580 -8.548 -9.376 1.00 25.00 C ATOM 0 H ILE A 145 -2.347 -8.300 -6.711 1.00 25.00 H new ATOM 0 HA ILE A 145 -2.014 -5.451 -6.855 1.00 25.00 H new ATOM 0 HB ILE A 145 -0.228 -5.987 -8.479 1.00 25.00 H new ATOM 0 HG12 ILE A 145 -1.272 -8.838 -8.315 1.00 25.00 H new ATOM 0 HG13 ILE A 145 -1.404 -7.776 -9.703 1.00 25.00 H new ATOM 0 HG21 ILE A 145 1.178 -7.417 -6.990 1.00 25.00 H new ATOM 0 HG22 ILE A 145 0.265 -6.213 -6.051 1.00 25.00 H new ATOM 0 HG23 ILE A 145 -0.277 -7.908 -6.091 1.00 25.00 H new ATOM 0 HD11 ILE A 145 0.413 -9.411 -10.021 1.00 25.00 H new ATOM 0 HD12 ILE A 145 1.075 -7.761 -9.944 1.00 25.00 H new ATOM 0 HD13 ILE A 145 1.209 -8.839 -8.535 1.00 25.00 H new ATOM 2016 N VAL A 146 -2.857 -4.810 -9.184 1.00 25.00 N ATOM 2017 CA VAL A 146 -3.661 -4.342 -10.325 1.00 25.00 C ATOM 2018 C VAL A 146 -3.370 -5.121 -11.614 1.00 25.00 C ATOM 2019 O VAL A 146 -4.198 -5.194 -12.505 1.00 25.00 O ATOM 2020 CB VAL A 146 -3.426 -2.804 -10.556 1.00 25.00 C ATOM 2021 CG1 VAL A 146 -2.051 -2.527 -11.185 1.00 25.00 C ATOM 2022 CG2 VAL A 146 -4.535 -2.184 -11.407 1.00 25.00 C ATOM 0 H VAL A 146 -2.200 -4.117 -8.825 1.00 25.00 H new ATOM 0 HA VAL A 146 -4.707 -4.522 -10.074 1.00 25.00 H new ATOM 0 HB VAL A 146 -3.450 -2.333 -9.573 1.00 25.00 H new ATOM 0 HG11 VAL A 146 -1.926 -1.454 -11.329 1.00 25.00 H new ATOM 0 HG12 VAL A 146 -1.267 -2.898 -10.524 1.00 25.00 H new ATOM 0 HG13 VAL A 146 -1.983 -3.033 -12.148 1.00 25.00 H new ATOM 0 HG21 VAL A 146 -4.337 -1.121 -11.544 1.00 25.00 H new ATOM 0 HG22 VAL A 146 -4.566 -2.676 -12.379 1.00 25.00 H new ATOM 0 HG23 VAL A 146 -5.494 -2.313 -10.905 1.00 25.00 H new ATOM 2032 N PHE A 147 -2.178 -5.687 -11.712 1.00 25.00 N ATOM 2033 CA PHE A 147 -1.741 -6.365 -12.931 1.00 25.00 C ATOM 2034 C PHE A 147 -2.426 -7.715 -13.104 1.00 25.00 C ATOM 2035 O PHE A 147 -2.656 -8.150 -14.227 1.00 25.00 O ATOM 2036 CB PHE A 147 -0.218 -6.518 -12.892 1.00 25.00 C ATOM 2037 CG PHE A 147 0.504 -5.211 -12.640 1.00 25.00 C ATOM 2038 CD1 PHE A 147 0.559 -4.227 -13.644 1.00 25.00 C ATOM 2039 CD2 PHE A 147 1.113 -4.946 -11.397 1.00 25.00 C ATOM 2040 CE1 PHE A 147 1.204 -2.980 -13.409 1.00 25.00 C ATOM 2041 CE2 PHE A 147 1.766 -3.707 -11.159 1.00 25.00 C ATOM 2042 CZ PHE A 147 1.806 -2.727 -12.168 1.00 25.00 C ATOM 0 H PHE A 147 -1.489 -5.692 -10.960 1.00 25.00 H new ATOM 0 HA PHE A 147 -2.025 -5.762 -13.793 1.00 25.00 H new ATOM 0 HB2 PHE A 147 0.050 -7.230 -12.112 1.00 25.00 H new ATOM 0 HB3 PHE A 147 0.123 -6.938 -13.838 1.00 25.00 H new ATOM 0 HD1 PHE A 147 0.106 -4.420 -14.605 1.00 25.00 H new ATOM 0 HD2 PHE A 147 1.083 -5.693 -10.617 1.00 25.00 H new ATOM 0 HE1 PHE A 147 1.230 -2.230 -14.185 1.00 25.00 H new ATOM 0 HE2 PHE A 147 2.232 -3.517 -10.203 1.00 25.00 H new ATOM 0 HZ PHE A 147 2.299 -1.783 -11.987 1.00 25.00 H new