USER MOD reduce.3.24.130724 H: found=0, std=0, add=698, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 698 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 57 GLN : amide:sc= 1.22 K(o=2,f=0.84) USER MOD Set 1.2: A 88 GLN : amide:sc= 0.798 K(o=2,f=0.84) USER MOD Set 2.1: A 44 MET CE :methyl 178:sc= -0.367 (180deg=-0.369) USER MOD Set 2.2: A 55 MET CE :methyl -127:sc=-0.00142 (180deg=-0.171) USER MOD Set 3.1: A 19 ASN : amide:sc= 2.08 K(o=3.2,f=-2.7!) USER MOD Set 3.2: A 31 GLN : amide:sc= 1.09 K(o=3.2,f=0.59) USER MOD Set 4.1: A 28 SER OG : rot 89:sc= 1.3 USER MOD Set 4.2: B 358 ASN : amide:sc= -0.123 K(o=1.2,f=0.23) USER MOD Single : A 17 HIS : no HE2:sc= -0.414 X(o=-0.41,f=-0.54) USER MOD Single : A 21 LYS NZ :NH3+ -169:sc= 0.968 (180deg=0.788) USER MOD Single : A 25 GLN : amide:sc= 2.22 K(o=2.2,f=-0.44) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 HIS : no HE2:sc= -0.123 K(o=-0.12,f=-1.1) USER MOD Single : A 38 THR OG1 : rot -170:sc= -0.986 USER MOD Single : A 41 SER OG : rot -86:sc= 1.46 USER MOD Single : A 42 LYS NZ :NH3+ -106:sc= 0.663 (180deg=-1.59!) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 CYS SG : rot -78:sc= 0.16 USER MOD Single : A 51 GLN : amide:sc= -0.41 X(o=-0.41,f=-0.47) USER MOD Single : A 54 SER OG : rot 180:sc= 0.314 USER MOD Single : A 65 GLN : amide:sc= -0.435 X(o=-0.44,f=-0.64) USER MOD Single : A 68 ASN : amide:sc= 1.1 K(o=1.1,f=-0.0035) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0.095 USER MOD Single : A 72 THR OG1 : rot 180:sc= -0.285 USER MOD Single : A 75 GLN : amide:sc= -0.337 X(o=-0.34,f=-0.19) USER MOD Single : A 78 MET CE :methyl -163:sc= -0.405 (180deg=-0.894) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 GLN : amide:sc= -0.28 K(o=-0.28,f=-0.82) USER MOD Single : A 90 GLN : amide:sc= -0.0876 K(o=-0.088,f=-3.3!) USER MOD Single : A 91 THR OG1 : rot 85:sc= 0.0267 USER MOD Single : B 357 ASN : amide:sc= -0.104 X(o=-0.1,f=-0.019) USER MOD Single : B 365 SER OG : rot 180:sc= -0.112 USER MOD Single : B 367 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 16 -5.655 15.828 12.881 1.00 10.00 N ATOM 2 CA ASP A 16 -6.487 14.604 12.924 1.00 10.00 C ATOM 3 C ASP A 16 -5.854 13.498 12.099 1.00 10.00 C ATOM 4 O ASP A 16 -4.774 13.677 11.533 1.00 10.00 O ATOM 5 CB ASP A 16 -7.895 14.902 12.412 1.00 10.00 C ATOM 6 CG ASP A 16 -8.649 15.822 13.341 1.00 10.00 C ATOM 7 OD1 ASP A 16 -8.091 16.866 13.725 1.00 10.00 O ATOM 8 OD2 ASP A 16 -9.800 15.505 13.701 1.00 10.00 O ATOM 0 HA ASP A 16 -6.552 14.270 13.959 1.00 10.00 H new ATOM 0 HB2 ASP A 16 -7.833 15.356 11.423 1.00 10.00 H new ATOM 0 HB3 ASP A 16 -8.446 13.968 12.300 1.00 10.00 H new ATOM 13 N HIS A 17 -6.529 12.361 12.026 1.00 10.00 N ATOM 14 CA HIS A 17 -6.030 11.216 11.277 1.00 10.00 C ATOM 15 C HIS A 17 -6.983 10.877 10.139 1.00 10.00 C ATOM 16 O HIS A 17 -8.107 11.382 10.087 1.00 10.00 O ATOM 17 CB HIS A 17 -5.865 10.000 12.199 1.00 10.00 C ATOM 18 CG HIS A 17 -4.854 10.195 13.292 1.00 10.00 C ATOM 19 ND1 HIS A 17 -5.227 10.599 14.551 1.00 10.00 N ATOM 20 CD2 HIS A 17 -3.509 10.038 13.260 1.00 10.00 C ATOM 21 CE1 HIS A 17 -4.111 10.683 15.251 1.00 10.00 C ATOM 22 NE2 HIS A 17 -3.043 10.351 14.513 1.00 10.00 N ATOM 0 H HIS A 17 -7.429 12.206 12.479 1.00 10.00 H new ATOM 0 HA HIS A 17 -5.056 11.475 10.861 1.00 10.00 H new ATOM 0 HB2 HIS A 17 -6.830 9.764 12.648 1.00 10.00 H new ATOM 0 HB3 HIS A 17 -5.574 9.138 11.598 1.00 10.00 H new ATOM 0 HD1 HIS A 17 -6.173 10.794 14.878 1.00 10.00 H new ATOM 0 HD2 HIS A 17 -2.917 9.727 12.412 1.00 10.00 H new ATOM 0 HE1 HIS A 17 -4.065 10.982 16.288 1.00 10.00 H new ATOM 30 N ILE A 18 -6.531 10.029 9.233 1.00 10.00 N ATOM 31 CA ILE A 18 -7.337 9.615 8.096 1.00 10.00 C ATOM 32 C ILE A 18 -7.394 8.089 8.028 1.00 10.00 C ATOM 33 O ILE A 18 -6.398 7.412 8.292 1.00 10.00 O ATOM 34 CB ILE A 18 -6.783 10.200 6.773 1.00 10.00 C ATOM 35 CG1 ILE A 18 -7.699 9.848 5.598 1.00 10.00 C ATOM 36 CG2 ILE A 18 -5.361 9.710 6.513 1.00 10.00 C ATOM 37 CD1 ILE A 18 -7.307 10.524 4.302 1.00 10.00 C ATOM 0 H ILE A 18 -5.602 9.610 9.263 1.00 10.00 H new ATOM 0 HA ILE A 18 -8.347 10.003 8.231 1.00 10.00 H new ATOM 0 HB ILE A 18 -6.755 11.285 6.871 1.00 10.00 H new ATOM 0 HG12 ILE A 18 -7.690 8.768 5.452 1.00 10.00 H new ATOM 0 HG13 ILE A 18 -8.722 10.127 5.849 1.00 10.00 H new ATOM 0 HG21 ILE A 18 -4.995 10.135 5.578 1.00 10.00 H new ATOM 0 HG22 ILE A 18 -4.713 10.022 7.332 1.00 10.00 H new ATOM 0 HG23 ILE A 18 -5.358 8.622 6.443 1.00 10.00 H new ATOM 0 HD11 ILE A 18 -7.999 10.229 3.514 1.00 10.00 H new ATOM 0 HD12 ILE A 18 -7.343 11.606 4.430 1.00 10.00 H new ATOM 0 HD13 ILE A 18 -6.295 10.225 4.027 1.00 10.00 H new ATOM 49 N ASN A 19 -8.565 7.550 7.710 1.00 10.00 N ATOM 50 CA ASN A 19 -8.738 6.104 7.629 1.00 10.00 C ATOM 51 C ASN A 19 -8.825 5.648 6.182 1.00 10.00 C ATOM 52 O ASN A 19 -9.692 6.095 5.426 1.00 10.00 O ATOM 53 CB ASN A 19 -9.998 5.664 8.382 1.00 10.00 C ATOM 54 CG ASN A 19 -9.996 6.108 9.829 1.00 10.00 C ATOM 55 OD1 ASN A 19 -9.530 5.390 10.713 1.00 10.00 O ATOM 56 ND2 ASN A 19 -10.517 7.298 10.079 1.00 10.00 N ATOM 0 H ASN A 19 -9.406 8.090 7.505 1.00 10.00 H new ATOM 0 HA ASN A 19 -7.867 5.641 8.093 1.00 10.00 H new ATOM 0 HB2 ASN A 19 -10.877 6.072 7.882 1.00 10.00 H new ATOM 0 HB3 ASN A 19 -10.082 4.578 8.339 1.00 10.00 H new ATOM 0 HD21 ASN A 19 -10.543 7.653 11.035 1.00 10.00 H new ATOM 0 HD22 ASN A 19 -10.893 7.861 9.316 1.00 10.00 H new ATOM 63 N LEU A 20 -7.919 4.766 5.798 1.00 10.00 N ATOM 64 CA LEU A 20 -7.892 4.233 4.447 1.00 10.00 C ATOM 65 C LEU A 20 -8.197 2.741 4.472 1.00 10.00 C ATOM 66 O LEU A 20 -7.709 2.016 5.342 1.00 10.00 O ATOM 67 CB LEU A 20 -6.526 4.490 3.806 1.00 10.00 C ATOM 68 CG LEU A 20 -6.082 5.957 3.801 1.00 10.00 C ATOM 69 CD1 LEU A 20 -4.623 6.071 3.388 1.00 10.00 C ATOM 70 CD2 LEU A 20 -6.966 6.780 2.876 1.00 10.00 C ATOM 0 H LEU A 20 -7.187 4.401 6.408 1.00 10.00 H new ATOM 0 HA LEU A 20 -8.653 4.736 3.851 1.00 10.00 H new ATOM 0 HB2 LEU A 20 -5.776 3.900 4.334 1.00 10.00 H new ATOM 0 HB3 LEU A 20 -6.550 4.129 2.778 1.00 10.00 H new ATOM 0 HG LEU A 20 -6.184 6.351 4.812 1.00 10.00 H new ATOM 0 HD11 LEU A 20 -4.325 7.120 3.390 1.00 10.00 H new ATOM 0 HD12 LEU A 20 -4.002 5.516 4.091 1.00 10.00 H new ATOM 0 HD13 LEU A 20 -4.495 5.659 2.387 1.00 10.00 H new ATOM 0 HD21 LEU A 20 -6.635 7.819 2.886 1.00 10.00 H new ATOM 0 HD22 LEU A 20 -6.897 6.387 1.862 1.00 10.00 H new ATOM 0 HD23 LEU A 20 -8.000 6.725 3.217 1.00 10.00 H new ATOM 82 N LYS A 21 -9.004 2.287 3.522 1.00 10.00 N ATOM 83 CA LYS A 21 -9.387 0.884 3.446 1.00 10.00 C ATOM 84 C LYS A 21 -8.523 0.131 2.444 1.00 10.00 C ATOM 85 O LYS A 21 -8.549 0.420 1.247 1.00 10.00 O ATOM 86 CB LYS A 21 -10.853 0.747 3.023 1.00 10.00 C ATOM 87 CG LYS A 21 -11.829 1.547 3.868 1.00 10.00 C ATOM 88 CD LYS A 21 -13.143 1.739 3.133 1.00 10.00 C ATOM 89 CE LYS A 21 -14.171 2.444 3.998 1.00 10.00 C ATOM 90 NZ LYS A 21 -15.349 2.888 3.207 1.00 10.00 N ATOM 0 H LYS A 21 -9.407 2.873 2.791 1.00 10.00 H new ATOM 0 HA LYS A 21 -9.245 0.457 4.439 1.00 10.00 H new ATOM 0 HB2 LYS A 21 -10.949 1.061 1.984 1.00 10.00 H new ATOM 0 HB3 LYS A 21 -11.133 -0.305 3.065 1.00 10.00 H new ATOM 0 HG2 LYS A 21 -12.007 1.032 4.812 1.00 10.00 H new ATOM 0 HG3 LYS A 21 -11.397 2.518 4.110 1.00 10.00 H new ATOM 0 HD2 LYS A 21 -12.971 2.319 2.226 1.00 10.00 H new ATOM 0 HD3 LYS A 21 -13.532 0.769 2.823 1.00 10.00 H new ATOM 0 HE2 LYS A 21 -14.499 1.773 4.792 1.00 10.00 H new ATOM 0 HE3 LYS A 21 -13.710 3.307 4.479 1.00 10.00 H new ATOM 0 HZ1 LYS A 21 -15.937 3.522 3.785 1.00 10.00 H new ATOM 0 HZ2 LYS A 21 -15.026 3.394 2.358 1.00 10.00 H new ATOM 0 HZ3 LYS A 21 -15.909 2.059 2.924 1.00 10.00 H new ATOM 104 N VAL A 22 -7.758 -0.826 2.934 1.00 10.00 N ATOM 105 CA VAL A 22 -6.916 -1.638 2.074 1.00 10.00 C ATOM 106 C VAL A 22 -7.526 -3.031 1.976 1.00 10.00 C ATOM 107 O VAL A 22 -7.415 -3.836 2.903 1.00 10.00 O ATOM 108 CB VAL A 22 -5.466 -1.726 2.598 1.00 10.00 C ATOM 109 CG1 VAL A 22 -4.610 -2.594 1.687 1.00 10.00 C ATOM 110 CG2 VAL A 22 -4.863 -0.335 2.740 1.00 10.00 C ATOM 0 H VAL A 22 -7.702 -1.061 3.925 1.00 10.00 H new ATOM 0 HA VAL A 22 -6.869 -1.171 1.090 1.00 10.00 H new ATOM 0 HB VAL A 22 -5.489 -2.193 3.583 1.00 10.00 H new ATOM 0 HG11 VAL A 22 -3.594 -2.640 2.078 1.00 10.00 H new ATOM 0 HG12 VAL A 22 -5.028 -3.600 1.644 1.00 10.00 H new ATOM 0 HG13 VAL A 22 -4.594 -2.165 0.685 1.00 10.00 H new ATOM 0 HG21 VAL A 22 -3.841 -0.417 3.110 1.00 10.00 H new ATOM 0 HG22 VAL A 22 -4.858 0.160 1.769 1.00 10.00 H new ATOM 0 HG23 VAL A 22 -5.457 0.249 3.442 1.00 10.00 H new ATOM 120 N ALA A 23 -8.191 -3.298 0.861 1.00 10.00 N ATOM 121 CA ALA A 23 -8.855 -4.575 0.657 1.00 10.00 C ATOM 122 C ALA A 23 -8.092 -5.473 -0.303 1.00 10.00 C ATOM 123 O ALA A 23 -7.610 -5.026 -1.346 1.00 10.00 O ATOM 124 CB ALA A 23 -10.271 -4.349 0.146 1.00 10.00 C ATOM 0 H ALA A 23 -8.284 -2.645 0.083 1.00 10.00 H new ATOM 0 HA ALA A 23 -8.888 -5.083 1.621 1.00 10.00 H new ATOM 0 HB1 ALA A 23 -10.761 -5.311 -0.004 1.00 10.00 H new ATOM 0 HB2 ALA A 23 -10.832 -3.765 0.876 1.00 10.00 H new ATOM 0 HB3 ALA A 23 -10.235 -3.809 -0.800 1.00 10.00 H new ATOM 130 N GLY A 24 -7.989 -6.745 0.058 1.00 10.00 N ATOM 131 CA GLY A 24 -7.303 -7.705 -0.778 1.00 10.00 C ATOM 132 C GLY A 24 -8.221 -8.273 -1.842 1.00 10.00 C ATOM 133 O GLY A 24 -9.378 -7.863 -1.951 1.00 10.00 O ATOM 0 H GLY A 24 -8.372 -7.129 0.922 1.00 10.00 H new ATOM 0 HA2 GLY A 24 -6.446 -7.228 -1.253 1.00 10.00 H new ATOM 0 HA3 GLY A 24 -6.915 -8.515 -0.160 1.00 10.00 H new ATOM 137 N GLN A 25 -7.724 -9.232 -2.612 1.00 10.00 N ATOM 138 CA GLN A 25 -8.518 -9.843 -3.676 1.00 10.00 C ATOM 139 C GLN A 25 -9.433 -10.929 -3.116 1.00 10.00 C ATOM 140 O GLN A 25 -10.276 -11.478 -3.828 1.00 10.00 O ATOM 141 CB GLN A 25 -7.601 -10.427 -4.757 1.00 10.00 C ATOM 142 CG GLN A 25 -6.595 -9.425 -5.303 1.00 10.00 C ATOM 143 CD GLN A 25 -7.248 -8.152 -5.811 1.00 10.00 C ATOM 144 OE1 GLN A 25 -8.330 -8.186 -6.401 1.00 10.00 O ATOM 145 NE2 GLN A 25 -6.601 -7.024 -5.575 1.00 10.00 N ATOM 0 H GLN A 25 -6.779 -9.604 -2.522 1.00 10.00 H new ATOM 0 HA GLN A 25 -9.141 -9.068 -4.124 1.00 10.00 H new ATOM 0 HB2 GLN A 25 -7.064 -11.281 -4.345 1.00 10.00 H new ATOM 0 HB3 GLN A 25 -8.212 -10.801 -5.578 1.00 10.00 H new ATOM 0 HG2 GLN A 25 -5.879 -9.173 -4.521 1.00 10.00 H new ATOM 0 HG3 GLN A 25 -6.032 -9.887 -6.114 1.00 10.00 H new ATOM 0 HE21 GLN A 25 -5.708 -7.042 -5.083 1.00 10.00 H new ATOM 0 HE22 GLN A 25 -6.995 -6.136 -5.885 1.00 10.00 H new ATOM 154 N ASP A 26 -9.265 -11.225 -1.836 1.00 10.00 N ATOM 155 CA ASP A 26 -10.067 -12.241 -1.165 1.00 10.00 C ATOM 156 C ASP A 26 -11.245 -11.603 -0.433 1.00 10.00 C ATOM 157 O ASP A 26 -12.398 -11.754 -0.839 1.00 10.00 O ATOM 158 CB ASP A 26 -9.204 -13.047 -0.183 1.00 10.00 C ATOM 159 CG ASP A 26 -8.157 -12.198 0.521 1.00 10.00 C ATOM 160 OD1 ASP A 26 -6.964 -12.338 0.200 1.00 10.00 O ATOM 161 OD2 ASP A 26 -8.526 -11.378 1.389 1.00 10.00 O ATOM 0 H ASP A 26 -8.575 -10.773 -1.236 1.00 10.00 H new ATOM 0 HA ASP A 26 -10.459 -12.920 -1.923 1.00 10.00 H new ATOM 0 HB2 ASP A 26 -9.849 -13.511 0.563 1.00 10.00 H new ATOM 0 HB3 ASP A 26 -8.707 -13.854 -0.722 1.00 10.00 H new ATOM 166 N GLY A 27 -10.947 -10.893 0.642 1.00 10.00 N ATOM 167 CA GLY A 27 -11.975 -10.235 1.421 1.00 10.00 C ATOM 168 C GLY A 27 -11.412 -9.514 2.630 1.00 10.00 C ATOM 169 O GLY A 27 -12.153 -8.892 3.392 1.00 10.00 O ATOM 0 H GLY A 27 -9.999 -10.759 0.993 1.00 10.00 H new ATOM 0 HA2 GLY A 27 -12.504 -9.521 0.790 1.00 10.00 H new ATOM 0 HA3 GLY A 27 -12.706 -10.973 1.750 1.00 10.00 H new ATOM 173 N SER A 28 -10.100 -9.611 2.821 1.00 10.00 N ATOM 174 CA SER A 28 -9.437 -8.952 3.939 1.00 10.00 C ATOM 175 C SER A 28 -9.422 -7.443 3.724 1.00 10.00 C ATOM 176 O SER A 28 -8.973 -6.968 2.680 1.00 10.00 O ATOM 177 CB SER A 28 -8.006 -9.475 4.076 1.00 10.00 C ATOM 178 OG SER A 28 -7.951 -10.878 3.871 1.00 10.00 O ATOM 0 H SER A 28 -9.475 -10.141 2.214 1.00 10.00 H new ATOM 0 HA SER A 28 -9.986 -9.171 4.855 1.00 10.00 H new ATOM 0 HB2 SER A 28 -7.362 -8.974 3.353 1.00 10.00 H new ATOM 0 HB3 SER A 28 -7.621 -9.234 5.067 1.00 10.00 H new ATOM 0 HG SER A 28 -7.816 -11.064 2.918 1.00 10.00 H new ATOM 184 N VAL A 29 -9.920 -6.691 4.699 1.00 10.00 N ATOM 185 CA VAL A 29 -9.953 -5.237 4.588 1.00 10.00 C ATOM 186 C VAL A 29 -9.373 -4.594 5.835 1.00 10.00 C ATOM 187 O VAL A 29 -10.056 -4.462 6.849 1.00 10.00 O ATOM 188 CB VAL A 29 -11.386 -4.691 4.370 1.00 10.00 C ATOM 189 CG1 VAL A 29 -11.349 -3.195 4.091 1.00 10.00 C ATOM 190 CG2 VAL A 29 -12.095 -5.429 3.242 1.00 10.00 C ATOM 0 H VAL A 29 -10.304 -7.060 5.569 1.00 10.00 H new ATOM 0 HA VAL A 29 -9.352 -4.982 3.715 1.00 10.00 H new ATOM 0 HB VAL A 29 -11.952 -4.861 5.286 1.00 10.00 H new ATOM 0 HG11 VAL A 29 -12.364 -2.828 3.940 1.00 10.00 H new ATOM 0 HG12 VAL A 29 -10.898 -2.678 4.938 1.00 10.00 H new ATOM 0 HG13 VAL A 29 -10.758 -3.007 3.195 1.00 10.00 H new ATOM 0 HG21 VAL A 29 -13.098 -5.022 3.115 1.00 10.00 H new ATOM 0 HG22 VAL A 29 -11.533 -5.305 2.316 1.00 10.00 H new ATOM 0 HG23 VAL A 29 -12.162 -6.489 3.487 1.00 10.00 H new ATOM 200 N VAL A 30 -8.116 -4.200 5.758 1.00 10.00 N ATOM 201 CA VAL A 30 -7.451 -3.578 6.889 1.00 10.00 C ATOM 202 C VAL A 30 -7.725 -2.076 6.908 1.00 10.00 C ATOM 203 O VAL A 30 -7.912 -1.452 5.858 1.00 10.00 O ATOM 204 CB VAL A 30 -5.930 -3.850 6.883 1.00 10.00 C ATOM 205 CG1 VAL A 30 -5.664 -5.350 6.909 1.00 10.00 C ATOM 206 CG2 VAL A 30 -5.270 -3.220 5.670 1.00 10.00 C ATOM 0 H VAL A 30 -7.535 -4.299 4.926 1.00 10.00 H new ATOM 0 HA VAL A 30 -7.859 -4.024 7.796 1.00 10.00 H new ATOM 0 HB VAL A 30 -5.499 -3.398 7.777 1.00 10.00 H new ATOM 0 HG11 VAL A 30 -4.589 -5.529 6.904 1.00 10.00 H new ATOM 0 HG12 VAL A 30 -6.100 -5.781 7.810 1.00 10.00 H new ATOM 0 HG13 VAL A 30 -6.113 -5.814 6.031 1.00 10.00 H new ATOM 0 HG21 VAL A 30 -4.200 -3.426 5.690 1.00 10.00 H new ATOM 0 HG22 VAL A 30 -5.703 -3.638 4.762 1.00 10.00 H new ATOM 0 HG23 VAL A 30 -5.432 -2.142 5.686 1.00 10.00 H new ATOM 216 N GLN A 31 -7.750 -1.508 8.103 1.00 10.00 N ATOM 217 CA GLN A 31 -8.021 -0.091 8.278 1.00 10.00 C ATOM 218 C GLN A 31 -6.747 0.658 8.643 1.00 10.00 C ATOM 219 O GLN A 31 -6.242 0.548 9.761 1.00 10.00 O ATOM 220 CB GLN A 31 -9.077 0.104 9.373 1.00 10.00 C ATOM 221 CG GLN A 31 -9.509 1.551 9.568 1.00 10.00 C ATOM 222 CD GLN A 31 -10.478 1.715 10.726 1.00 10.00 C ATOM 223 OE1 GLN A 31 -11.229 0.800 11.058 1.00 10.00 O ATOM 224 NE2 GLN A 31 -10.482 2.888 11.340 1.00 10.00 N ATOM 0 H GLN A 31 -7.584 -2.013 8.974 1.00 10.00 H new ATOM 0 HA GLN A 31 -8.399 0.311 7.338 1.00 10.00 H new ATOM 0 HB2 GLN A 31 -9.954 -0.496 9.129 1.00 10.00 H new ATOM 0 HB3 GLN A 31 -8.683 -0.277 10.315 1.00 10.00 H new ATOM 0 HG2 GLN A 31 -8.629 2.169 9.744 1.00 10.00 H new ATOM 0 HG3 GLN A 31 -9.976 1.914 8.653 1.00 10.00 H new ATOM 0 HE21 GLN A 31 -9.844 3.624 11.037 1.00 10.00 H new ATOM 0 HE22 GLN A 31 -11.123 3.055 12.116 1.00 10.00 H new ATOM 233 N PHE A 32 -6.217 1.404 7.694 1.00 10.00 N ATOM 234 CA PHE A 32 -5.012 2.174 7.932 1.00 10.00 C ATOM 235 C PHE A 32 -5.374 3.548 8.466 1.00 10.00 C ATOM 236 O PHE A 32 -5.922 4.376 7.740 1.00 10.00 O ATOM 237 CB PHE A 32 -4.194 2.304 6.650 1.00 10.00 C ATOM 238 CG PHE A 32 -3.083 1.302 6.545 1.00 10.00 C ATOM 239 CD1 PHE A 32 -3.289 0.079 5.930 1.00 10.00 C ATOM 240 CD2 PHE A 32 -1.830 1.586 7.063 1.00 10.00 C ATOM 241 CE1 PHE A 32 -2.265 -0.845 5.832 1.00 10.00 C ATOM 242 CE2 PHE A 32 -0.804 0.669 6.968 1.00 10.00 C ATOM 243 CZ PHE A 32 -1.021 -0.550 6.352 1.00 10.00 C ATOM 0 H PHE A 32 -6.600 1.493 6.753 1.00 10.00 H new ATOM 0 HA PHE A 32 -4.406 1.653 8.673 1.00 10.00 H new ATOM 0 HB2 PHE A 32 -4.857 2.191 5.792 1.00 10.00 H new ATOM 0 HB3 PHE A 32 -3.773 3.308 6.597 1.00 10.00 H new ATOM 0 HD1 PHE A 32 -4.261 -0.156 5.522 1.00 10.00 H new ATOM 0 HD2 PHE A 32 -1.655 2.536 7.546 1.00 10.00 H new ATOM 0 HE1 PHE A 32 -2.438 -1.796 5.350 1.00 10.00 H new ATOM 0 HE2 PHE A 32 0.169 0.903 7.375 1.00 10.00 H new ATOM 0 HZ PHE A 32 -0.219 -1.269 6.278 1.00 10.00 H new ATOM 253 N LYS A 33 -5.091 3.779 9.738 1.00 10.00 N ATOM 254 CA LYS A 33 -5.389 5.058 10.353 1.00 10.00 C ATOM 255 C LYS A 33 -4.096 5.823 10.576 1.00 10.00 C ATOM 256 O LYS A 33 -3.443 5.684 11.606 1.00 10.00 O ATOM 257 CB LYS A 33 -6.145 4.860 11.666 1.00 10.00 C ATOM 258 CG LYS A 33 -6.640 6.157 12.286 1.00 10.00 C ATOM 259 CD LYS A 33 -7.677 5.896 13.361 1.00 10.00 C ATOM 260 CE LYS A 33 -8.305 7.191 13.850 1.00 10.00 C ATOM 261 NZ LYS A 33 -9.482 6.940 14.722 1.00 10.00 N ATOM 0 H LYS A 33 -4.657 3.098 10.361 1.00 10.00 H new ATOM 0 HA LYS A 33 -6.030 5.638 9.689 1.00 10.00 H new ATOM 0 HB2 LYS A 33 -6.997 4.203 11.489 1.00 10.00 H new ATOM 0 HB3 LYS A 33 -5.494 4.353 12.377 1.00 10.00 H new ATOM 0 HG2 LYS A 33 -5.799 6.701 12.715 1.00 10.00 H new ATOM 0 HG3 LYS A 33 -7.069 6.792 11.511 1.00 10.00 H new ATOM 0 HD2 LYS A 33 -8.453 5.239 12.969 1.00 10.00 H new ATOM 0 HD3 LYS A 33 -7.212 5.376 14.199 1.00 10.00 H new ATOM 0 HE2 LYS A 33 -7.563 7.770 14.399 1.00 10.00 H new ATOM 0 HE3 LYS A 33 -8.609 7.793 12.994 1.00 10.00 H new ATOM 0 HZ1 LYS A 33 -9.882 7.848 15.035 1.00 10.00 H new ATOM 0 HZ2 LYS A 33 -10.201 6.410 14.190 1.00 10.00 H new ATOM 0 HZ3 LYS A 33 -9.187 6.387 15.552 1.00 10.00 H new ATOM 275 N ILE A 34 -3.721 6.614 9.591 1.00 10.00 N ATOM 276 CA ILE A 34 -2.486 7.376 9.657 1.00 10.00 C ATOM 277 C ILE A 34 -2.749 8.864 9.502 1.00 10.00 C ATOM 278 O ILE A 34 -3.897 9.300 9.441 1.00 10.00 O ATOM 279 CB ILE A 34 -1.498 6.925 8.560 1.00 10.00 C ATOM 280 CG1 ILE A 34 -2.104 7.139 7.166 1.00 10.00 C ATOM 281 CG2 ILE A 34 -1.131 5.461 8.761 1.00 10.00 C ATOM 282 CD1 ILE A 34 -1.128 6.901 6.034 1.00 10.00 C ATOM 0 H ILE A 34 -4.254 6.747 8.732 1.00 10.00 H new ATOM 0 HA ILE A 34 -2.048 7.190 10.638 1.00 10.00 H new ATOM 0 HB ILE A 34 -0.594 7.529 8.635 1.00 10.00 H new ATOM 0 HG12 ILE A 34 -2.957 6.472 7.044 1.00 10.00 H new ATOM 0 HG13 ILE A 34 -2.484 8.158 7.098 1.00 10.00 H new ATOM 0 HG21 ILE A 34 -0.434 5.151 7.983 1.00 10.00 H new ATOM 0 HG22 ILE A 34 -0.665 5.334 9.738 1.00 10.00 H new ATOM 0 HG23 ILE A 34 -2.032 4.849 8.706 1.00 10.00 H new ATOM 0 HD11 ILE A 34 -1.628 7.071 5.081 1.00 10.00 H new ATOM 0 HD12 ILE A 34 -0.286 7.586 6.130 1.00 10.00 H new ATOM 0 HD13 ILE A 34 -0.766 5.874 6.075 1.00 10.00 H new ATOM 294 N LYS A 35 -1.679 9.640 9.449 1.00 10.00 N ATOM 295 CA LYS A 35 -1.791 11.075 9.282 1.00 10.00 C ATOM 296 C LYS A 35 -1.691 11.414 7.800 1.00 10.00 C ATOM 297 O LYS A 35 -1.089 10.670 7.025 1.00 10.00 O ATOM 298 CB LYS A 35 -0.708 11.797 10.089 1.00 10.00 C ATOM 299 CG LYS A 35 -0.777 11.496 11.578 1.00 10.00 C ATOM 300 CD LYS A 35 0.127 12.412 12.382 1.00 10.00 C ATOM 301 CE LYS A 35 0.022 12.128 13.871 1.00 10.00 C ATOM 302 NZ LYS A 35 0.661 13.195 14.682 1.00 10.00 N ATOM 0 H LYS A 35 -0.721 9.297 9.520 1.00 10.00 H new ATOM 0 HA LYS A 35 -2.757 11.412 9.658 1.00 10.00 H new ATOM 0 HB2 LYS A 35 0.273 11.508 9.711 1.00 10.00 H new ATOM 0 HB3 LYS A 35 -0.805 12.872 9.936 1.00 10.00 H new ATOM 0 HG2 LYS A 35 -1.805 11.606 11.923 1.00 10.00 H new ATOM 0 HG3 LYS A 35 -0.491 10.459 11.753 1.00 10.00 H new ATOM 0 HD2 LYS A 35 1.160 12.283 12.057 1.00 10.00 H new ATOM 0 HD3 LYS A 35 -0.140 13.451 12.189 1.00 10.00 H new ATOM 0 HE2 LYS A 35 -1.028 12.038 14.151 1.00 10.00 H new ATOM 0 HE3 LYS A 35 0.494 11.171 14.093 1.00 10.00 H new ATOM 0 HZ1 LYS A 35 0.569 12.966 15.692 1.00 10.00 H new ATOM 0 HZ2 LYS A 35 1.668 13.264 14.433 1.00 10.00 H new ATOM 0 HZ3 LYS A 35 0.194 14.104 14.490 1.00 10.00 H new ATOM 316 N ARG A 36 -2.269 12.537 7.407 1.00 10.00 N ATOM 317 CA ARG A 36 -2.270 12.951 6.008 1.00 10.00 C ATOM 318 C ARG A 36 -0.871 13.319 5.512 1.00 10.00 C ATOM 319 O ARG A 36 -0.638 13.395 4.304 1.00 10.00 O ATOM 320 CB ARG A 36 -3.233 14.121 5.809 1.00 10.00 C ATOM 321 CG ARG A 36 -4.693 13.714 5.898 1.00 10.00 C ATOM 322 CD ARG A 36 -5.618 14.833 5.448 1.00 10.00 C ATOM 323 NE ARG A 36 -6.502 14.400 4.365 1.00 10.00 N ATOM 324 CZ ARG A 36 -7.798 14.708 4.283 1.00 10.00 C ATOM 325 NH1 ARG A 36 -8.373 15.463 5.215 1.00 10.00 N ATOM 326 NH2 ARG A 36 -8.517 14.252 3.266 1.00 10.00 N ATOM 0 H ARG A 36 -2.746 13.182 8.037 1.00 10.00 H new ATOM 0 HA ARG A 36 -2.606 12.101 5.414 1.00 10.00 H new ATOM 0 HB2 ARG A 36 -3.028 14.884 6.560 1.00 10.00 H new ATOM 0 HB3 ARG A 36 -3.047 14.575 4.835 1.00 10.00 H new ATOM 0 HG2 ARG A 36 -4.863 12.832 5.281 1.00 10.00 H new ATOM 0 HG3 ARG A 36 -4.931 13.436 6.925 1.00 10.00 H new ATOM 0 HD2 ARG A 36 -6.217 15.173 6.293 1.00 10.00 H new ATOM 0 HD3 ARG A 36 -5.024 15.685 5.115 1.00 10.00 H new ATOM 0 HE ARG A 36 -6.101 13.825 3.624 1.00 10.00 H new ATOM 0 HH11 ARG A 36 -7.823 15.811 6.000 1.00 10.00 H new ATOM 0 HH12 ARG A 36 -9.364 15.694 5.145 1.00 10.00 H new ATOM 0 HH21 ARG A 36 -8.079 13.670 2.552 1.00 10.00 H new ATOM 0 HH22 ARG A 36 -9.508 14.484 3.198 1.00 10.00 H new ATOM 340 N HIS A 37 0.057 13.526 6.437 1.00 10.00 N ATOM 341 CA HIS A 37 1.427 13.879 6.076 1.00 10.00 C ATOM 342 C HIS A 37 2.366 12.679 6.220 1.00 10.00 C ATOM 343 O HIS A 37 3.587 12.823 6.162 1.00 10.00 O ATOM 344 CB HIS A 37 1.931 15.062 6.920 1.00 10.00 C ATOM 345 CG HIS A 37 1.867 14.845 8.405 1.00 10.00 C ATOM 346 ND1 HIS A 37 2.850 14.162 9.076 1.00 10.00 N ATOM 347 CD2 HIS A 37 0.931 15.254 9.294 1.00 10.00 C ATOM 348 CE1 HIS A 37 2.500 14.177 10.349 1.00 10.00 C ATOM 349 NE2 HIS A 37 1.342 14.825 10.529 1.00 10.00 N ATOM 0 H HIS A 37 -0.111 13.456 7.441 1.00 10.00 H new ATOM 0 HA HIS A 37 1.424 14.181 5.029 1.00 10.00 H new ATOM 0 HB2 HIS A 37 2.963 15.276 6.642 1.00 10.00 H new ATOM 0 HB3 HIS A 37 1.344 15.946 6.670 1.00 10.00 H new ATOM 0 HD1 HIS A 37 3.682 13.730 8.673 1.00 10.00 H new ATOM 0 HD2 HIS A 37 0.033 15.811 9.072 1.00 10.00 H new ATOM 0 HE1 HIS A 37 3.074 13.724 11.144 1.00 10.00 H new ATOM 357 N THR A 38 1.790 11.497 6.407 1.00 10.00 N ATOM 358 CA THR A 38 2.578 10.282 6.544 1.00 10.00 C ATOM 359 C THR A 38 2.762 9.610 5.180 1.00 10.00 C ATOM 360 O THR A 38 1.783 9.286 4.508 1.00 10.00 O ATOM 361 CB THR A 38 1.911 9.305 7.531 1.00 10.00 C ATOM 362 OG1 THR A 38 1.613 9.996 8.752 1.00 10.00 O ATOM 363 CG2 THR A 38 2.817 8.119 7.825 1.00 10.00 C ATOM 0 H THR A 38 0.782 11.356 6.467 1.00 10.00 H new ATOM 0 HA THR A 38 3.557 10.554 6.938 1.00 10.00 H new ATOM 0 HB THR A 38 0.993 8.929 7.079 1.00 10.00 H new ATOM 0 HG1 THR A 38 1.336 9.350 9.435 1.00 10.00 H new ATOM 0 HG21 THR A 38 2.320 7.446 8.524 1.00 10.00 H new ATOM 0 HG22 THR A 38 3.031 7.586 6.899 1.00 10.00 H new ATOM 0 HG23 THR A 38 3.750 8.474 8.263 1.00 10.00 H new ATOM 371 N PRO A 39 4.024 9.423 4.748 1.00 10.00 N ATOM 372 CA PRO A 39 4.353 8.804 3.452 1.00 10.00 C ATOM 373 C PRO A 39 3.680 7.448 3.243 1.00 10.00 C ATOM 374 O PRO A 39 3.704 6.584 4.125 1.00 10.00 O ATOM 375 CB PRO A 39 5.872 8.639 3.511 1.00 10.00 C ATOM 376 CG PRO A 39 6.332 9.674 4.475 1.00 10.00 C ATOM 377 CD PRO A 39 5.237 9.808 5.494 1.00 10.00 C ATOM 0 HA PRO A 39 4.002 9.416 2.621 1.00 10.00 H new ATOM 0 HB2 PRO A 39 6.148 7.638 3.844 1.00 10.00 H new ATOM 0 HB3 PRO A 39 6.324 8.784 2.530 1.00 10.00 H new ATOM 0 HG2 PRO A 39 7.269 9.379 4.946 1.00 10.00 H new ATOM 0 HG3 PRO A 39 6.514 10.623 3.971 1.00 10.00 H new ATOM 0 HD2 PRO A 39 5.405 9.156 6.352 1.00 10.00 H new ATOM 0 HD3 PRO A 39 5.167 10.826 5.876 1.00 10.00 H new ATOM 385 N LEU A 40 3.108 7.257 2.055 1.00 10.00 N ATOM 386 CA LEU A 40 2.420 6.013 1.721 1.00 10.00 C ATOM 387 C LEU A 40 3.405 4.859 1.552 1.00 10.00 C ATOM 388 O LEU A 40 3.006 3.696 1.505 1.00 10.00 O ATOM 389 CB LEU A 40 1.588 6.187 0.447 1.00 10.00 C ATOM 390 CG LEU A 40 0.372 7.107 0.583 1.00 10.00 C ATOM 391 CD1 LEU A 40 -0.315 7.288 -0.762 1.00 10.00 C ATOM 392 CD2 LEU A 40 -0.607 6.553 1.607 1.00 10.00 C ATOM 0 H LEU A 40 3.108 7.950 1.307 1.00 10.00 H new ATOM 0 HA LEU A 40 1.755 5.770 2.550 1.00 10.00 H new ATOM 0 HB2 LEU A 40 2.234 6.579 -0.339 1.00 10.00 H new ATOM 0 HB3 LEU A 40 1.246 5.205 0.119 1.00 10.00 H new ATOM 0 HG LEU A 40 0.718 8.081 0.928 1.00 10.00 H new ATOM 0 HD11 LEU A 40 -1.177 7.945 -0.645 1.00 10.00 H new ATOM 0 HD12 LEU A 40 0.385 7.730 -1.471 1.00 10.00 H new ATOM 0 HD13 LEU A 40 -0.646 6.319 -1.135 1.00 10.00 H new ATOM 0 HD21 LEU A 40 -1.464 7.221 1.689 1.00 10.00 H new ATOM 0 HD22 LEU A 40 -0.945 5.566 1.291 1.00 10.00 H new ATOM 0 HD23 LEU A 40 -0.114 6.474 2.576 1.00 10.00 H new ATOM 404 N SER A 41 4.688 5.186 1.468 1.00 10.00 N ATOM 405 CA SER A 41 5.728 4.179 1.327 1.00 10.00 C ATOM 406 C SER A 41 5.721 3.249 2.534 1.00 10.00 C ATOM 407 O SER A 41 5.770 2.025 2.401 1.00 10.00 O ATOM 408 CB SER A 41 7.085 4.868 1.201 1.00 10.00 C ATOM 409 OG SER A 41 6.966 6.249 1.509 1.00 10.00 O ATOM 0 H SER A 41 5.033 6.146 1.495 1.00 10.00 H new ATOM 0 HA SER A 41 5.540 3.587 0.431 1.00 10.00 H new ATOM 0 HB2 SER A 41 7.803 4.399 1.874 1.00 10.00 H new ATOM 0 HB3 SER A 41 7.470 4.746 0.189 1.00 10.00 H new ATOM 0 HG SER A 41 6.708 6.743 0.703 1.00 10.00 H new ATOM 415 N LYS A 42 5.619 3.848 3.714 1.00 10.00 N ATOM 416 CA LYS A 42 5.602 3.100 4.958 1.00 10.00 C ATOM 417 C LYS A 42 4.278 2.363 5.111 1.00 10.00 C ATOM 418 O LYS A 42 4.207 1.327 5.767 1.00 10.00 O ATOM 419 CB LYS A 42 5.860 4.045 6.130 1.00 10.00 C ATOM 420 CG LYS A 42 7.170 4.802 5.978 1.00 10.00 C ATOM 421 CD LYS A 42 7.452 5.724 7.148 1.00 10.00 C ATOM 422 CE LYS A 42 8.798 6.406 6.970 1.00 10.00 C ATOM 423 NZ LYS A 42 9.253 7.096 8.200 1.00 10.00 N ATOM 0 H LYS A 42 5.546 4.859 3.832 1.00 10.00 H new ATOM 0 HA LYS A 42 6.395 2.352 4.946 1.00 10.00 H new ATOM 0 HB2 LYS A 42 5.038 4.756 6.209 1.00 10.00 H new ATOM 0 HB3 LYS A 42 5.878 3.474 7.058 1.00 10.00 H new ATOM 0 HG2 LYS A 42 7.988 4.088 5.878 1.00 10.00 H new ATOM 0 HG3 LYS A 42 7.143 5.387 5.058 1.00 10.00 H new ATOM 0 HD2 LYS A 42 6.665 6.474 7.227 1.00 10.00 H new ATOM 0 HD3 LYS A 42 7.445 5.155 8.078 1.00 10.00 H new ATOM 0 HE2 LYS A 42 9.541 5.664 6.678 1.00 10.00 H new ATOM 0 HE3 LYS A 42 8.731 7.128 6.156 1.00 10.00 H new ATOM 0 HZ1 LYS A 42 9.148 8.124 8.080 1.00 10.00 H new ATOM 0 HZ2 LYS A 42 8.678 6.781 9.008 1.00 10.00 H new ATOM 0 HZ3 LYS A 42 10.252 6.868 8.377 1.00 10.00 H new ATOM 437 N LEU A 43 3.235 2.897 4.481 1.00 10.00 N ATOM 438 CA LEU A 43 1.919 2.273 4.515 1.00 10.00 C ATOM 439 C LEU A 43 1.984 0.939 3.779 1.00 10.00 C ATOM 440 O LEU A 43 1.462 -0.076 4.244 1.00 10.00 O ATOM 441 CB LEU A 43 0.874 3.197 3.869 1.00 10.00 C ATOM 442 CG LEU A 43 -0.503 2.572 3.610 1.00 10.00 C ATOM 443 CD1 LEU A 43 -1.605 3.553 3.974 1.00 10.00 C ATOM 444 CD2 LEU A 43 -0.636 2.148 2.154 1.00 10.00 C ATOM 0 H LEU A 43 3.278 3.761 3.941 1.00 10.00 H new ATOM 0 HA LEU A 43 1.622 2.100 5.549 1.00 10.00 H new ATOM 0 HB2 LEU A 43 0.741 4.068 4.510 1.00 10.00 H new ATOM 0 HB3 LEU A 43 1.272 3.557 2.921 1.00 10.00 H new ATOM 0 HG LEU A 43 -0.600 1.686 4.237 1.00 10.00 H new ATOM 0 HD11 LEU A 43 -2.576 3.096 3.785 1.00 10.00 H new ATOM 0 HD12 LEU A 43 -1.526 3.814 5.029 1.00 10.00 H new ATOM 0 HD13 LEU A 43 -1.504 4.454 3.369 1.00 10.00 H new ATOM 0 HD21 LEU A 43 -1.620 1.707 1.992 1.00 10.00 H new ATOM 0 HD22 LEU A 43 -0.518 3.019 1.509 1.00 10.00 H new ATOM 0 HD23 LEU A 43 0.134 1.414 1.917 1.00 10.00 H new ATOM 456 N MET A 44 2.647 0.955 2.627 1.00 10.00 N ATOM 457 CA MET A 44 2.812 -0.245 1.819 1.00 10.00 C ATOM 458 C MET A 44 3.665 -1.260 2.566 1.00 10.00 C ATOM 459 O MET A 44 3.351 -2.450 2.596 1.00 10.00 O ATOM 460 CB MET A 44 3.462 0.097 0.474 1.00 10.00 C ATOM 461 CG MET A 44 2.580 0.933 -0.440 1.00 10.00 C ATOM 462 SD MET A 44 3.264 1.111 -2.100 1.00 10.00 S ATOM 463 CE MET A 44 4.683 2.155 -1.775 1.00 10.00 C ATOM 0 H MET A 44 3.080 1.790 2.232 1.00 10.00 H new ATOM 0 HA MET A 44 1.828 -0.674 1.629 1.00 10.00 H new ATOM 0 HB2 MET A 44 4.392 0.635 0.657 1.00 10.00 H new ATOM 0 HB3 MET A 44 3.725 -0.829 -0.038 1.00 10.00 H new ATOM 0 HG2 MET A 44 1.594 0.473 -0.506 1.00 10.00 H new ATOM 0 HG3 MET A 44 2.443 1.921 -0.001 1.00 10.00 H new ATOM 0 HE1 MET A 44 5.230 2.325 -2.702 1.00 10.00 H new ATOM 0 HE2 MET A 44 4.347 3.110 -1.372 1.00 10.00 H new ATOM 0 HE3 MET A 44 5.337 1.666 -1.053 1.00 10.00 H new ATOM 473 N LYS A 45 4.736 -0.772 3.183 1.00 10.00 N ATOM 474 CA LYS A 45 5.640 -1.622 3.946 1.00 10.00 C ATOM 475 C LYS A 45 4.910 -2.264 5.123 1.00 10.00 C ATOM 476 O LYS A 45 5.055 -3.459 5.366 1.00 10.00 O ATOM 477 CB LYS A 45 6.839 -0.814 4.451 1.00 10.00 C ATOM 478 CG LYS A 45 7.838 -0.457 3.364 1.00 10.00 C ATOM 479 CD LYS A 45 8.641 -1.672 2.921 1.00 10.00 C ATOM 480 CE LYS A 45 9.862 -1.890 3.802 1.00 10.00 C ATOM 481 NZ LYS A 45 11.061 -1.176 3.282 1.00 10.00 N ATOM 0 H LYS A 45 4.999 0.213 3.169 1.00 10.00 H new ATOM 0 HA LYS A 45 6.001 -2.411 3.287 1.00 10.00 H new ATOM 0 HB2 LYS A 45 6.478 0.104 4.915 1.00 10.00 H new ATOM 0 HB3 LYS A 45 7.349 -1.384 5.227 1.00 10.00 H new ATOM 0 HG2 LYS A 45 7.310 -0.037 2.508 1.00 10.00 H new ATOM 0 HG3 LYS A 45 8.516 0.314 3.731 1.00 10.00 H new ATOM 0 HD2 LYS A 45 8.007 -2.558 2.951 1.00 10.00 H new ATOM 0 HD3 LYS A 45 8.957 -1.542 1.886 1.00 10.00 H new ATOM 0 HE2 LYS A 45 9.645 -1.546 4.813 1.00 10.00 H new ATOM 0 HE3 LYS A 45 10.076 -2.957 3.868 1.00 10.00 H new ATOM 0 HZ1 LYS A 45 11.870 -1.351 3.912 1.00 10.00 H new ATOM 0 HZ2 LYS A 45 11.284 -1.522 2.327 1.00 10.00 H new ATOM 0 HZ3 LYS A 45 10.867 -0.155 3.243 1.00 10.00 H new ATOM 495 N ALA A 46 4.120 -1.463 5.836 1.00 10.00 N ATOM 496 CA ALA A 46 3.360 -1.944 6.987 1.00 10.00 C ATOM 497 C ALA A 46 2.430 -3.087 6.597 1.00 10.00 C ATOM 498 O ALA A 46 2.415 -4.133 7.246 1.00 10.00 O ATOM 499 CB ALA A 46 2.570 -0.804 7.611 1.00 10.00 C ATOM 0 H ALA A 46 3.990 -0.472 5.634 1.00 10.00 H new ATOM 0 HA ALA A 46 4.068 -2.326 7.723 1.00 10.00 H new ATOM 0 HB1 ALA A 46 2.008 -1.177 8.468 1.00 10.00 H new ATOM 0 HB2 ALA A 46 3.256 -0.023 7.939 1.00 10.00 H new ATOM 0 HB3 ALA A 46 1.879 -0.394 6.874 1.00 10.00 H new ATOM 505 N TYR A 47 1.662 -2.890 5.527 1.00 10.00 N ATOM 506 CA TYR A 47 0.745 -3.921 5.058 1.00 10.00 C ATOM 507 C TYR A 47 1.525 -5.167 4.655 1.00 10.00 C ATOM 508 O TYR A 47 1.128 -6.291 4.963 1.00 10.00 O ATOM 509 CB TYR A 47 -0.084 -3.419 3.873 1.00 10.00 C ATOM 510 CG TYR A 47 -1.133 -4.409 3.415 1.00 10.00 C ATOM 511 CD1 TYR A 47 -1.058 -5.006 2.162 1.00 10.00 C ATOM 512 CD2 TYR A 47 -2.194 -4.752 4.243 1.00 10.00 C ATOM 513 CE1 TYR A 47 -2.011 -5.916 1.748 1.00 10.00 C ATOM 514 CE2 TYR A 47 -3.151 -5.660 3.834 1.00 10.00 C ATOM 515 CZ TYR A 47 -3.055 -6.240 2.587 1.00 10.00 C ATOM 516 OH TYR A 47 -4.006 -7.147 2.177 1.00 10.00 O ATOM 0 H TYR A 47 1.657 -2.033 4.974 1.00 10.00 H new ATOM 0 HA TYR A 47 0.064 -4.169 5.872 1.00 10.00 H new ATOM 0 HB2 TYR A 47 -0.572 -2.485 4.150 1.00 10.00 H new ATOM 0 HB3 TYR A 47 0.583 -3.196 3.040 1.00 10.00 H new ATOM 0 HD1 TYR A 47 -0.241 -4.754 1.502 1.00 10.00 H new ATOM 0 HD2 TYR A 47 -2.272 -4.302 5.222 1.00 10.00 H new ATOM 0 HE1 TYR A 47 -1.938 -6.371 0.771 1.00 10.00 H new ATOM 0 HE2 TYR A 47 -3.971 -5.915 4.489 1.00 10.00 H new ATOM 0 HH TYR A 47 -4.672 -7.265 2.886 1.00 10.00 H new ATOM 526 N CYS A 48 2.647 -4.950 3.984 1.00 10.00 N ATOM 527 CA CYS A 48 3.499 -6.040 3.538 1.00 10.00 C ATOM 528 C CYS A 48 4.046 -6.822 4.732 1.00 10.00 C ATOM 529 O CYS A 48 4.198 -8.042 4.671 1.00 10.00 O ATOM 530 CB CYS A 48 4.647 -5.495 2.693 1.00 10.00 C ATOM 531 SG CYS A 48 5.364 -6.706 1.569 1.00 10.00 S ATOM 0 H CYS A 48 2.989 -4.022 3.736 1.00 10.00 H new ATOM 0 HA CYS A 48 2.902 -6.719 2.929 1.00 10.00 H new ATOM 0 HB2 CYS A 48 4.287 -4.645 2.114 1.00 10.00 H new ATOM 0 HB3 CYS A 48 5.428 -5.122 3.356 1.00 10.00 H new ATOM 0 HG CYS A 48 6.157 -7.496 2.230 1.00 10.00 H new ATOM 537 N GLU A 49 4.322 -6.111 5.823 1.00 10.00 N ATOM 538 CA GLU A 49 4.836 -6.729 7.039 1.00 10.00 C ATOM 539 C GLU A 49 3.826 -7.720 7.607 1.00 10.00 C ATOM 540 O GLU A 49 4.182 -8.834 7.987 1.00 10.00 O ATOM 541 CB GLU A 49 5.145 -5.665 8.094 1.00 10.00 C ATOM 542 CG GLU A 49 6.375 -4.824 7.789 1.00 10.00 C ATOM 543 CD GLU A 49 7.659 -5.618 7.865 1.00 10.00 C ATOM 544 OE1 GLU A 49 7.909 -6.251 8.910 1.00 10.00 O ATOM 545 OE2 GLU A 49 8.430 -5.609 6.881 1.00 10.00 O ATOM 0 H GLU A 49 4.197 -5.101 5.888 1.00 10.00 H new ATOM 0 HA GLU A 49 5.753 -7.259 6.782 1.00 10.00 H new ATOM 0 HB2 GLU A 49 4.283 -5.005 8.192 1.00 10.00 H new ATOM 0 HB3 GLU A 49 5.283 -6.155 9.058 1.00 10.00 H new ATOM 0 HG2 GLU A 49 6.278 -4.393 6.792 1.00 10.00 H new ATOM 0 HG3 GLU A 49 6.425 -3.992 8.492 1.00 10.00 H new ATOM 552 N ARG A 50 2.562 -7.306 7.647 1.00 10.00 N ATOM 553 CA ARG A 50 1.494 -8.152 8.171 1.00 10.00 C ATOM 554 C ARG A 50 1.203 -9.316 7.232 1.00 10.00 C ATOM 555 O ARG A 50 0.702 -10.359 7.655 1.00 10.00 O ATOM 556 CB ARG A 50 0.221 -7.333 8.398 1.00 10.00 C ATOM 557 CG ARG A 50 0.407 -6.212 9.403 1.00 10.00 C ATOM 558 CD ARG A 50 -0.875 -5.908 10.163 1.00 10.00 C ATOM 559 NE ARG A 50 -0.585 -5.273 11.446 1.00 10.00 N ATOM 560 CZ ARG A 50 -1.502 -4.774 12.274 1.00 10.00 C ATOM 561 NH1 ARG A 50 -2.791 -4.781 11.954 1.00 10.00 N ATOM 562 NH2 ARG A 50 -1.117 -4.249 13.429 1.00 10.00 N ATOM 0 H ARG A 50 2.253 -6.390 7.323 1.00 10.00 H new ATOM 0 HA ARG A 50 1.830 -8.557 9.126 1.00 10.00 H new ATOM 0 HB2 ARG A 50 -0.107 -6.911 7.448 1.00 10.00 H new ATOM 0 HB3 ARG A 50 -0.573 -7.995 8.744 1.00 10.00 H new ATOM 0 HG2 ARG A 50 1.191 -6.485 10.109 1.00 10.00 H new ATOM 0 HG3 ARG A 50 0.743 -5.314 8.886 1.00 10.00 H new ATOM 0 HD2 ARG A 50 -1.510 -5.254 9.565 1.00 10.00 H new ATOM 0 HD3 ARG A 50 -1.432 -6.830 10.327 1.00 10.00 H new ATOM 0 HE ARG A 50 0.393 -5.207 11.729 1.00 10.00 H new ATOM 0 HH11 ARG A 50 -3.093 -5.173 11.062 1.00 10.00 H new ATOM 0 HH12 ARG A 50 -3.479 -4.395 12.600 1.00 10.00 H new ATOM 0 HH21 ARG A 50 -0.128 -4.230 13.676 1.00 10.00 H new ATOM 0 HH22 ARG A 50 -1.810 -3.864 14.071 1.00 10.00 H new ATOM 576 N GLN A 51 1.518 -9.135 5.957 1.00 10.00 N ATOM 577 CA GLN A 51 1.295 -10.176 4.967 1.00 10.00 C ATOM 578 C GLN A 51 2.445 -11.175 4.961 1.00 10.00 C ATOM 579 O GLN A 51 2.245 -12.359 4.691 1.00 10.00 O ATOM 580 CB GLN A 51 1.127 -9.568 3.573 1.00 10.00 C ATOM 581 CG GLN A 51 -0.198 -8.846 3.378 1.00 10.00 C ATOM 582 CD GLN A 51 -1.379 -9.645 3.896 1.00 10.00 C ATOM 583 OE1 GLN A 51 -1.810 -9.472 5.034 1.00 10.00 O ATOM 584 NE2 GLN A 51 -1.901 -10.533 3.067 1.00 10.00 N ATOM 0 H GLN A 51 1.928 -8.278 5.586 1.00 10.00 H new ATOM 0 HA GLN A 51 0.378 -10.701 5.236 1.00 10.00 H new ATOM 0 HB2 GLN A 51 1.943 -8.868 3.390 1.00 10.00 H new ATOM 0 HB3 GLN A 51 1.213 -10.359 2.828 1.00 10.00 H new ATOM 0 HG2 GLN A 51 -0.162 -7.884 3.890 1.00 10.00 H new ATOM 0 HG3 GLN A 51 -0.342 -8.638 2.318 1.00 10.00 H new ATOM 0 HE21 GLN A 51 -1.514 -10.646 2.130 1.00 10.00 H new ATOM 0 HE22 GLN A 51 -2.691 -11.105 3.364 1.00 10.00 H new ATOM 593 N GLY A 52 3.645 -10.694 5.258 1.00 10.00 N ATOM 594 CA GLY A 52 4.809 -11.557 5.278 1.00 10.00 C ATOM 595 C GLY A 52 5.328 -11.828 3.883 1.00 10.00 C ATOM 596 O GLY A 52 5.622 -12.971 3.528 1.00 10.00 O ATOM 0 H GLY A 52 3.833 -9.718 5.486 1.00 10.00 H new ATOM 0 HA2 GLY A 52 5.595 -11.095 5.875 1.00 10.00 H new ATOM 0 HA3 GLY A 52 4.555 -12.500 5.761 1.00 10.00 H new ATOM 600 N LEU A 53 5.433 -10.773 3.089 1.00 10.00 N ATOM 601 CA LEU A 53 5.908 -10.882 1.718 1.00 10.00 C ATOM 602 C LEU A 53 6.852 -9.735 1.390 1.00 10.00 C ATOM 603 O LEU A 53 7.242 -8.966 2.270 1.00 10.00 O ATOM 604 CB LEU A 53 4.729 -10.865 0.739 1.00 10.00 C ATOM 605 CG LEU A 53 3.734 -12.018 0.883 1.00 10.00 C ATOM 606 CD1 LEU A 53 2.435 -11.691 0.167 1.00 10.00 C ATOM 607 CD2 LEU A 53 4.325 -13.307 0.336 1.00 10.00 C ATOM 0 H LEU A 53 5.193 -9.824 3.374 1.00 10.00 H new ATOM 0 HA LEU A 53 6.443 -11.827 1.619 1.00 10.00 H new ATOM 0 HB2 LEU A 53 4.190 -9.926 0.864 1.00 10.00 H new ATOM 0 HB3 LEU A 53 5.123 -10.874 -0.277 1.00 10.00 H new ATOM 0 HG LEU A 53 3.523 -12.157 1.943 1.00 10.00 H new ATOM 0 HD11 LEU A 53 1.738 -12.522 0.279 1.00 10.00 H new ATOM 0 HD12 LEU A 53 1.998 -10.790 0.599 1.00 10.00 H new ATOM 0 HD13 LEU A 53 2.635 -11.526 -0.892 1.00 10.00 H new ATOM 0 HD21 LEU A 53 3.602 -14.115 0.448 1.00 10.00 H new ATOM 0 HD22 LEU A 53 4.565 -13.178 -0.719 1.00 10.00 H new ATOM 0 HD23 LEU A 53 5.233 -13.554 0.887 1.00 10.00 H new ATOM 619 N SER A 54 7.211 -9.624 0.121 1.00 10.00 N ATOM 620 CA SER A 54 8.091 -8.564 -0.335 1.00 10.00 C ATOM 621 C SER A 54 7.267 -7.463 -0.989 1.00 10.00 C ATOM 622 O SER A 54 6.318 -7.746 -1.726 1.00 10.00 O ATOM 623 CB SER A 54 9.122 -9.115 -1.325 1.00 10.00 C ATOM 624 OG SER A 54 9.703 -8.075 -2.097 1.00 10.00 O ATOM 0 H SER A 54 6.903 -10.260 -0.614 1.00 10.00 H new ATOM 0 HA SER A 54 8.624 -8.151 0.521 1.00 10.00 H new ATOM 0 HB2 SER A 54 9.903 -9.647 -0.782 1.00 10.00 H new ATOM 0 HB3 SER A 54 8.644 -9.838 -1.986 1.00 10.00 H new ATOM 0 HG SER A 54 10.358 -8.456 -2.719 1.00 10.00 H new ATOM 630 N MET A 55 7.631 -6.212 -0.732 1.00 10.00 N ATOM 631 CA MET A 55 6.913 -5.075 -1.299 1.00 10.00 C ATOM 632 C MET A 55 7.111 -5.014 -2.811 1.00 10.00 C ATOM 633 O MET A 55 6.399 -4.302 -3.514 1.00 10.00 O ATOM 634 CB MET A 55 7.374 -3.764 -0.657 1.00 10.00 C ATOM 635 CG MET A 55 6.291 -2.697 -0.626 1.00 10.00 C ATOM 636 SD MET A 55 6.925 -1.066 -0.193 1.00 10.00 S ATOM 637 CE MET A 55 7.744 -0.607 -1.719 1.00 10.00 C ATOM 0 H MET A 55 8.418 -5.959 -0.135 1.00 10.00 H new ATOM 0 HA MET A 55 5.852 -5.210 -1.089 1.00 10.00 H new ATOM 0 HB2 MET A 55 7.707 -3.964 0.361 1.00 10.00 H new ATOM 0 HB3 MET A 55 8.235 -3.382 -1.205 1.00 10.00 H new ATOM 0 HG2 MET A 55 5.810 -2.647 -1.603 1.00 10.00 H new ATOM 0 HG3 MET A 55 5.524 -2.986 0.093 1.00 10.00 H new ATOM 0 HE1 MET A 55 8.773 -0.317 -1.507 1.00 10.00 H new ATOM 0 HE2 MET A 55 7.740 -1.455 -2.403 1.00 10.00 H new ATOM 0 HE3 MET A 55 7.218 0.231 -2.177 1.00 10.00 H new ATOM 647 N ARG A 56 8.080 -5.775 -3.306 1.00 10.00 N ATOM 648 CA ARG A 56 8.367 -5.818 -4.732 1.00 10.00 C ATOM 649 C ARG A 56 7.508 -6.887 -5.405 1.00 10.00 C ATOM 650 O ARG A 56 7.439 -6.969 -6.632 1.00 10.00 O ATOM 651 CB ARG A 56 9.852 -6.112 -4.965 1.00 10.00 C ATOM 652 CG ARG A 56 10.323 -5.816 -6.381 1.00 10.00 C ATOM 653 CD ARG A 56 11.804 -6.104 -6.549 1.00 10.00 C ATOM 654 NE ARG A 56 12.283 -5.733 -7.878 1.00 10.00 N ATOM 655 CZ ARG A 56 12.839 -4.558 -8.171 1.00 10.00 C ATOM 656 NH1 ARG A 56 12.991 -3.634 -7.229 1.00 10.00 N ATOM 657 NH2 ARG A 56 13.239 -4.309 -9.413 1.00 10.00 N ATOM 0 H ARG A 56 8.681 -6.372 -2.738 1.00 10.00 H new ATOM 0 HA ARG A 56 8.131 -4.847 -5.168 1.00 10.00 H new ATOM 0 HB2 ARG A 56 10.444 -5.522 -4.265 1.00 10.00 H new ATOM 0 HB3 ARG A 56 10.045 -7.161 -4.740 1.00 10.00 H new ATOM 0 HG2 ARG A 56 9.752 -6.418 -7.088 1.00 10.00 H new ATOM 0 HG3 ARG A 56 10.126 -4.771 -6.620 1.00 10.00 H new ATOM 0 HD2 ARG A 56 12.368 -5.557 -5.794 1.00 10.00 H new ATOM 0 HD3 ARG A 56 11.989 -7.165 -6.379 1.00 10.00 H new ATOM 0 HE ARG A 56 12.186 -6.416 -8.629 1.00 10.00 H new ATOM 0 HH11 ARG A 56 12.681 -3.822 -6.275 1.00 10.00 H new ATOM 0 HH12 ARG A 56 13.417 -2.736 -7.459 1.00 10.00 H new ATOM 0 HH21 ARG A 56 13.120 -5.016 -10.139 1.00 10.00 H new ATOM 0 HH22 ARG A 56 13.665 -3.411 -9.641 1.00 10.00 H new ATOM 671 N GLN A 57 6.838 -7.692 -4.586 1.00 10.00 N ATOM 672 CA GLN A 57 5.987 -8.765 -5.085 1.00 10.00 C ATOM 673 C GLN A 57 4.544 -8.289 -5.256 1.00 10.00 C ATOM 674 O GLN A 57 3.805 -8.803 -6.092 1.00 10.00 O ATOM 675 CB GLN A 57 6.039 -9.959 -4.126 1.00 10.00 C ATOM 676 CG GLN A 57 5.179 -11.134 -4.563 1.00 10.00 C ATOM 677 CD GLN A 57 5.149 -12.251 -3.538 1.00 10.00 C ATOM 678 OE1 GLN A 57 6.134 -12.501 -2.842 1.00 10.00 O ATOM 679 NE2 GLN A 57 4.019 -12.929 -3.437 1.00 10.00 N ATOM 0 H GLN A 57 6.869 -7.620 -3.569 1.00 10.00 H new ATOM 0 HA GLN A 57 6.359 -9.071 -6.063 1.00 10.00 H new ATOM 0 HB2 GLN A 57 7.072 -10.292 -4.031 1.00 10.00 H new ATOM 0 HB3 GLN A 57 5.717 -9.633 -3.137 1.00 10.00 H new ATOM 0 HG2 GLN A 57 4.162 -10.787 -4.745 1.00 10.00 H new ATOM 0 HG3 GLN A 57 5.557 -11.524 -5.508 1.00 10.00 H new ATOM 0 HE21 GLN A 57 3.226 -12.690 -4.032 1.00 10.00 H new ATOM 0 HE22 GLN A 57 3.940 -13.691 -2.764 1.00 10.00 H new ATOM 688 N ILE A 58 4.151 -7.299 -4.470 1.00 10.00 N ATOM 689 CA ILE A 58 2.795 -6.772 -4.541 1.00 10.00 C ATOM 690 C ILE A 58 2.770 -5.392 -5.197 1.00 10.00 C ATOM 691 O ILE A 58 3.811 -4.754 -5.364 1.00 10.00 O ATOM 692 CB ILE A 58 2.140 -6.692 -3.145 1.00 10.00 C ATOM 693 CG1 ILE A 58 3.034 -5.911 -2.172 1.00 10.00 C ATOM 694 CG2 ILE A 58 1.858 -8.094 -2.615 1.00 10.00 C ATOM 695 CD1 ILE A 58 2.465 -5.801 -0.775 1.00 10.00 C ATOM 0 H ILE A 58 4.748 -6.845 -3.778 1.00 10.00 H new ATOM 0 HA ILE A 58 2.221 -7.466 -5.154 1.00 10.00 H new ATOM 0 HB ILE A 58 1.193 -6.159 -3.234 1.00 10.00 H new ATOM 0 HG12 ILE A 58 4.009 -6.396 -2.120 1.00 10.00 H new ATOM 0 HG13 ILE A 58 3.197 -4.909 -2.568 1.00 10.00 H new ATOM 0 HG21 ILE A 58 1.396 -8.025 -1.630 1.00 10.00 H new ATOM 0 HG22 ILE A 58 1.183 -8.612 -3.297 1.00 10.00 H new ATOM 0 HG23 ILE A 58 2.793 -8.649 -2.539 1.00 10.00 H new ATOM 0 HD11 ILE A 58 3.153 -5.236 -0.146 1.00 10.00 H new ATOM 0 HD12 ILE A 58 1.504 -5.289 -0.813 1.00 10.00 H new ATOM 0 HD13 ILE A 58 2.328 -6.799 -0.358 1.00 10.00 H new ATOM 707 N ARG A 59 1.580 -4.954 -5.592 1.00 10.00 N ATOM 708 CA ARG A 59 1.401 -3.652 -6.227 1.00 10.00 C ATOM 709 C ARG A 59 0.158 -2.962 -5.675 1.00 10.00 C ATOM 710 O ARG A 59 -0.918 -3.558 -5.622 1.00 10.00 O ATOM 711 CB ARG A 59 1.267 -3.799 -7.747 1.00 10.00 C ATOM 712 CG ARG A 59 2.553 -4.205 -8.449 1.00 10.00 C ATOM 713 CD ARG A 59 3.660 -3.180 -8.246 1.00 10.00 C ATOM 714 NE ARG A 59 4.859 -3.516 -9.011 1.00 10.00 N ATOM 715 CZ ARG A 59 5.788 -4.383 -8.607 1.00 10.00 C ATOM 716 NH1 ARG A 59 5.675 -4.989 -7.430 1.00 10.00 N ATOM 717 NH2 ARG A 59 6.836 -4.634 -9.382 1.00 10.00 N ATOM 0 H ARG A 59 0.717 -5.487 -5.483 1.00 10.00 H new ATOM 0 HA ARG A 59 2.281 -3.048 -6.007 1.00 10.00 H new ATOM 0 HB2 ARG A 59 0.498 -4.541 -7.963 1.00 10.00 H new ATOM 0 HB3 ARG A 59 0.922 -2.853 -8.163 1.00 10.00 H new ATOM 0 HG2 ARG A 59 2.882 -5.174 -8.072 1.00 10.00 H new ATOM 0 HG3 ARG A 59 2.362 -4.326 -9.515 1.00 10.00 H new ATOM 0 HD2 ARG A 59 3.302 -2.195 -8.545 1.00 10.00 H new ATOM 0 HD3 ARG A 59 3.910 -3.120 -7.187 1.00 10.00 H new ATOM 0 HE ARG A 59 4.994 -3.058 -9.912 1.00 10.00 H new ATOM 0 HH11 ARG A 59 4.874 -4.792 -6.830 1.00 10.00 H new ATOM 0 HH12 ARG A 59 6.389 -5.651 -7.127 1.00 10.00 H new ATOM 0 HH21 ARG A 59 6.928 -4.164 -10.283 1.00 10.00 H new ATOM 0 HH22 ARG A 59 7.549 -5.297 -9.077 1.00 10.00 H new ATOM 731 N PHE A 60 0.309 -1.709 -5.274 1.00 10.00 N ATOM 732 CA PHE A 60 -0.804 -0.941 -4.729 1.00 10.00 C ATOM 733 C PHE A 60 -1.416 -0.046 -5.801 1.00 10.00 C ATOM 734 O PHE A 60 -0.699 0.603 -6.568 1.00 10.00 O ATOM 735 CB PHE A 60 -0.336 -0.094 -3.541 1.00 10.00 C ATOM 736 CG PHE A 60 -0.131 -0.877 -2.274 1.00 10.00 C ATOM 737 CD1 PHE A 60 0.908 -1.788 -2.160 1.00 10.00 C ATOM 738 CD2 PHE A 60 -0.974 -0.694 -1.190 1.00 10.00 C ATOM 739 CE1 PHE A 60 1.099 -2.499 -0.992 1.00 10.00 C ATOM 740 CE2 PHE A 60 -0.787 -1.403 -0.020 1.00 10.00 C ATOM 741 CZ PHE A 60 0.250 -2.306 0.079 1.00 10.00 C ATOM 0 H PHE A 60 1.192 -1.200 -5.315 1.00 10.00 H new ATOM 0 HA PHE A 60 -1.566 -1.641 -4.385 1.00 10.00 H new ATOM 0 HB2 PHE A 60 0.599 0.400 -3.806 1.00 10.00 H new ATOM 0 HB3 PHE A 60 -1.070 0.691 -3.356 1.00 10.00 H new ATOM 0 HD1 PHE A 60 1.576 -1.943 -2.995 1.00 10.00 H new ATOM 0 HD2 PHE A 60 -1.788 0.012 -1.261 1.00 10.00 H new ATOM 0 HE1 PHE A 60 1.912 -3.206 -0.916 1.00 10.00 H new ATOM 0 HE2 PHE A 60 -1.452 -1.250 0.817 1.00 10.00 H new ATOM 0 HZ PHE A 60 0.398 -2.862 0.993 1.00 10.00 H new ATOM 751 N ARG A 61 -2.740 -0.016 -5.855 1.00 10.00 N ATOM 752 CA ARG A 61 -3.451 0.792 -6.835 1.00 10.00 C ATOM 753 C ARG A 61 -4.446 1.722 -6.150 1.00 10.00 C ATOM 754 O ARG A 61 -5.225 1.297 -5.296 1.00 10.00 O ATOM 755 CB ARG A 61 -4.177 -0.116 -7.831 1.00 10.00 C ATOM 756 CG ARG A 61 -4.153 0.398 -9.263 1.00 10.00 C ATOM 757 CD ARG A 61 -4.695 -0.638 -10.235 1.00 10.00 C ATOM 758 NE ARG A 61 -4.600 -0.197 -11.626 1.00 10.00 N ATOM 759 CZ ARG A 61 -4.645 -1.014 -12.676 1.00 10.00 C ATOM 760 NH1 ARG A 61 -4.808 -2.320 -12.502 1.00 10.00 N ATOM 761 NH2 ARG A 61 -4.543 -0.526 -13.904 1.00 10.00 N ATOM 0 H ARG A 61 -3.346 -0.545 -5.228 1.00 10.00 H new ATOM 0 HA ARG A 61 -2.725 1.404 -7.371 1.00 10.00 H new ATOM 0 HB2 ARG A 61 -3.723 -1.106 -7.803 1.00 10.00 H new ATOM 0 HB3 ARG A 61 -5.213 -0.232 -7.514 1.00 10.00 H new ATOM 0 HG2 ARG A 61 -4.746 1.310 -9.333 1.00 10.00 H new ATOM 0 HG3 ARG A 61 -3.132 0.659 -9.540 1.00 10.00 H new ATOM 0 HD2 ARG A 61 -4.144 -1.570 -10.113 1.00 10.00 H new ATOM 0 HD3 ARG A 61 -5.737 -0.850 -9.994 1.00 10.00 H new ATOM 0 HE ARG A 61 -4.492 0.802 -11.803 1.00 10.00 H new ATOM 0 HH11 ARG A 61 -4.899 -2.702 -11.560 1.00 10.00 H new ATOM 0 HH12 ARG A 61 -4.842 -2.942 -13.310 1.00 10.00 H new ATOM 0 HH21 ARG A 61 -4.430 0.478 -14.046 1.00 10.00 H new ATOM 0 HH22 ARG A 61 -4.578 -1.154 -14.707 1.00 10.00 H new ATOM 775 N PHE A 62 -4.410 2.990 -6.531 1.00 10.00 N ATOM 776 CA PHE A 62 -5.302 3.995 -5.972 1.00 10.00 C ATOM 777 C PHE A 62 -6.042 4.718 -7.094 1.00 10.00 C ATOM 778 O PHE A 62 -5.417 5.320 -7.969 1.00 10.00 O ATOM 779 CB PHE A 62 -4.511 4.999 -5.122 1.00 10.00 C ATOM 780 CG PHE A 62 -5.261 6.268 -4.819 1.00 10.00 C ATOM 781 CD1 PHE A 62 -6.297 6.276 -3.902 1.00 10.00 C ATOM 782 CD2 PHE A 62 -4.927 7.453 -5.458 1.00 10.00 C ATOM 783 CE1 PHE A 62 -6.986 7.441 -3.627 1.00 10.00 C ATOM 784 CE2 PHE A 62 -5.615 8.619 -5.186 1.00 10.00 C ATOM 785 CZ PHE A 62 -6.645 8.612 -4.271 1.00 10.00 C ATOM 0 H PHE A 62 -3.764 3.350 -7.234 1.00 10.00 H new ATOM 0 HA PHE A 62 -6.031 3.499 -5.331 1.00 10.00 H new ATOM 0 HB2 PHE A 62 -4.229 4.522 -4.183 1.00 10.00 H new ATOM 0 HB3 PHE A 62 -3.586 5.251 -5.642 1.00 10.00 H new ATOM 0 HD1 PHE A 62 -6.570 5.362 -3.396 1.00 10.00 H new ATOM 0 HD2 PHE A 62 -4.120 7.464 -6.176 1.00 10.00 H new ATOM 0 HE1 PHE A 62 -7.792 7.435 -2.908 1.00 10.00 H new ATOM 0 HE2 PHE A 62 -5.346 9.535 -5.690 1.00 10.00 H new ATOM 0 HZ PHE A 62 -7.185 9.523 -4.058 1.00 10.00 H new ATOM 795 N ASP A 63 -7.372 4.626 -7.074 1.00 10.00 N ATOM 796 CA ASP A 63 -8.224 5.272 -8.078 1.00 10.00 C ATOM 797 C ASP A 63 -7.877 4.796 -9.493 1.00 10.00 C ATOM 798 O ASP A 63 -8.135 5.487 -10.480 1.00 10.00 O ATOM 799 CB ASP A 63 -8.108 6.799 -7.974 1.00 10.00 C ATOM 800 CG ASP A 63 -9.247 7.526 -8.666 1.00 10.00 C ATOM 801 OD1 ASP A 63 -10.416 7.120 -8.491 1.00 10.00 O ATOM 802 OD2 ASP A 63 -8.980 8.513 -9.387 1.00 10.00 O ATOM 0 H ASP A 63 -7.889 4.105 -6.366 1.00 10.00 H new ATOM 0 HA ASP A 63 -9.257 4.987 -7.878 1.00 10.00 H new ATOM 0 HB2 ASP A 63 -8.086 7.086 -6.923 1.00 10.00 H new ATOM 0 HB3 ASP A 63 -7.162 7.117 -8.411 1.00 10.00 H new ATOM 807 N GLY A 64 -7.290 3.608 -9.580 1.00 10.00 N ATOM 808 CA GLY A 64 -6.925 3.046 -10.866 1.00 10.00 C ATOM 809 C GLY A 64 -5.455 3.209 -11.205 1.00 10.00 C ATOM 810 O GLY A 64 -4.918 2.462 -12.020 1.00 10.00 O ATOM 0 H GLY A 64 -7.059 3.022 -8.778 1.00 10.00 H new ATOM 0 HA2 GLY A 64 -7.176 1.985 -10.874 1.00 10.00 H new ATOM 0 HA3 GLY A 64 -7.523 3.521 -11.644 1.00 10.00 H new ATOM 814 N GLN A 65 -4.788 4.160 -10.567 1.00 10.00 N ATOM 815 CA GLN A 65 -3.376 4.407 -10.841 1.00 10.00 C ATOM 816 C GLN A 65 -2.487 3.849 -9.731 1.00 10.00 C ATOM 817 O GLN A 65 -2.905 3.756 -8.580 1.00 10.00 O ATOM 818 CB GLN A 65 -3.128 5.907 -11.019 1.00 10.00 C ATOM 819 CG GLN A 65 -3.589 6.443 -12.367 1.00 10.00 C ATOM 820 CD GLN A 65 -3.117 5.580 -13.524 1.00 10.00 C ATOM 821 OE1 GLN A 65 -3.832 4.693 -13.986 1.00 10.00 O ATOM 822 NE2 GLN A 65 -1.903 5.821 -13.986 1.00 10.00 N ATOM 0 H GLN A 65 -5.197 4.771 -9.860 1.00 10.00 H new ATOM 0 HA GLN A 65 -3.117 3.891 -11.766 1.00 10.00 H new ATOM 0 HB2 GLN A 65 -3.643 6.449 -10.226 1.00 10.00 H new ATOM 0 HB3 GLN A 65 -2.063 6.107 -10.902 1.00 10.00 H new ATOM 0 HG2 GLN A 65 -4.677 6.500 -12.380 1.00 10.00 H new ATOM 0 HG3 GLN A 65 -3.215 7.459 -12.498 1.00 10.00 H new ATOM 0 HE21 GLN A 65 -1.340 6.566 -13.576 1.00 10.00 H new ATOM 0 HE22 GLN A 65 -1.529 5.262 -14.753 1.00 10.00 H new ATOM 831 N PRO A 66 -1.248 3.451 -10.074 1.00 10.00 N ATOM 832 CA PRO A 66 -0.294 2.897 -9.102 1.00 10.00 C ATOM 833 C PRO A 66 0.209 3.948 -8.111 1.00 10.00 C ATOM 834 O PRO A 66 0.232 5.144 -8.410 1.00 10.00 O ATOM 835 CB PRO A 66 0.857 2.395 -9.979 1.00 10.00 C ATOM 836 CG PRO A 66 0.778 3.217 -11.218 1.00 10.00 C ATOM 837 CD PRO A 66 -0.680 3.502 -11.435 1.00 10.00 C ATOM 0 HA PRO A 66 -0.748 2.122 -8.485 1.00 10.00 H new ATOM 0 HB2 PRO A 66 1.818 2.522 -9.481 1.00 10.00 H new ATOM 0 HB3 PRO A 66 0.751 1.333 -10.201 1.00 10.00 H new ATOM 0 HG2 PRO A 66 1.344 4.142 -11.109 1.00 10.00 H new ATOM 0 HG3 PRO A 66 1.202 2.682 -12.068 1.00 10.00 H new ATOM 0 HD2 PRO A 66 -0.834 4.477 -11.898 1.00 10.00 H new ATOM 0 HD3 PRO A 66 -1.140 2.762 -12.090 1.00 10.00 H new ATOM 845 N ILE A 67 0.615 3.492 -6.932 1.00 10.00 N ATOM 846 CA ILE A 67 1.115 4.388 -5.896 1.00 10.00 C ATOM 847 C ILE A 67 2.644 4.394 -5.869 1.00 10.00 C ATOM 848 O ILE A 67 3.285 3.356 -6.050 1.00 10.00 O ATOM 849 CB ILE A 67 0.580 3.985 -4.503 1.00 10.00 C ATOM 850 CG1 ILE A 67 -0.947 3.897 -4.527 1.00 10.00 C ATOM 851 CG2 ILE A 67 1.041 4.979 -3.441 1.00 10.00 C ATOM 852 CD1 ILE A 67 -1.560 3.551 -3.186 1.00 10.00 C ATOM 0 H ILE A 67 0.608 2.506 -6.669 1.00 10.00 H new ATOM 0 HA ILE A 67 0.758 5.390 -6.136 1.00 10.00 H new ATOM 0 HB ILE A 67 0.982 3.004 -4.249 1.00 10.00 H new ATOM 0 HG12 ILE A 67 -1.351 4.851 -4.866 1.00 10.00 H new ATOM 0 HG13 ILE A 67 -1.247 3.146 -5.258 1.00 10.00 H new ATOM 0 HG21 ILE A 67 0.654 4.677 -2.468 1.00 10.00 H new ATOM 0 HG22 ILE A 67 2.130 4.997 -3.408 1.00 10.00 H new ATOM 0 HG23 ILE A 67 0.669 5.973 -3.687 1.00 10.00 H new ATOM 0 HD11 ILE A 67 -2.645 3.507 -3.282 1.00 10.00 H new ATOM 0 HD12 ILE A 67 -1.185 2.583 -2.854 1.00 10.00 H new ATOM 0 HD13 ILE A 67 -1.292 4.314 -2.455 1.00 10.00 H new ATOM 864 N ASN A 68 3.216 5.572 -5.659 1.00 10.00 N ATOM 865 CA ASN A 68 4.662 5.728 -5.596 1.00 10.00 C ATOM 866 C ASN A 68 5.101 5.849 -4.144 1.00 10.00 C ATOM 867 O ASN A 68 4.299 6.182 -3.271 1.00 10.00 O ATOM 868 CB ASN A 68 5.110 6.972 -6.369 1.00 10.00 C ATOM 869 CG ASN A 68 4.613 6.989 -7.803 1.00 10.00 C ATOM 870 OD1 ASN A 68 5.271 6.474 -8.706 1.00 10.00 O ATOM 871 ND2 ASN A 68 3.449 7.579 -8.017 1.00 10.00 N ATOM 0 H ASN A 68 2.695 6.439 -5.529 1.00 10.00 H new ATOM 0 HA ASN A 68 5.123 4.851 -6.050 1.00 10.00 H new ATOM 0 HB2 ASN A 68 4.749 7.863 -5.854 1.00 10.00 H new ATOM 0 HB3 ASN A 68 6.199 7.022 -6.367 1.00 10.00 H new ATOM 0 HD21 ASN A 68 3.064 7.620 -8.961 1.00 10.00 H new ATOM 0 HD22 ASN A 68 2.937 7.993 -7.239 1.00 10.00 H new ATOM 878 N GLU A 69 6.373 5.589 -3.887 1.00 10.00 N ATOM 879 CA GLU A 69 6.907 5.674 -2.532 1.00 10.00 C ATOM 880 C GLU A 69 6.971 7.126 -2.061 1.00 10.00 C ATOM 881 O GLU A 69 7.024 7.400 -0.863 1.00 10.00 O ATOM 882 CB GLU A 69 8.299 5.047 -2.467 1.00 10.00 C ATOM 883 CG GLU A 69 8.290 3.529 -2.534 1.00 10.00 C ATOM 884 CD GLU A 69 9.658 2.934 -2.271 1.00 10.00 C ATOM 885 OE1 GLU A 69 10.250 2.353 -3.204 1.00 10.00 O ATOM 886 OE2 GLU A 69 10.156 3.057 -1.136 1.00 10.00 O ATOM 0 H GLU A 69 7.055 5.318 -4.595 1.00 10.00 H new ATOM 0 HA GLU A 69 6.237 5.124 -1.872 1.00 10.00 H new ATOM 0 HB2 GLU A 69 8.901 5.434 -3.289 1.00 10.00 H new ATOM 0 HB3 GLU A 69 8.785 5.358 -1.542 1.00 10.00 H new ATOM 0 HG2 GLU A 69 7.580 3.139 -1.804 1.00 10.00 H new ATOM 0 HG3 GLU A 69 7.942 3.213 -3.517 1.00 10.00 H new ATOM 893 N THR A 70 6.952 8.049 -3.008 1.00 10.00 N ATOM 894 CA THR A 70 7.017 9.466 -2.701 1.00 10.00 C ATOM 895 C THR A 70 5.624 10.088 -2.584 1.00 10.00 C ATOM 896 O THR A 70 5.489 11.301 -2.424 1.00 10.00 O ATOM 897 CB THR A 70 7.807 10.193 -3.796 1.00 10.00 C ATOM 898 OG1 THR A 70 7.916 9.336 -4.944 1.00 10.00 O ATOM 899 CG2 THR A 70 9.196 10.567 -3.303 1.00 10.00 C ATOM 0 H THR A 70 6.892 7.838 -4.004 1.00 10.00 H new ATOM 0 HA THR A 70 7.516 9.575 -1.738 1.00 10.00 H new ATOM 0 HB THR A 70 7.280 11.109 -4.062 1.00 10.00 H new ATOM 0 HG1 THR A 70 8.419 9.796 -5.649 1.00 10.00 H new ATOM 0 HG21 THR A 70 9.738 11.081 -4.097 1.00 10.00 H new ATOM 0 HG22 THR A 70 9.110 11.224 -2.437 1.00 10.00 H new ATOM 0 HG23 THR A 70 9.737 9.664 -3.021 1.00 10.00 H new ATOM 907 N ASP A 71 4.592 9.256 -2.650 1.00 10.00 N ATOM 908 CA ASP A 71 3.222 9.745 -2.564 1.00 10.00 C ATOM 909 C ASP A 71 2.767 9.859 -1.111 1.00 10.00 C ATOM 910 O ASP A 71 3.261 9.156 -0.226 1.00 10.00 O ATOM 911 CB ASP A 71 2.260 8.836 -3.341 1.00 10.00 C ATOM 912 CG ASP A 71 2.298 9.069 -4.843 1.00 10.00 C ATOM 913 OD1 ASP A 71 2.464 10.232 -5.275 1.00 10.00 O ATOM 914 OD2 ASP A 71 2.156 8.087 -5.603 1.00 10.00 O ATOM 0 H ASP A 71 4.677 8.246 -2.762 1.00 10.00 H new ATOM 0 HA ASP A 71 3.204 10.738 -3.014 1.00 10.00 H new ATOM 0 HB2 ASP A 71 2.508 7.795 -3.135 1.00 10.00 H new ATOM 0 HB3 ASP A 71 1.245 8.999 -2.980 1.00 10.00 H new ATOM 919 N THR A 72 1.827 10.762 -0.879 1.00 10.00 N ATOM 920 CA THR A 72 1.279 11.000 0.450 1.00 10.00 C ATOM 921 C THR A 72 -0.242 11.158 0.355 1.00 10.00 C ATOM 922 O THR A 72 -0.750 11.549 -0.696 1.00 10.00 O ATOM 923 CB THR A 72 1.897 12.270 1.073 1.00 10.00 C ATOM 924 OG1 THR A 72 2.818 12.869 0.149 1.00 10.00 O ATOM 925 CG2 THR A 72 2.624 11.952 2.370 1.00 10.00 C ATOM 0 H THR A 72 1.421 11.351 -1.606 1.00 10.00 H new ATOM 0 HA THR A 72 1.520 10.149 1.087 1.00 10.00 H new ATOM 0 HB THR A 72 1.085 12.964 1.292 1.00 10.00 H new ATOM 0 HG1 THR A 72 3.205 13.675 0.549 1.00 10.00 H new ATOM 0 HG21 THR A 72 3.048 12.867 2.783 1.00 10.00 H new ATOM 0 HG22 THR A 72 1.922 11.522 3.085 1.00 10.00 H new ATOM 0 HG23 THR A 72 3.424 11.238 2.173 1.00 10.00 H new ATOM 933 N PRO A 73 -0.996 10.856 1.432 1.00 10.00 N ATOM 934 CA PRO A 73 -2.462 10.980 1.429 1.00 10.00 C ATOM 935 C PRO A 73 -2.926 12.378 1.029 1.00 10.00 C ATOM 936 O PRO A 73 -3.861 12.533 0.242 1.00 10.00 O ATOM 937 CB PRO A 73 -2.853 10.680 2.878 1.00 10.00 C ATOM 938 CG PRO A 73 -1.733 9.859 3.411 1.00 10.00 C ATOM 939 CD PRO A 73 -0.493 10.355 2.724 1.00 10.00 C ATOM 0 HA PRO A 73 -2.923 10.309 0.704 1.00 10.00 H new ATOM 0 HB2 PRO A 73 -2.979 11.598 3.452 1.00 10.00 H new ATOM 0 HB3 PRO A 73 -3.799 10.140 2.929 1.00 10.00 H new ATOM 0 HG2 PRO A 73 -1.650 9.968 4.492 1.00 10.00 H new ATOM 0 HG3 PRO A 73 -1.894 8.800 3.208 1.00 10.00 H new ATOM 0 HD2 PRO A 73 -0.004 11.142 3.297 1.00 10.00 H new ATOM 0 HD3 PRO A 73 0.238 9.558 2.589 1.00 10.00 H new ATOM 947 N ALA A 74 -2.258 13.396 1.562 1.00 10.00 N ATOM 948 CA ALA A 74 -2.601 14.780 1.252 1.00 10.00 C ATOM 949 C ALA A 74 -2.137 15.155 -0.151 1.00 10.00 C ATOM 950 O ALA A 74 -2.691 16.053 -0.783 1.00 10.00 O ATOM 951 CB ALA A 74 -1.986 15.722 2.275 1.00 10.00 C ATOM 0 H ALA A 74 -1.477 13.289 2.210 1.00 10.00 H new ATOM 0 HA ALA A 74 -3.686 14.875 1.292 1.00 10.00 H new ATOM 0 HB1 ALA A 74 -2.252 16.750 2.029 1.00 10.00 H new ATOM 0 HB2 ALA A 74 -2.363 15.477 3.268 1.00 10.00 H new ATOM 0 HB3 ALA A 74 -0.901 15.615 2.263 1.00 10.00 H new ATOM 957 N GLN A 75 -1.123 14.451 -0.638 1.00 10.00 N ATOM 958 CA GLN A 75 -0.575 14.710 -1.964 1.00 10.00 C ATOM 959 C GLN A 75 -1.497 14.154 -3.047 1.00 10.00 C ATOM 960 O GLN A 75 -1.679 14.767 -4.093 1.00 10.00 O ATOM 961 CB GLN A 75 0.818 14.089 -2.093 1.00 10.00 C ATOM 962 CG GLN A 75 1.642 14.653 -3.240 1.00 10.00 C ATOM 963 CD GLN A 75 1.921 16.134 -3.080 1.00 10.00 C ATOM 964 OE1 GLN A 75 2.869 16.527 -2.399 1.00 10.00 O ATOM 965 NE2 GLN A 75 1.111 16.964 -3.717 1.00 10.00 N ATOM 0 H GLN A 75 -0.662 13.694 -0.133 1.00 10.00 H new ATOM 0 HA GLN A 75 -0.496 15.789 -2.096 1.00 10.00 H new ATOM 0 HB2 GLN A 75 1.360 14.241 -1.160 1.00 10.00 H new ATOM 0 HB3 GLN A 75 0.714 13.013 -2.229 1.00 10.00 H new ATOM 0 HG2 GLN A 75 2.587 14.113 -3.304 1.00 10.00 H new ATOM 0 HG3 GLN A 75 1.115 14.485 -4.179 1.00 10.00 H new ATOM 0 HE21 GLN A 75 0.337 16.597 -4.271 1.00 10.00 H new ATOM 0 HE22 GLN A 75 1.261 17.971 -3.654 1.00 10.00 H new ATOM 974 N LEU A 76 -2.079 12.992 -2.785 1.00 10.00 N ATOM 975 CA LEU A 76 -2.990 12.362 -3.734 1.00 10.00 C ATOM 976 C LEU A 76 -4.423 12.824 -3.484 1.00 10.00 C ATOM 977 O LEU A 76 -5.360 12.351 -4.131 1.00 10.00 O ATOM 978 CB LEU A 76 -2.901 10.837 -3.629 1.00 10.00 C ATOM 979 CG LEU A 76 -1.613 10.215 -4.175 1.00 10.00 C ATOM 980 CD1 LEU A 76 -1.607 8.712 -3.930 1.00 10.00 C ATOM 981 CD2 LEU A 76 -1.462 10.512 -5.661 1.00 10.00 C ATOM 0 H LEU A 76 -1.937 12.465 -1.923 1.00 10.00 H new ATOM 0 HA LEU A 76 -2.698 12.660 -4.741 1.00 10.00 H new ATOM 0 HB2 LEU A 76 -3.005 10.555 -2.581 1.00 10.00 H new ATOM 0 HB3 LEU A 76 -3.748 10.403 -4.161 1.00 10.00 H new ATOM 0 HG LEU A 76 -0.767 10.657 -3.650 1.00 10.00 H new ATOM 0 HD11 LEU A 76 -0.685 8.283 -4.323 1.00 10.00 H new ATOM 0 HD12 LEU A 76 -1.670 8.518 -2.859 1.00 10.00 H new ATOM 0 HD13 LEU A 76 -2.462 8.258 -4.432 1.00 10.00 H new ATOM 0 HD21 LEU A 76 -0.541 10.062 -6.030 1.00 10.00 H new ATOM 0 HD22 LEU A 76 -2.312 10.097 -6.203 1.00 10.00 H new ATOM 0 HD23 LEU A 76 -1.426 11.591 -5.815 1.00 10.00 H new ATOM 993 N GLU A 77 -4.572 13.751 -2.535 1.00 10.00 N ATOM 994 CA GLU A 77 -5.872 14.307 -2.169 1.00 10.00 C ATOM 995 C GLU A 77 -6.859 13.203 -1.796 1.00 10.00 C ATOM 996 O GLU A 77 -8.008 13.198 -2.240 1.00 10.00 O ATOM 997 CB GLU A 77 -6.416 15.167 -3.310 1.00 10.00 C ATOM 998 CG GLU A 77 -5.580 16.408 -3.573 1.00 10.00 C ATOM 999 CD GLU A 77 -5.952 17.100 -4.864 1.00 10.00 C ATOM 1000 OE1 GLU A 77 -7.101 17.576 -4.980 1.00 10.00 O ATOM 1001 OE2 GLU A 77 -5.096 17.185 -5.768 1.00 10.00 O ATOM 0 H GLU A 77 -3.793 14.136 -2.000 1.00 10.00 H new ATOM 0 HA GLU A 77 -5.741 14.939 -1.290 1.00 10.00 H new ATOM 0 HB2 GLU A 77 -6.461 14.567 -4.219 1.00 10.00 H new ATOM 0 HB3 GLU A 77 -7.437 15.467 -3.075 1.00 10.00 H new ATOM 0 HG2 GLU A 77 -5.702 17.105 -2.744 1.00 10.00 H new ATOM 0 HG3 GLU A 77 -4.526 16.131 -3.605 1.00 10.00 H new ATOM 1008 N MET A 78 -6.398 12.281 -0.964 1.00 10.00 N ATOM 1009 CA MET A 78 -7.216 11.162 -0.522 1.00 10.00 C ATOM 1010 C MET A 78 -8.106 11.584 0.640 1.00 10.00 C ATOM 1011 O MET A 78 -7.705 12.406 1.472 1.00 10.00 O ATOM 1012 CB MET A 78 -6.329 9.990 -0.099 1.00 10.00 C ATOM 1013 CG MET A 78 -5.302 9.604 -1.149 1.00 10.00 C ATOM 1014 SD MET A 78 -4.021 8.512 -0.508 1.00 10.00 S ATOM 1015 CE MET A 78 -4.916 6.965 -0.391 1.00 10.00 C ATOM 0 H MET A 78 -5.454 12.287 -0.579 1.00 10.00 H new ATOM 0 HA MET A 78 -7.846 10.846 -1.353 1.00 10.00 H new ATOM 0 HB2 MET A 78 -5.813 10.249 0.826 1.00 10.00 H new ATOM 0 HB3 MET A 78 -6.958 9.127 0.118 1.00 10.00 H new ATOM 0 HG2 MET A 78 -5.807 9.114 -1.981 1.00 10.00 H new ATOM 0 HG3 MET A 78 -4.838 10.507 -1.545 1.00 10.00 H new ATOM 0 HE1 MET A 78 -4.372 6.278 0.257 1.00 10.00 H new ATOM 0 HE2 MET A 78 -5.907 7.148 0.025 1.00 10.00 H new ATOM 0 HE3 MET A 78 -5.015 6.526 -1.384 1.00 10.00 H new ATOM 1025 N GLU A 79 -9.301 11.017 0.696 1.00 10.00 N ATOM 1026 CA GLU A 79 -10.255 11.333 1.748 1.00 10.00 C ATOM 1027 C GLU A 79 -10.456 10.141 2.675 1.00 10.00 C ATOM 1028 O GLU A 79 -9.948 9.049 2.417 1.00 10.00 O ATOM 1029 CB GLU A 79 -11.594 11.745 1.134 1.00 10.00 C ATOM 1030 CG GLU A 79 -11.717 13.239 0.893 1.00 10.00 C ATOM 1031 CD GLU A 79 -12.009 14.007 2.164 1.00 10.00 C ATOM 1032 OE1 GLU A 79 -13.194 14.081 2.559 1.00 10.00 O ATOM 1033 OE2 GLU A 79 -11.064 14.542 2.776 1.00 10.00 O ATOM 0 H GLU A 79 -9.635 10.330 0.020 1.00 10.00 H new ATOM 0 HA GLU A 79 -9.856 12.161 2.333 1.00 10.00 H new ATOM 0 HB2 GLU A 79 -11.727 11.220 0.188 1.00 10.00 H new ATOM 0 HB3 GLU A 79 -12.401 11.424 1.793 1.00 10.00 H new ATOM 0 HG2 GLU A 79 -10.792 13.610 0.452 1.00 10.00 H new ATOM 0 HG3 GLU A 79 -12.511 13.423 0.170 1.00 10.00 H new ATOM 1040 N ASP A 80 -11.187 10.360 3.761 1.00 10.00 N ATOM 1041 CA ASP A 80 -11.461 9.300 4.719 1.00 10.00 C ATOM 1042 C ASP A 80 -12.373 8.257 4.090 1.00 10.00 C ATOM 1043 O ASP A 80 -13.299 8.606 3.354 1.00 10.00 O ATOM 1044 CB ASP A 80 -12.109 9.873 5.982 1.00 10.00 C ATOM 1045 CG ASP A 80 -12.298 8.834 7.072 1.00 10.00 C ATOM 1046 OD1 ASP A 80 -13.429 8.318 7.227 1.00 10.00 O ATOM 1047 OD2 ASP A 80 -11.324 8.540 7.792 1.00 10.00 O ATOM 0 H ASP A 80 -11.600 11.262 3.999 1.00 10.00 H new ATOM 0 HA ASP A 80 -10.519 8.828 4.998 1.00 10.00 H new ATOM 0 HB2 ASP A 80 -11.491 10.685 6.365 1.00 10.00 H new ATOM 0 HB3 ASP A 80 -13.077 10.303 5.725 1.00 10.00 H new ATOM 1052 N GLU A 81 -12.087 6.989 4.371 1.00 10.00 N ATOM 1053 CA GLU A 81 -12.855 5.856 3.853 1.00 10.00 C ATOM 1054 C GLU A 81 -12.512 5.560 2.396 1.00 10.00 C ATOM 1055 O GLU A 81 -13.311 4.955 1.674 1.00 10.00 O ATOM 1056 CB GLU A 81 -14.366 6.067 4.001 1.00 10.00 C ATOM 1057 CG GLU A 81 -14.876 5.822 5.408 1.00 10.00 C ATOM 1058 CD GLU A 81 -16.350 5.490 5.446 1.00 10.00 C ATOM 1059 OE1 GLU A 81 -17.110 6.228 6.106 1.00 10.00 O ATOM 1060 OE2 GLU A 81 -16.753 4.493 4.808 1.00 10.00 O ATOM 0 H GLU A 81 -11.309 6.714 4.970 1.00 10.00 H new ATOM 0 HA GLU A 81 -12.572 4.995 4.458 1.00 10.00 H new ATOM 0 HB2 GLU A 81 -14.613 7.087 3.706 1.00 10.00 H new ATOM 0 HB3 GLU A 81 -14.887 5.401 3.313 1.00 10.00 H new ATOM 0 HG2 GLU A 81 -14.312 5.004 5.857 1.00 10.00 H new ATOM 0 HG3 GLU A 81 -14.692 6.708 6.016 1.00 10.00 H new ATOM 1067 N ASP A 82 -11.323 5.976 1.967 1.00 10.00 N ATOM 1068 CA ASP A 82 -10.881 5.720 0.599 1.00 10.00 C ATOM 1069 C ASP A 82 -10.500 4.251 0.454 1.00 10.00 C ATOM 1070 O ASP A 82 -10.291 3.567 1.457 1.00 10.00 O ATOM 1071 CB ASP A 82 -9.696 6.612 0.226 1.00 10.00 C ATOM 1072 CG ASP A 82 -9.728 7.017 -1.235 1.00 10.00 C ATOM 1073 OD1 ASP A 82 -9.466 6.159 -2.100 1.00 10.00 O ATOM 1074 OD2 ASP A 82 -10.035 8.193 -1.523 1.00 10.00 O ATOM 0 H ASP A 82 -10.653 6.488 2.541 1.00 10.00 H new ATOM 0 HA ASP A 82 -11.701 5.953 -0.080 1.00 10.00 H new ATOM 0 HB2 ASP A 82 -9.704 7.506 0.850 1.00 10.00 H new ATOM 0 HB3 ASP A 82 -8.765 6.085 0.436 1.00 10.00 H new ATOM 1079 N THR A 83 -10.386 3.767 -0.773 1.00 10.00 N ATOM 1080 CA THR A 83 -10.060 2.365 -0.998 1.00 10.00 C ATOM 1081 C THR A 83 -8.760 2.190 -1.781 1.00 10.00 C ATOM 1082 O THR A 83 -8.549 2.826 -2.813 1.00 10.00 O ATOM 1083 CB THR A 83 -11.192 1.645 -1.753 1.00 10.00 C ATOM 1084 OG1 THR A 83 -12.461 2.192 -1.371 1.00 10.00 O ATOM 1085 CG2 THR A 83 -11.169 0.151 -1.463 1.00 10.00 C ATOM 0 H THR A 83 -10.513 4.317 -1.622 1.00 10.00 H new ATOM 0 HA THR A 83 -9.934 1.922 -0.010 1.00 10.00 H new ATOM 0 HB THR A 83 -11.040 1.794 -2.822 1.00 10.00 H new ATOM 0 HG1 THR A 83 -13.176 1.730 -1.857 1.00 10.00 H new ATOM 0 HG21 THR A 83 -11.977 -0.338 -2.007 1.00 10.00 H new ATOM 0 HG22 THR A 83 -10.214 -0.267 -1.781 1.00 10.00 H new ATOM 0 HG23 THR A 83 -11.299 -0.014 -0.394 1.00 10.00 H new ATOM 1093 N ILE A 84 -7.894 1.325 -1.276 1.00 10.00 N ATOM 1094 CA ILE A 84 -6.627 1.031 -1.926 1.00 10.00 C ATOM 1095 C ILE A 84 -6.596 -0.442 -2.314 1.00 10.00 C ATOM 1096 O ILE A 84 -6.809 -1.315 -1.470 1.00 10.00 O ATOM 1097 CB ILE A 84 -5.423 1.346 -1.011 1.00 10.00 C ATOM 1098 CG1 ILE A 84 -5.536 2.762 -0.435 1.00 10.00 C ATOM 1099 CG2 ILE A 84 -4.120 1.186 -1.785 1.00 10.00 C ATOM 1100 CD1 ILE A 84 -4.458 3.093 0.576 1.00 10.00 C ATOM 0 H ILE A 84 -8.048 0.810 -0.409 1.00 10.00 H new ATOM 0 HA ILE A 84 -6.546 1.663 -2.810 1.00 10.00 H new ATOM 0 HB ILE A 84 -5.425 0.641 -0.180 1.00 10.00 H new ATOM 0 HG12 ILE A 84 -5.490 3.482 -1.252 1.00 10.00 H new ATOM 0 HG13 ILE A 84 -6.512 2.877 0.036 1.00 10.00 H new ATOM 0 HG21 ILE A 84 -3.278 1.411 -1.130 1.00 10.00 H new ATOM 0 HG22 ILE A 84 -4.035 0.161 -2.147 1.00 10.00 H new ATOM 0 HG23 ILE A 84 -4.114 1.872 -2.632 1.00 10.00 H new ATOM 0 HD11 ILE A 84 -4.601 4.110 0.941 1.00 10.00 H new ATOM 0 HD12 ILE A 84 -4.517 2.396 1.412 1.00 10.00 H new ATOM 0 HD13 ILE A 84 -3.479 3.011 0.104 1.00 10.00 H new ATOM 1112 N ASP A 85 -6.351 -0.712 -3.585 1.00 10.00 N ATOM 1113 CA ASP A 85 -6.313 -2.082 -4.080 1.00 10.00 C ATOM 1114 C ASP A 85 -4.893 -2.624 -4.053 1.00 10.00 C ATOM 1115 O ASP A 85 -3.933 -1.878 -4.257 1.00 10.00 O ATOM 1116 CB ASP A 85 -6.860 -2.155 -5.507 1.00 10.00 C ATOM 1117 CG ASP A 85 -7.832 -3.301 -5.693 1.00 10.00 C ATOM 1118 OD1 ASP A 85 -7.455 -4.459 -5.423 1.00 10.00 O ATOM 1119 OD2 ASP A 85 -8.982 -3.043 -6.111 1.00 10.00 O ATOM 0 H ASP A 85 -6.175 -0.001 -4.295 1.00 10.00 H new ATOM 0 HA ASP A 85 -6.938 -2.691 -3.427 1.00 10.00 H new ATOM 0 HB2 ASP A 85 -7.358 -1.216 -5.751 1.00 10.00 H new ATOM 0 HB3 ASP A 85 -6.031 -2.268 -6.206 1.00 10.00 H new ATOM 1124 N VAL A 86 -4.762 -3.918 -3.800 1.00 10.00 N ATOM 1125 CA VAL A 86 -3.457 -4.564 -3.743 1.00 10.00 C ATOM 1126 C VAL A 86 -3.429 -5.795 -4.641 1.00 10.00 C ATOM 1127 O VAL A 86 -4.124 -6.781 -4.387 1.00 10.00 O ATOM 1128 CB VAL A 86 -3.083 -4.984 -2.303 1.00 10.00 C ATOM 1129 CG1 VAL A 86 -1.651 -5.497 -2.248 1.00 10.00 C ATOM 1130 CG2 VAL A 86 -3.272 -3.825 -1.337 1.00 10.00 C ATOM 0 H VAL A 86 -5.548 -4.545 -3.630 1.00 10.00 H new ATOM 0 HA VAL A 86 -2.727 -3.833 -4.091 1.00 10.00 H new ATOM 0 HB VAL A 86 -3.749 -5.792 -2.001 1.00 10.00 H new ATOM 0 HG11 VAL A 86 -1.408 -5.787 -1.226 1.00 10.00 H new ATOM 0 HG12 VAL A 86 -1.548 -6.361 -2.905 1.00 10.00 H new ATOM 0 HG13 VAL A 86 -0.970 -4.711 -2.574 1.00 10.00 H new ATOM 0 HG21 VAL A 86 -3.003 -4.143 -0.330 1.00 10.00 H new ATOM 0 HG22 VAL A 86 -2.634 -2.993 -1.637 1.00 10.00 H new ATOM 0 HG23 VAL A 86 -4.314 -3.506 -1.351 1.00 10.00 H new ATOM 1140 N PHE A 87 -2.631 -5.729 -5.693 1.00 10.00 N ATOM 1141 CA PHE A 87 -2.503 -6.833 -6.633 1.00 10.00 C ATOM 1142 C PHE A 87 -1.139 -7.493 -6.480 1.00 10.00 C ATOM 1143 O PHE A 87 -0.265 -6.962 -5.793 1.00 10.00 O ATOM 1144 CB PHE A 87 -2.688 -6.339 -8.070 1.00 10.00 C ATOM 1145 CG PHE A 87 -4.061 -5.792 -8.349 1.00 10.00 C ATOM 1146 CD1 PHE A 87 -5.108 -6.640 -8.677 1.00 10.00 C ATOM 1147 CD2 PHE A 87 -4.302 -4.429 -8.282 1.00 10.00 C ATOM 1148 CE1 PHE A 87 -6.370 -6.136 -8.934 1.00 10.00 C ATOM 1149 CE2 PHE A 87 -5.561 -3.920 -8.538 1.00 10.00 C ATOM 1150 CZ PHE A 87 -6.596 -4.775 -8.863 1.00 10.00 C ATOM 0 H PHE A 87 -2.057 -4.917 -5.920 1.00 10.00 H new ATOM 0 HA PHE A 87 -3.280 -7.566 -6.415 1.00 10.00 H new ATOM 0 HB2 PHE A 87 -1.949 -5.565 -8.277 1.00 10.00 H new ATOM 0 HB3 PHE A 87 -2.488 -7.162 -8.756 1.00 10.00 H new ATOM 0 HD1 PHE A 87 -4.936 -7.705 -8.732 1.00 10.00 H new ATOM 0 HD2 PHE A 87 -3.496 -3.757 -8.027 1.00 10.00 H new ATOM 0 HE1 PHE A 87 -7.178 -6.806 -9.190 1.00 10.00 H new ATOM 0 HE2 PHE A 87 -5.735 -2.856 -8.484 1.00 10.00 H new ATOM 0 HZ PHE A 87 -7.581 -4.380 -9.061 1.00 10.00 H new ATOM 1160 N GLN A 88 -0.959 -8.642 -7.111 1.00 10.00 N ATOM 1161 CA GLN A 88 0.306 -9.355 -7.041 1.00 10.00 C ATOM 1162 C GLN A 88 1.015 -9.312 -8.387 1.00 10.00 C ATOM 1163 O GLN A 88 0.371 -9.287 -9.438 1.00 10.00 O ATOM 1164 CB GLN A 88 0.080 -10.806 -6.615 1.00 10.00 C ATOM 1165 CG GLN A 88 -0.337 -10.961 -5.159 1.00 10.00 C ATOM 1166 CD GLN A 88 0.609 -11.850 -4.376 1.00 10.00 C ATOM 1167 OE1 GLN A 88 1.801 -11.922 -4.671 1.00 10.00 O ATOM 1168 NE2 GLN A 88 0.086 -12.538 -3.373 1.00 10.00 N ATOM 0 H GLN A 88 -1.673 -9.101 -7.677 1.00 10.00 H new ATOM 0 HA GLN A 88 0.934 -8.865 -6.297 1.00 10.00 H new ATOM 0 HB2 GLN A 88 -0.687 -11.247 -7.252 1.00 10.00 H new ATOM 0 HB3 GLN A 88 0.997 -11.371 -6.783 1.00 10.00 H new ATOM 0 HG2 GLN A 88 -0.379 -9.978 -4.690 1.00 10.00 H new ATOM 0 HG3 GLN A 88 -1.343 -11.378 -5.115 1.00 10.00 H new ATOM 0 HE21 GLN A 88 -0.908 -12.452 -3.159 1.00 10.00 H new ATOM 0 HE22 GLN A 88 0.677 -13.154 -2.814 1.00 10.00 H new ATOM 1177 N GLN A 89 2.338 -9.290 -8.348 1.00 10.00 N ATOM 1178 CA GLN A 89 3.138 -9.252 -9.560 1.00 10.00 C ATOM 1179 C GLN A 89 3.173 -10.631 -10.209 1.00 10.00 C ATOM 1180 O GLN A 89 2.977 -11.648 -9.538 1.00 10.00 O ATOM 1181 CB GLN A 89 4.559 -8.779 -9.242 1.00 10.00 C ATOM 1182 CG GLN A 89 5.326 -8.282 -10.458 1.00 10.00 C ATOM 1183 CD GLN A 89 4.652 -7.104 -11.136 1.00 10.00 C ATOM 1184 OE1 GLN A 89 3.968 -6.310 -10.496 1.00 10.00 O ATOM 1185 NE2 GLN A 89 4.837 -6.985 -12.439 1.00 10.00 N ATOM 0 H GLN A 89 2.882 -9.298 -7.485 1.00 10.00 H new ATOM 0 HA GLN A 89 2.685 -8.548 -10.258 1.00 10.00 H new ATOM 0 HB2 GLN A 89 4.509 -7.979 -8.503 1.00 10.00 H new ATOM 0 HB3 GLN A 89 5.112 -9.600 -8.786 1.00 10.00 H new ATOM 0 HG2 GLN A 89 6.332 -7.994 -10.154 1.00 10.00 H new ATOM 0 HG3 GLN A 89 5.430 -9.097 -11.174 1.00 10.00 H new ATOM 0 HE21 GLN A 89 5.412 -7.665 -12.937 1.00 10.00 H new ATOM 0 HE22 GLN A 89 4.405 -6.213 -12.947 1.00 10.00 H new ATOM 1194 N GLN A 90 3.410 -10.659 -11.512 1.00 10.00 N ATOM 1195 CA GLN A 90 3.473 -11.908 -12.260 1.00 10.00 C ATOM 1196 C GLN A 90 4.656 -12.749 -11.801 1.00 10.00 C ATOM 1197 O GLN A 90 5.694 -12.216 -11.406 1.00 10.00 O ATOM 1198 CB GLN A 90 3.586 -11.626 -13.761 1.00 10.00 C ATOM 1199 CG GLN A 90 2.293 -11.133 -14.397 1.00 10.00 C ATOM 1200 CD GLN A 90 1.922 -9.723 -13.977 1.00 10.00 C ATOM 1201 OE1 GLN A 90 2.788 -8.897 -13.688 1.00 10.00 O ATOM 1202 NE2 GLN A 90 0.632 -9.439 -13.945 1.00 10.00 N ATOM 0 H GLN A 90 3.563 -9.824 -12.078 1.00 10.00 H new ATOM 0 HA GLN A 90 2.554 -12.464 -12.072 1.00 10.00 H new ATOM 0 HB2 GLN A 90 4.366 -10.882 -13.923 1.00 10.00 H new ATOM 0 HB3 GLN A 90 3.905 -12.537 -14.269 1.00 10.00 H new ATOM 0 HG2 GLN A 90 2.393 -11.168 -15.482 1.00 10.00 H new ATOM 0 HG3 GLN A 90 1.482 -11.811 -14.129 1.00 10.00 H new ATOM 0 HE21 GLN A 90 -0.054 -10.153 -14.192 1.00 10.00 H new ATOM 0 HE22 GLN A 90 0.322 -8.506 -13.673 1.00 10.00 H new ATOM 1211 N THR A 91 4.490 -14.061 -11.851 1.00 10.00 N ATOM 1212 CA THR A 91 5.536 -14.981 -11.437 1.00 10.00 C ATOM 1213 C THR A 91 6.462 -15.334 -12.598 1.00 10.00 C ATOM 1214 O THR A 91 7.529 -15.915 -12.400 1.00 10.00 O ATOM 1215 CB THR A 91 4.924 -16.269 -10.861 1.00 10.00 C ATOM 1216 OG1 THR A 91 3.505 -16.103 -10.705 1.00 10.00 O ATOM 1217 CG2 THR A 91 5.550 -16.609 -9.517 1.00 10.00 C ATOM 0 H THR A 91 3.636 -14.514 -12.176 1.00 10.00 H new ATOM 0 HA THR A 91 6.123 -14.481 -10.667 1.00 10.00 H new ATOM 0 HB THR A 91 5.123 -17.087 -11.553 1.00 10.00 H new ATOM 0 HG1 THR A 91 3.057 -16.308 -11.552 1.00 10.00 H new ATOM 0 HG21 THR A 91 5.102 -17.523 -9.128 1.00 10.00 H new ATOM 0 HG22 THR A 91 6.623 -16.755 -9.642 1.00 10.00 H new ATOM 0 HG23 THR A 91 5.374 -15.793 -8.817 1.00 10.00 H new ATOM 1225 N GLY A 92 6.049 -14.977 -13.808 1.00 10.00 N ATOM 1226 CA GLY A 92 6.848 -15.258 -14.978 1.00 10.00 C ATOM 1227 C GLY A 92 6.056 -15.091 -16.254 1.00 10.00 C ATOM 1228 O GLY A 92 4.919 -14.577 -16.184 1.00 10.00 O ATOM 0 H GLY A 92 5.170 -14.496 -13.997 1.00 10.00 H new ATOM 0 HA2 GLY A 92 7.711 -14.593 -14.997 1.00 10.00 H new ATOM 0 HA3 GLY A 92 7.232 -16.276 -14.920 1.00 10.00 H new TER 1232 GLY A 92 ATOM 1233 N ASN B 357 -13.300 -11.954 5.819 1.00 10.00 N ATOM 1234 CA ASN B 357 -13.179 -10.479 5.895 1.00 10.00 C ATOM 1235 C ASN B 357 -12.702 -10.053 7.276 1.00 10.00 C ATOM 1236 O ASN B 357 -13.467 -10.069 8.237 1.00 10.00 O ATOM 1237 CB ASN B 357 -14.518 -9.803 5.564 1.00 10.00 C ATOM 1238 CG ASN B 357 -15.714 -10.563 6.101 1.00 10.00 C ATOM 1239 OD1 ASN B 357 -16.240 -11.455 5.438 1.00 10.00 O ATOM 1240 ND2 ASN B 357 -16.143 -10.221 7.305 1.00 10.00 N ATOM 0 HA ASN B 357 -12.442 -10.162 5.157 1.00 10.00 H new ATOM 0 HB2 ASN B 357 -14.521 -8.794 5.976 1.00 10.00 H new ATOM 0 HB3 ASN B 357 -14.612 -9.706 4.482 1.00 10.00 H new ATOM 0 HD21 ASN B 357 -16.941 -10.704 7.718 1.00 10.00 H new ATOM 0 HD22 ASN B 357 -15.676 -9.474 7.820 1.00 10.00 H new ATOM 1247 N ASN B 358 -11.448 -9.646 7.365 1.00 10.00 N ATOM 1248 CA ASN B 358 -10.871 -9.236 8.639 1.00 10.00 C ATOM 1249 C ASN B 358 -10.437 -7.787 8.588 1.00 10.00 C ATOM 1250 O ASN B 358 -9.811 -7.362 7.623 1.00 10.00 O ATOM 1251 CB ASN B 358 -9.678 -10.134 9.010 1.00 10.00 C ATOM 1252 CG ASN B 358 -8.490 -9.970 8.069 1.00 10.00 C ATOM 1253 OD1 ASN B 358 -8.397 -10.648 7.044 1.00 10.00 O ATOM 1254 ND2 ASN B 358 -7.574 -9.071 8.404 1.00 10.00 N ATOM 0 H ASN B 358 -10.808 -9.590 6.573 1.00 10.00 H new ATOM 0 HA ASN B 358 -11.638 -9.342 9.406 1.00 10.00 H new ATOM 0 HB2 ASN B 358 -9.362 -9.906 10.028 1.00 10.00 H new ATOM 0 HB3 ASN B 358 -9.999 -11.176 9.002 1.00 10.00 H new ATOM 0 HD21 ASN B 358 -6.761 -8.924 7.806 1.00 10.00 H new ATOM 0 HD22 ASN B 358 -7.683 -8.527 9.260 1.00 10.00 H new ATOM 1261 N ARG B 359 -10.811 -7.022 9.606 1.00 10.00 N ATOM 1262 CA ARG B 359 -10.431 -5.621 9.658 1.00 10.00 C ATOM 1263 C ARG B 359 -9.605 -5.329 10.903 1.00 10.00 C ATOM 1264 O ARG B 359 -10.048 -5.545 12.032 1.00 10.00 O ATOM 1265 CB ARG B 359 -11.688 -4.738 9.650 1.00 10.00 C ATOM 1266 CG ARG B 359 -12.959 -5.501 9.315 1.00 10.00 C ATOM 1267 CD ARG B 359 -14.133 -4.569 9.088 1.00 10.00 C ATOM 1268 NE ARG B 359 -14.070 -3.929 7.774 1.00 10.00 N ATOM 1269 CZ ARG B 359 -14.168 -2.621 7.579 1.00 10.00 C ATOM 1270 NH1 ARG B 359 -14.329 -1.798 8.607 1.00 10.00 N ATOM 1271 NH2 ARG B 359 -14.096 -2.131 6.347 1.00 10.00 N ATOM 0 H ARG B 359 -11.370 -7.345 10.396 1.00 10.00 H new ATOM 0 HA ARG B 359 -9.824 -5.397 8.781 1.00 10.00 H new ATOM 0 HB2 ARG B 359 -11.801 -4.270 10.628 1.00 10.00 H new ATOM 0 HB3 ARG B 359 -11.554 -3.934 8.926 1.00 10.00 H new ATOM 0 HG2 ARG B 359 -12.796 -6.104 8.422 1.00 10.00 H new ATOM 0 HG3 ARG B 359 -13.194 -6.190 10.126 1.00 10.00 H new ATOM 0 HD2 ARG B 359 -15.064 -5.129 9.176 1.00 10.00 H new ATOM 0 HD3 ARG B 359 -14.146 -3.804 9.865 1.00 10.00 H new ATOM 0 HE ARG B 359 -13.943 -4.526 6.957 1.00 10.00 H new ATOM 0 HH11 ARG B 359 -14.378 -2.170 9.555 1.00 10.00 H new ATOM 0 HH12 ARG B 359 -14.404 -0.793 8.449 1.00 10.00 H new ATOM 0 HH21 ARG B 359 -13.966 -2.760 5.555 1.00 10.00 H new ATOM 0 HH22 ARG B 359 -14.171 -1.126 6.193 1.00 10.00 H new ATOM 1285 N ASP B 360 -8.407 -4.829 10.671 1.00 10.00 N ATOM 1286 CA ASP B 360 -7.473 -4.452 11.725 1.00 10.00 C ATOM 1287 C ASP B 360 -7.034 -3.014 11.509 1.00 10.00 C ATOM 1288 O ASP B 360 -6.823 -2.612 10.365 1.00 10.00 O ATOM 1289 CB ASP B 360 -6.271 -5.408 11.836 1.00 10.00 C ATOM 1290 CG ASP B 360 -5.645 -5.796 10.511 1.00 10.00 C ATOM 1291 OD1 ASP B 360 -6.061 -6.831 9.947 1.00 10.00 O ATOM 1292 OD2 ASP B 360 -4.703 -5.108 10.067 1.00 10.00 O ATOM 0 H ASP B 360 -8.045 -4.669 9.731 1.00 10.00 H new ATOM 0 HA ASP B 360 -7.990 -4.533 12.681 1.00 10.00 H new ATOM 0 HB2 ASP B 360 -5.509 -4.940 12.459 1.00 10.00 H new ATOM 0 HB3 ASP B 360 -6.591 -6.314 12.350 1.00 10.00 H new ATOM 1297 N PRO B 361 -6.917 -2.195 12.560 1.00 10.00 N ATOM 1298 CA PRO B 361 -6.526 -0.811 12.404 1.00 10.00 C ATOM 1299 C PRO B 361 -5.089 -0.554 12.837 1.00 10.00 C ATOM 1300 O PRO B 361 -4.670 -0.896 13.943 1.00 10.00 O ATOM 1301 CB PRO B 361 -7.493 -0.128 13.373 1.00 10.00 C ATOM 1302 CG PRO B 361 -7.747 -1.140 14.462 1.00 10.00 C ATOM 1303 CD PRO B 361 -7.266 -2.487 13.954 1.00 10.00 C ATOM 0 HA PRO B 361 -6.568 -0.467 11.371 1.00 10.00 H new ATOM 0 HB2 PRO B 361 -7.062 0.787 13.779 1.00 10.00 H new ATOM 0 HB3 PRO B 361 -8.420 0.152 12.872 1.00 10.00 H new ATOM 0 HG2 PRO B 361 -7.218 -0.863 15.374 1.00 10.00 H new ATOM 0 HG3 PRO B 361 -8.808 -1.180 14.709 1.00 10.00 H new ATOM 0 HD2 PRO B 361 -6.408 -2.851 14.519 1.00 10.00 H new ATOM 0 HD3 PRO B 361 -8.042 -3.249 14.027 1.00 10.00 H new ATOM 1311 N ILE B 362 -4.345 0.077 11.941 1.00 10.00 N ATOM 1312 CA ILE B 362 -2.937 0.370 12.165 1.00 10.00 C ATOM 1313 C ILE B 362 -2.688 1.868 12.155 1.00 10.00 C ATOM 1314 O ILE B 362 -3.135 2.563 11.249 1.00 10.00 O ATOM 1315 CB ILE B 362 -2.050 -0.274 11.067 1.00 10.00 C ATOM 1316 CG1 ILE B 362 -2.461 -1.730 10.814 1.00 10.00 C ATOM 1317 CG2 ILE B 362 -0.567 -0.178 11.433 1.00 10.00 C ATOM 1318 CD1 ILE B 362 -2.065 -2.238 9.446 1.00 10.00 C ATOM 0 H ILE B 362 -4.699 0.400 11.040 1.00 10.00 H new ATOM 0 HA ILE B 362 -2.677 -0.045 13.139 1.00 10.00 H new ATOM 0 HB ILE B 362 -2.203 0.283 10.143 1.00 10.00 H new ATOM 0 HG12 ILE B 362 -2.007 -2.365 11.574 1.00 10.00 H new ATOM 0 HG13 ILE B 362 -3.541 -1.820 10.928 1.00 10.00 H new ATOM 0 HG21 ILE B 362 0.032 -0.637 10.647 1.00 10.00 H new ATOM 0 HG22 ILE B 362 -0.286 0.870 11.539 1.00 10.00 H new ATOM 0 HG23 ILE B 362 -0.390 -0.698 12.374 1.00 10.00 H new ATOM 0 HD11 ILE B 362 -2.387 -3.274 9.335 1.00 10.00 H new ATOM 0 HD12 ILE B 362 -2.540 -1.627 8.679 1.00 10.00 H new ATOM 0 HD13 ILE B 362 -0.982 -2.181 9.336 1.00 10.00 H new ATOM 1330 N VAL B 363 -1.998 2.375 13.171 1.00 10.00 N ATOM 1331 CA VAL B 363 -1.681 3.793 13.213 1.00 10.00 C ATOM 1332 C VAL B 363 -0.178 3.991 13.244 1.00 10.00 C ATOM 1333 O VAL B 363 0.512 3.452 14.116 1.00 10.00 O ATOM 1334 CB VAL B 363 -2.266 4.493 14.464 1.00 10.00 C ATOM 1335 CG1 VAL B 363 -1.996 5.994 14.419 1.00 10.00 C ATOM 1336 CG2 VAL B 363 -3.755 4.212 14.620 1.00 10.00 C ATOM 0 H VAL B 363 -1.653 1.833 13.964 1.00 10.00 H new ATOM 0 HA VAL B 363 -2.123 4.232 12.319 1.00 10.00 H new ATOM 0 HB VAL B 363 -1.763 4.080 15.338 1.00 10.00 H new ATOM 0 HG11 VAL B 363 -2.416 6.466 15.307 1.00 10.00 H new ATOM 0 HG12 VAL B 363 -0.921 6.169 14.388 1.00 10.00 H new ATOM 0 HG13 VAL B 363 -2.459 6.420 13.529 1.00 10.00 H new ATOM 0 HG21 VAL B 363 -4.130 4.720 15.509 1.00 10.00 H new ATOM 0 HG22 VAL B 363 -4.288 4.576 13.742 1.00 10.00 H new ATOM 0 HG23 VAL B 363 -3.914 3.138 14.721 1.00 10.00 H new ATOM 1346 N ILE B 364 0.329 4.738 12.283 1.00 10.00 N ATOM 1347 CA ILE B 364 1.740 5.061 12.235 1.00 10.00 C ATOM 1348 C ILE B 364 1.916 6.567 12.141 1.00 10.00 C ATOM 1349 O ILE B 364 1.228 7.237 11.367 1.00 10.00 O ATOM 1350 CB ILE B 364 2.510 4.343 11.090 1.00 10.00 C ATOM 1351 CG1 ILE B 364 4.019 4.617 11.197 1.00 10.00 C ATOM 1352 CG2 ILE B 364 2.002 4.763 9.718 1.00 10.00 C ATOM 1353 CD1 ILE B 364 4.642 4.156 12.503 1.00 10.00 C ATOM 0 H ILE B 364 -0.220 5.135 11.520 1.00 10.00 H new ATOM 0 HA ILE B 364 2.180 4.690 13.161 1.00 10.00 H new ATOM 0 HB ILE B 364 2.332 3.274 11.202 1.00 10.00 H new ATOM 0 HG12 ILE B 364 4.527 4.121 10.370 1.00 10.00 H new ATOM 0 HG13 ILE B 364 4.192 5.687 11.082 1.00 10.00 H new ATOM 0 HG21 ILE B 364 2.565 4.239 8.946 1.00 10.00 H new ATOM 0 HG22 ILE B 364 0.945 4.512 9.629 1.00 10.00 H new ATOM 0 HG23 ILE B 364 2.132 5.838 9.596 1.00 10.00 H new ATOM 0 HD11 ILE B 364 5.708 4.386 12.499 1.00 10.00 H new ATOM 0 HD12 ILE B 364 4.163 4.670 13.336 1.00 10.00 H new ATOM 0 HD13 ILE B 364 4.503 3.080 12.613 1.00 10.00 H new ATOM 1365 N SER B 365 2.783 7.108 12.966 1.00 10.00 N ATOM 1366 CA SER B 365 3.037 8.533 12.958 1.00 10.00 C ATOM 1367 C SER B 365 4.501 8.781 12.630 1.00 10.00 C ATOM 1368 O SER B 365 5.387 8.149 13.207 1.00 10.00 O ATOM 1369 CB SER B 365 2.653 9.158 14.300 1.00 10.00 C ATOM 1370 OG SER B 365 1.289 8.891 14.577 1.00 10.00 O ATOM 0 H SER B 365 3.325 6.583 13.652 1.00 10.00 H new ATOM 0 HA SER B 365 2.422 9.006 12.193 1.00 10.00 H new ATOM 0 HB2 SER B 365 3.281 8.754 15.094 1.00 10.00 H new ATOM 0 HB3 SER B 365 2.825 10.234 14.274 1.00 10.00 H new ATOM 0 HG SER B 365 1.046 9.291 15.438 1.00 10.00 H new ATOM 1376 N ASP B 366 4.752 9.685 11.696 1.00 10.00 N ATOM 1377 CA ASP B 366 6.110 9.984 11.282 1.00 10.00 C ATOM 1378 C ASP B 366 6.442 11.429 11.601 1.00 10.00 C ATOM 1379 O ASP B 366 5.658 12.339 11.316 1.00 10.00 O ATOM 1380 CB ASP B 366 6.274 9.724 9.785 1.00 10.00 C ATOM 1381 CG ASP B 366 7.721 9.521 9.384 1.00 10.00 C ATOM 1382 OD1 ASP B 366 8.012 9.523 8.167 1.00 10.00 O ATOM 1383 OD2 ASP B 366 8.571 9.318 10.274 1.00 10.00 O ATOM 0 H ASP B 366 4.033 10.223 11.212 1.00 10.00 H new ATOM 0 HA ASP B 366 6.796 9.335 11.826 1.00 10.00 H new ATOM 0 HB2 ASP B 366 5.697 8.842 9.508 1.00 10.00 H new ATOM 0 HB3 ASP B 366 5.860 10.564 9.227 1.00 10.00 H new ATOM 1388 N SER B 367 7.581 11.629 12.229 1.00 10.00 N ATOM 1389 CA SER B 367 8.017 12.955 12.615 1.00 10.00 C ATOM 1390 C SER B 367 9.292 13.338 11.862 1.00 10.00 C ATOM 1391 O SER B 367 10.359 12.753 12.080 1.00 10.00 O ATOM 1392 CB SER B 367 8.258 12.994 14.126 1.00 10.00 C ATOM 1393 OG SER B 367 7.145 12.463 14.835 1.00 10.00 O ATOM 0 H SER B 367 8.227 10.883 12.485 1.00 10.00 H new ATOM 0 HA SER B 367 7.240 13.675 12.358 1.00 10.00 H new ATOM 0 HB2 SER B 367 9.154 12.423 14.369 1.00 10.00 H new ATOM 0 HB3 SER B 367 8.438 14.021 14.442 1.00 10.00 H new ATOM 0 HG SER B 367 7.324 12.497 15.798 1.00 10.00 H new ATOM 1399 N PRO B 368 9.199 14.333 10.968 1.00 10.00 N ATOM 1400 CA PRO B 368 10.340 14.792 10.173 1.00 10.00 C ATOM 1401 C PRO B 368 11.305 15.641 10.993 1.00 10.00 C ATOM 1402 O PRO B 368 10.847 16.344 11.922 1.00 10.00 O ATOM 1403 CB PRO B 368 9.680 15.621 9.068 1.00 10.00 C ATOM 1404 CG PRO B 368 8.432 16.145 9.684 1.00 10.00 C ATOM 1405 CD PRO B 368 7.973 15.101 10.668 1.00 10.00 C ATOM 0 HA PRO B 368 10.946 13.968 9.796 1.00 10.00 H new ATOM 0 HB2 PRO B 368 10.330 16.432 8.739 1.00 10.00 H new ATOM 0 HB3 PRO B 368 9.463 15.011 8.191 1.00 10.00 H new ATOM 0 HG2 PRO B 368 8.615 17.096 10.184 1.00 10.00 H new ATOM 0 HG3 PRO B 368 7.670 16.325 8.925 1.00 10.00 H new ATOM 0 HD2 PRO B 368 7.556 15.555 11.567 1.00 10.00 H new ATOM 0 HD3 PRO B 368 7.197 14.465 10.243 1.00 10.00 H new TER 1413 PRO B 368