USER MOD reduce.3.24.130724 H: found=0, std=0, add=698, rem=0, adj=17 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= 0.329 K(o=0.31,f=-2.9!) USER MOD Set 1.2: A 88 GLN : amide:sc= -0.0205 K(o=0.31,f=-2.9) USER MOD Set 2.1: A 19 ASN : amide:sc= 2.09 K(o=3.2,f=-1.9) USER MOD Set 2.2: A 31 GLN : amide:sc= 1.15 K(o=3.2,f=0.007) USER MOD Single : A 17 HIS : no HD1:sc= -0.817 X(o=-0.82,f=-0.79) USER MOD Single : A 21 LYS NZ :NH3+ -156:sc= 1.26 (180deg=1.1) USER MOD Single : A 25 GLN : amide:sc= 1.25 K(o=1.2,f=-0.66) USER MOD Single : A 28 SER OG : rot -83:sc= 1.24 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 HD1:sc= -1.59 K(o=-1.6,f=-3.5!) USER MOD Single : A 38 THR OG1 : rot -160:sc= -0.646 USER MOD Single : A 41 SER OG : rot -118:sc= 1.43 USER MOD Single : A 42 LYS NZ :NH3+ -113:sc= -0.839 (180deg=-2.52!) USER MOD Single : A 44 MET CE :methyl 171:sc= -0.493 (180deg=-0.591) 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 -82:sc= -0.464 USER MOD Single : A 51 GLN : amide:sc= -0.0397 K(o=-0.04,f=-0.81) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 55 MET CE :methyl 162:sc= -0.0392 (180deg=-0.355) USER MOD Single : A 65 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 68 ASN : amide:sc= 1.22 K(o=1.2,f=-0.2) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 THR OG1 : rot 110:sc= -1.93! USER MOD Single : A 75 GLN : amide:sc= -0.168 K(o=-0.17,f=-0.78) USER MOD Single : A 78 MET CE :methyl -119:sc= -1.57 (180deg=-3.41) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 GLN : amide:sc= -0.24 X(o=-0.24,f=-0.73) USER MOD Single : A 90 GLN : amide:sc= -0.641 K(o=-0.64,f=-2.5!) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0.15 USER MOD Single : B 357 ASN : amide:sc= 0 X(o=0,f=-0.0047) USER MOD Single : B 358 ASN : amide:sc= -0.173 X(o=-0.17,f=-0.23) USER MOD Single : B 365 SER OG : rot 180:sc= 0 USER MOD Single : B 367 SER OG : rot 180:sc= 0.0555 USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 16 -6.480 15.615 12.423 1.00 10.00 N ATOM 2 CA ASP A 16 -6.889 14.263 12.860 1.00 10.00 C ATOM 3 C ASP A 16 -6.219 13.220 11.979 1.00 10.00 C ATOM 4 O ASP A 16 -5.250 13.526 11.282 1.00 10.00 O ATOM 5 CB ASP A 16 -8.414 14.118 12.789 1.00 10.00 C ATOM 6 CG ASP A 16 -8.959 13.170 13.840 1.00 10.00 C ATOM 7 OD1 ASP A 16 -8.874 11.940 13.645 1.00 10.00 O ATOM 8 OD2 ASP A 16 -9.478 13.651 14.868 1.00 10.00 O ATOM 0 HA ASP A 16 -6.578 14.113 13.894 1.00 10.00 H new ATOM 0 HB2 ASP A 16 -8.875 15.098 12.915 1.00 10.00 H new ATOM 0 HB3 ASP A 16 -8.695 13.758 11.799 1.00 10.00 H new ATOM 13 N HIS A 17 -6.727 12.001 12.006 1.00 10.00 N ATOM 14 CA HIS A 17 -6.169 10.926 11.205 1.00 10.00 C ATOM 15 C HIS A 17 -7.086 10.615 10.027 1.00 10.00 C ATOM 16 O HIS A 17 -8.252 11.016 10.012 1.00 10.00 O ATOM 17 CB HIS A 17 -5.960 9.677 12.063 1.00 10.00 C ATOM 18 CG HIS A 17 -4.841 9.805 13.054 1.00 10.00 C ATOM 19 ND1 HIS A 17 -5.043 10.345 14.300 1.00 10.00 N ATOM 20 CD2 HIS A 17 -3.538 9.458 12.930 1.00 10.00 C ATOM 21 CE1 HIS A 17 -3.865 10.318 14.902 1.00 10.00 C ATOM 22 NE2 HIS A 17 -2.924 9.789 14.111 1.00 10.00 N ATOM 0 H HIS A 17 -7.528 11.730 12.576 1.00 10.00 H new ATOM 0 HA HIS A 17 -5.202 11.245 10.818 1.00 10.00 H new ATOM 0 HB2 HIS A 17 -6.884 9.456 12.598 1.00 10.00 H new ATOM 0 HB3 HIS A 17 -5.759 8.828 11.410 1.00 10.00 H new ATOM 0 HD2 HIS A 17 -3.072 9.007 12.067 1.00 10.00 H new ATOM 0 HE1 HIS A 17 -3.686 10.677 15.905 1.00 10.00 H new ATOM 0 HE2 HIS A 17 -1.939 9.657 14.342 1.00 10.00 H new ATOM 30 N ILE A 18 -6.556 9.908 9.045 1.00 10.00 N ATOM 31 CA ILE A 18 -7.318 9.539 7.865 1.00 10.00 C ATOM 32 C ILE A 18 -7.441 8.020 7.791 1.00 10.00 C ATOM 33 O ILE A 18 -6.469 7.303 8.026 1.00 10.00 O ATOM 34 CB ILE A 18 -6.663 10.103 6.577 1.00 10.00 C ATOM 35 CG1 ILE A 18 -7.532 9.814 5.351 1.00 10.00 C ATOM 36 CG2 ILE A 18 -5.257 9.542 6.379 1.00 10.00 C ATOM 37 CD1 ILE A 18 -7.072 10.537 4.104 1.00 10.00 C ATOM 0 H ILE A 18 -5.592 9.575 9.042 1.00 10.00 H new ATOM 0 HA ILE A 18 -8.315 9.974 7.941 1.00 10.00 H new ATOM 0 HB ILE A 18 -6.582 11.184 6.695 1.00 10.00 H new ATOM 0 HG12 ILE A 18 -7.533 8.741 5.160 1.00 10.00 H new ATOM 0 HG13 ILE A 18 -8.561 10.100 5.569 1.00 10.00 H new ATOM 0 HG21 ILE A 18 -4.825 9.956 5.468 1.00 10.00 H new ATOM 0 HG22 ILE A 18 -4.634 9.812 7.232 1.00 10.00 H new ATOM 0 HG23 ILE A 18 -5.307 8.456 6.296 1.00 10.00 H new ATOM 0 HD11 ILE A 18 -7.732 10.287 3.274 1.00 10.00 H new ATOM 0 HD12 ILE A 18 -7.098 11.613 4.277 1.00 10.00 H new ATOM 0 HD13 ILE A 18 -6.054 10.233 3.862 1.00 10.00 H new ATOM 49 N ASN A 19 -8.640 7.533 7.503 1.00 10.00 N ATOM 50 CA ASN A 19 -8.880 6.098 7.428 1.00 10.00 C ATOM 51 C ASN A 19 -8.835 5.608 5.991 1.00 10.00 C ATOM 52 O ASN A 19 -9.756 5.848 5.205 1.00 10.00 O ATOM 53 CB ASN A 19 -10.233 5.742 8.051 1.00 10.00 C ATOM 54 CG ASN A 19 -10.363 6.228 9.481 1.00 10.00 C ATOM 55 OD1 ASN A 19 -10.017 5.520 10.426 1.00 10.00 O ATOM 56 ND2 ASN A 19 -10.865 7.439 9.646 1.00 10.00 N ATOM 0 H ASN A 19 -9.461 8.109 7.318 1.00 10.00 H new ATOM 0 HA ASN A 19 -8.087 5.603 7.989 1.00 10.00 H new ATOM 0 HB2 ASN A 19 -11.031 6.177 7.450 1.00 10.00 H new ATOM 0 HB3 ASN A 19 -10.367 4.661 8.025 1.00 10.00 H new ATOM 0 HD21 ASN A 19 -10.978 7.820 10.585 1.00 10.00 H new ATOM 0 HD22 ASN A 19 -11.139 7.992 8.834 1.00 10.00 H new ATOM 63 N LEU A 20 -7.755 4.930 5.649 1.00 10.00 N ATOM 64 CA LEU A 20 -7.579 4.388 4.313 1.00 10.00 C ATOM 65 C LEU A 20 -7.791 2.878 4.337 1.00 10.00 C ATOM 66 O LEU A 20 -7.027 2.144 4.965 1.00 10.00 O ATOM 67 CB LEU A 20 -6.183 4.724 3.783 1.00 10.00 C ATOM 68 CG LEU A 20 -5.855 6.218 3.733 1.00 10.00 C ATOM 69 CD1 LEU A 20 -4.416 6.435 3.287 1.00 10.00 C ATOM 70 CD2 LEU A 20 -6.822 6.947 2.808 1.00 10.00 C ATOM 0 H LEU A 20 -6.980 4.740 6.284 1.00 10.00 H new ATOM 0 HA LEU A 20 -8.316 4.837 3.647 1.00 10.00 H new ATOM 0 HB2 LEU A 20 -5.443 4.225 4.409 1.00 10.00 H new ATOM 0 HB3 LEU A 20 -6.082 4.311 2.779 1.00 10.00 H new ATOM 0 HG LEU A 20 -5.967 6.629 4.736 1.00 10.00 H new ATOM 0 HD11 LEU A 20 -4.201 7.503 3.258 1.00 10.00 H new ATOM 0 HD12 LEU A 20 -3.740 5.948 3.990 1.00 10.00 H new ATOM 0 HD13 LEU A 20 -4.275 6.009 2.294 1.00 10.00 H new ATOM 0 HD21 LEU A 20 -6.573 8.008 2.785 1.00 10.00 H new ATOM 0 HD22 LEU A 20 -6.744 6.534 1.802 1.00 10.00 H new ATOM 0 HD23 LEU A 20 -7.841 6.821 3.174 1.00 10.00 H new ATOM 82 N LYS A 21 -8.839 2.420 3.669 1.00 10.00 N ATOM 83 CA LYS A 21 -9.154 0.999 3.627 1.00 10.00 C ATOM 84 C LYS A 21 -8.288 0.283 2.601 1.00 10.00 C ATOM 85 O LYS A 21 -8.303 0.623 1.418 1.00 10.00 O ATOM 86 CB LYS A 21 -10.629 0.788 3.280 1.00 10.00 C ATOM 87 CG LYS A 21 -11.590 1.488 4.224 1.00 10.00 C ATOM 88 CD LYS A 21 -12.987 1.551 3.634 1.00 10.00 C ATOM 89 CE LYS A 21 -13.930 2.339 4.522 1.00 10.00 C ATOM 90 NZ LYS A 21 -15.264 2.530 3.892 1.00 10.00 N ATOM 0 H LYS A 21 -9.486 3.012 3.148 1.00 10.00 H new ATOM 0 HA LYS A 21 -8.952 0.583 4.614 1.00 10.00 H new ATOM 0 HB2 LYS A 21 -10.808 1.144 2.265 1.00 10.00 H new ATOM 0 HB3 LYS A 21 -10.844 -0.281 3.285 1.00 10.00 H new ATOM 0 HG2 LYS A 21 -11.618 0.960 5.177 1.00 10.00 H new ATOM 0 HG3 LYS A 21 -11.233 2.497 4.429 1.00 10.00 H new ATOM 0 HD2 LYS A 21 -12.946 2.011 2.647 1.00 10.00 H new ATOM 0 HD3 LYS A 21 -13.372 0.540 3.499 1.00 10.00 H new ATOM 0 HE2 LYS A 21 -14.050 1.820 5.473 1.00 10.00 H new ATOM 0 HE3 LYS A 21 -13.491 3.312 4.743 1.00 10.00 H new ATOM 0 HZ1 LYS A 21 -15.723 3.370 4.299 1.00 10.00 H new ATOM 0 HZ2 LYS A 21 -15.148 2.661 2.867 1.00 10.00 H new ATOM 0 HZ3 LYS A 21 -15.855 1.693 4.069 1.00 10.00 H new ATOM 104 N VAL A 22 -7.527 -0.693 3.060 1.00 10.00 N ATOM 105 CA VAL A 22 -6.676 -1.470 2.178 1.00 10.00 C ATOM 106 C VAL A 22 -7.192 -2.899 2.120 1.00 10.00 C ATOM 107 O VAL A 22 -7.026 -3.672 3.066 1.00 10.00 O ATOM 108 CB VAL A 22 -5.201 -1.459 2.636 1.00 10.00 C ATOM 109 CG1 VAL A 22 -4.343 -2.333 1.732 1.00 10.00 C ATOM 110 CG2 VAL A 22 -4.664 -0.035 2.671 1.00 10.00 C ATOM 0 H VAL A 22 -7.481 -0.967 4.041 1.00 10.00 H new ATOM 0 HA VAL A 22 -6.709 -1.016 1.188 1.00 10.00 H new ATOM 0 HB VAL A 22 -5.156 -1.871 3.644 1.00 10.00 H new ATOM 0 HG11 VAL A 22 -3.309 -2.308 2.076 1.00 10.00 H new ATOM 0 HG12 VAL A 22 -4.711 -3.359 1.762 1.00 10.00 H new ATOM 0 HG13 VAL A 22 -4.394 -1.959 0.709 1.00 10.00 H new ATOM 0 HG21 VAL A 22 -3.624 -0.046 2.996 1.00 10.00 H new ATOM 0 HG22 VAL A 22 -4.728 0.403 1.675 1.00 10.00 H new ATOM 0 HG23 VAL A 22 -5.255 0.560 3.367 1.00 10.00 H new ATOM 120 N ALA A 23 -7.839 -3.235 1.016 1.00 10.00 N ATOM 121 CA ALA A 23 -8.400 -4.561 0.837 1.00 10.00 C ATOM 122 C ALA A 23 -7.585 -5.374 -0.155 1.00 10.00 C ATOM 123 O ALA A 23 -7.038 -4.832 -1.118 1.00 10.00 O ATOM 124 CB ALA A 23 -9.845 -4.460 0.371 1.00 10.00 C ATOM 0 H ALA A 23 -7.988 -2.604 0.229 1.00 10.00 H new ATOM 0 HA ALA A 23 -8.369 -5.073 1.799 1.00 10.00 H new ATOM 0 HB1 ALA A 23 -10.256 -5.461 0.240 1.00 10.00 H new ATOM 0 HB2 ALA A 23 -10.431 -3.922 1.116 1.00 10.00 H new ATOM 0 HB3 ALA A 23 -9.885 -3.924 -0.578 1.00 10.00 H new ATOM 130 N GLY A 24 -7.492 -6.671 0.097 1.00 10.00 N ATOM 131 CA GLY A 24 -6.760 -7.547 -0.789 1.00 10.00 C ATOM 132 C GLY A 24 -7.673 -8.167 -1.828 1.00 10.00 C ATOM 133 O GLY A 24 -8.778 -7.677 -2.058 1.00 10.00 O ATOM 0 H GLY A 24 -7.913 -7.133 0.903 1.00 10.00 H new ATOM 0 HA2 GLY A 24 -5.968 -6.986 -1.286 1.00 10.00 H new ATOM 0 HA3 GLY A 24 -6.278 -8.334 -0.209 1.00 10.00 H new ATOM 137 N GLN A 25 -7.234 -9.257 -2.438 1.00 10.00 N ATOM 138 CA GLN A 25 -8.035 -9.933 -3.450 1.00 10.00 C ATOM 139 C GLN A 25 -8.731 -11.147 -2.846 1.00 10.00 C ATOM 140 O GLN A 25 -9.020 -12.123 -3.538 1.00 10.00 O ATOM 141 CB GLN A 25 -7.166 -10.352 -4.641 1.00 10.00 C ATOM 142 CG GLN A 25 -6.406 -9.195 -5.272 1.00 10.00 C ATOM 143 CD GLN A 25 -7.307 -8.034 -5.649 1.00 10.00 C ATOM 144 OE1 GLN A 25 -8.455 -8.223 -6.048 1.00 10.00 O ATOM 145 NE2 GLN A 25 -6.793 -6.825 -5.515 1.00 10.00 N ATOM 0 H GLN A 25 -6.331 -9.692 -2.252 1.00 10.00 H new ATOM 0 HA GLN A 25 -8.793 -9.237 -3.810 1.00 10.00 H new ATOM 0 HB2 GLN A 25 -6.454 -11.109 -4.313 1.00 10.00 H new ATOM 0 HB3 GLN A 25 -7.799 -10.817 -5.397 1.00 10.00 H new ATOM 0 HG2 GLN A 25 -5.643 -8.846 -4.576 1.00 10.00 H new ATOM 0 HG3 GLN A 25 -5.887 -9.550 -6.162 1.00 10.00 H new ATOM 0 HE21 GLN A 25 -5.836 -6.712 -5.181 1.00 10.00 H new ATOM 0 HE22 GLN A 25 -7.353 -6.004 -5.746 1.00 10.00 H new ATOM 154 N ASP A 26 -8.989 -11.080 -1.547 1.00 10.00 N ATOM 155 CA ASP A 26 -9.650 -12.165 -0.836 1.00 10.00 C ATOM 156 C ASP A 26 -10.864 -11.650 -0.065 1.00 10.00 C ATOM 157 O ASP A 26 -12.005 -11.934 -0.428 1.00 10.00 O ATOM 158 CB ASP A 26 -8.675 -12.880 0.114 1.00 10.00 C ATOM 159 CG ASP A 26 -7.698 -11.944 0.810 1.00 10.00 C ATOM 160 OD1 ASP A 26 -6.486 -12.041 0.537 1.00 10.00 O ATOM 161 OD2 ASP A 26 -8.138 -11.108 1.626 1.00 10.00 O ATOM 0 H ASP A 26 -8.749 -10.280 -0.961 1.00 10.00 H new ATOM 0 HA ASP A 26 -9.993 -12.887 -1.577 1.00 10.00 H new ATOM 0 HB2 ASP A 26 -9.248 -13.419 0.869 1.00 10.00 H new ATOM 0 HB3 ASP A 26 -8.112 -13.623 -0.450 1.00 10.00 H new ATOM 166 N GLY A 27 -10.614 -10.901 0.996 1.00 10.00 N ATOM 167 CA GLY A 27 -11.686 -10.355 1.803 1.00 10.00 C ATOM 168 C GLY A 27 -11.172 -9.546 2.983 1.00 10.00 C ATOM 169 O GLY A 27 -11.951 -8.918 3.692 1.00 10.00 O ATOM 0 H GLY A 27 -9.677 -10.658 1.317 1.00 10.00 H new ATOM 0 HA2 GLY A 27 -12.319 -9.722 1.181 1.00 10.00 H new ATOM 0 HA3 GLY A 27 -12.311 -11.169 2.169 1.00 10.00 H new ATOM 173 N SER A 28 -9.863 -9.578 3.207 1.00 10.00 N ATOM 174 CA SER A 28 -9.258 -8.832 4.304 1.00 10.00 C ATOM 175 C SER A 28 -9.272 -7.336 4.006 1.00 10.00 C ATOM 176 O SER A 28 -8.765 -6.903 2.968 1.00 10.00 O ATOM 177 CB SER A 28 -7.819 -9.317 4.534 1.00 10.00 C ATOM 178 OG SER A 28 -7.101 -9.415 3.312 1.00 10.00 O ATOM 0 H SER A 28 -9.201 -10.112 2.644 1.00 10.00 H new ATOM 0 HA SER A 28 -9.840 -9.006 5.209 1.00 10.00 H new ATOM 0 HB2 SER A 28 -7.305 -8.629 5.205 1.00 10.00 H new ATOM 0 HB3 SER A 28 -7.836 -10.289 5.026 1.00 10.00 H new ATOM 0 HG SER A 28 -7.302 -10.273 2.882 1.00 10.00 H new ATOM 184 N VAL A 29 -9.863 -6.543 4.898 1.00 10.00 N ATOM 185 CA VAL A 29 -9.918 -5.101 4.692 1.00 10.00 C ATOM 186 C VAL A 29 -9.359 -4.365 5.901 1.00 10.00 C ATOM 187 O VAL A 29 -10.075 -4.101 6.862 1.00 10.00 O ATOM 188 CB VAL A 29 -11.357 -4.599 4.423 1.00 10.00 C ATOM 189 CG1 VAL A 29 -11.337 -3.143 3.975 1.00 10.00 C ATOM 190 CG2 VAL A 29 -12.052 -5.464 3.383 1.00 10.00 C ATOM 0 H VAL A 29 -10.304 -6.870 5.758 1.00 10.00 H new ATOM 0 HA VAL A 29 -9.311 -4.891 3.811 1.00 10.00 H new ATOM 0 HB VAL A 29 -11.920 -4.671 5.354 1.00 10.00 H new ATOM 0 HG11 VAL A 29 -12.357 -2.805 3.790 1.00 10.00 H new ATOM 0 HG12 VAL A 29 -10.887 -2.529 4.755 1.00 10.00 H new ATOM 0 HG13 VAL A 29 -10.753 -3.052 3.059 1.00 10.00 H new ATOM 0 HG21 VAL A 29 -13.061 -5.089 3.213 1.00 10.00 H new ATOM 0 HG22 VAL A 29 -11.491 -5.431 2.449 1.00 10.00 H new ATOM 0 HG23 VAL A 29 -12.103 -6.493 3.740 1.00 10.00 H new ATOM 200 N VAL A 30 -8.079 -4.037 5.857 1.00 10.00 N ATOM 201 CA VAL A 30 -7.453 -3.337 6.964 1.00 10.00 C ATOM 202 C VAL A 30 -7.749 -1.840 6.895 1.00 10.00 C ATOM 203 O VAL A 30 -7.859 -1.262 5.811 1.00 10.00 O ATOM 204 CB VAL A 30 -5.927 -3.578 7.019 1.00 10.00 C ATOM 205 CG1 VAL A 30 -5.628 -5.064 7.161 1.00 10.00 C ATOM 206 CG2 VAL A 30 -5.237 -3.010 5.789 1.00 10.00 C ATOM 0 H VAL A 30 -7.458 -4.242 5.074 1.00 10.00 H new ATOM 0 HA VAL A 30 -7.883 -3.743 7.880 1.00 10.00 H new ATOM 0 HB VAL A 30 -5.535 -3.058 7.893 1.00 10.00 H new ATOM 0 HG11 VAL A 30 -4.549 -5.216 7.198 1.00 10.00 H new ATOM 0 HG12 VAL A 30 -6.079 -5.440 8.079 1.00 10.00 H new ATOM 0 HG13 VAL A 30 -6.041 -5.601 6.307 1.00 10.00 H new ATOM 0 HG21 VAL A 30 -4.165 -3.194 5.856 1.00 10.00 H new ATOM 0 HG22 VAL A 30 -5.633 -3.491 4.895 1.00 10.00 H new ATOM 0 HG23 VAL A 30 -5.418 -1.937 5.734 1.00 10.00 H new ATOM 216 N GLN A 31 -7.890 -1.229 8.057 1.00 10.00 N ATOM 217 CA GLN A 31 -8.191 0.190 8.153 1.00 10.00 C ATOM 218 C GLN A 31 -6.949 0.966 8.581 1.00 10.00 C ATOM 219 O GLN A 31 -6.613 1.021 9.764 1.00 10.00 O ATOM 220 CB GLN A 31 -9.331 0.395 9.158 1.00 10.00 C ATOM 221 CG GLN A 31 -9.849 1.823 9.251 1.00 10.00 C ATOM 222 CD GLN A 31 -11.052 1.931 10.172 1.00 10.00 C ATOM 223 OE1 GLN A 31 -11.807 0.972 10.340 1.00 10.00 O ATOM 224 NE2 GLN A 31 -11.247 3.093 10.774 1.00 10.00 N ATOM 0 H GLN A 31 -7.800 -1.699 8.958 1.00 10.00 H new ATOM 0 HA GLN A 31 -8.502 0.564 7.178 1.00 10.00 H new ATOM 0 HB2 GLN A 31 -10.159 -0.260 8.886 1.00 10.00 H new ATOM 0 HB3 GLN A 31 -8.988 0.083 10.144 1.00 10.00 H new ATOM 0 HG2 GLN A 31 -9.054 2.474 9.614 1.00 10.00 H new ATOM 0 HG3 GLN A 31 -10.121 2.176 8.256 1.00 10.00 H new ATOM 0 HE21 GLN A 31 -10.602 3.866 10.612 1.00 10.00 H new ATOM 0 HE22 GLN A 31 -12.043 3.216 11.400 1.00 10.00 H new ATOM 233 N PHE A 32 -6.254 1.545 7.617 1.00 10.00 N ATOM 234 CA PHE A 32 -5.056 2.314 7.912 1.00 10.00 C ATOM 235 C PHE A 32 -5.425 3.697 8.421 1.00 10.00 C ATOM 236 O PHE A 32 -5.824 4.563 7.647 1.00 10.00 O ATOM 237 CB PHE A 32 -4.167 2.430 6.674 1.00 10.00 C ATOM 238 CG PHE A 32 -3.085 1.393 6.618 1.00 10.00 C ATOM 239 CD1 PHE A 32 -3.242 0.247 5.855 1.00 10.00 C ATOM 240 CD2 PHE A 32 -1.914 1.562 7.335 1.00 10.00 C ATOM 241 CE1 PHE A 32 -2.249 -0.709 5.804 1.00 10.00 C ATOM 242 CE2 PHE A 32 -0.914 0.607 7.288 1.00 10.00 C ATOM 243 CZ PHE A 32 -1.084 -0.530 6.522 1.00 10.00 C ATOM 0 H PHE A 32 -6.497 1.498 6.627 1.00 10.00 H new ATOM 0 HA PHE A 32 -4.500 1.790 8.689 1.00 10.00 H new ATOM 0 HB2 PHE A 32 -4.787 2.346 5.781 1.00 10.00 H new ATOM 0 HB3 PHE A 32 -3.712 3.420 6.654 1.00 10.00 H new ATOM 0 HD1 PHE A 32 -4.153 0.101 5.293 1.00 10.00 H new ATOM 0 HD2 PHE A 32 -1.779 2.448 7.937 1.00 10.00 H new ATOM 0 HE1 PHE A 32 -2.383 -1.596 5.203 1.00 10.00 H new ATOM 0 HE2 PHE A 32 -0.002 0.750 7.849 1.00 10.00 H new ATOM 0 HZ PHE A 32 -0.306 -1.278 6.485 1.00 10.00 H new ATOM 253 N LYS A 33 -5.296 3.892 9.723 1.00 10.00 N ATOM 254 CA LYS A 33 -5.618 5.166 10.342 1.00 10.00 C ATOM 255 C LYS A 33 -4.336 5.946 10.612 1.00 10.00 C ATOM 256 O LYS A 33 -3.863 6.029 11.745 1.00 10.00 O ATOM 257 CB LYS A 33 -6.396 4.940 11.641 1.00 10.00 C ATOM 258 CG LYS A 33 -7.046 6.198 12.195 1.00 10.00 C ATOM 259 CD LYS A 33 -7.585 5.974 13.599 1.00 10.00 C ATOM 260 CE LYS A 33 -8.282 7.214 14.136 1.00 10.00 C ATOM 261 NZ LYS A 33 -8.426 7.172 15.616 1.00 10.00 N ATOM 0 H LYS A 33 -4.968 3.179 10.375 1.00 10.00 H new ATOM 0 HA LYS A 33 -6.245 5.746 9.664 1.00 10.00 H new ATOM 0 HB2 LYS A 33 -7.168 4.191 11.465 1.00 10.00 H new ATOM 0 HB3 LYS A 33 -5.720 4.531 12.392 1.00 10.00 H new ATOM 0 HG2 LYS A 33 -6.318 7.009 12.209 1.00 10.00 H new ATOM 0 HG3 LYS A 33 -7.858 6.509 11.538 1.00 10.00 H new ATOM 0 HD2 LYS A 33 -8.284 5.138 13.592 1.00 10.00 H new ATOM 0 HD3 LYS A 33 -6.766 5.699 14.264 1.00 10.00 H new ATOM 0 HE2 LYS A 33 -7.716 8.101 13.851 1.00 10.00 H new ATOM 0 HE3 LYS A 33 -9.267 7.304 13.678 1.00 10.00 H new ATOM 0 HZ1 LYS A 33 -8.906 8.035 15.943 1.00 10.00 H new ATOM 0 HZ2 LYS A 33 -8.988 6.340 15.887 1.00 10.00 H new ATOM 0 HZ3 LYS A 33 -7.485 7.112 16.055 1.00 10.00 H new ATOM 275 N ILE A 34 -3.771 6.496 9.555 1.00 10.00 N ATOM 276 CA ILE A 34 -2.541 7.261 9.656 1.00 10.00 C ATOM 277 C ILE A 34 -2.825 8.743 9.479 1.00 10.00 C ATOM 278 O ILE A 34 -3.979 9.150 9.380 1.00 10.00 O ATOM 279 CB ILE A 34 -1.506 6.806 8.606 1.00 10.00 C ATOM 280 CG1 ILE A 34 -2.113 6.824 7.196 1.00 10.00 C ATOM 281 CG2 ILE A 34 -0.994 5.415 8.952 1.00 10.00 C ATOM 282 CD1 ILE A 34 -1.090 6.661 6.093 1.00 10.00 C ATOM 0 H ILE A 34 -4.147 6.427 8.609 1.00 10.00 H new ATOM 0 HA ILE A 34 -2.125 7.085 10.648 1.00 10.00 H new ATOM 0 HB ILE A 34 -0.668 7.503 8.618 1.00 10.00 H new ATOM 0 HG12 ILE A 34 -2.850 6.025 7.117 1.00 10.00 H new ATOM 0 HG13 ILE A 34 -2.645 7.764 7.051 1.00 10.00 H new ATOM 0 HG21 ILE A 34 -0.264 5.100 8.207 1.00 10.00 H new ATOM 0 HG22 ILE A 34 -0.524 5.435 9.935 1.00 10.00 H new ATOM 0 HG23 ILE A 34 -1.828 4.713 8.963 1.00 10.00 H new ATOM 0 HD11 ILE A 34 -1.591 6.683 5.125 1.00 10.00 H new ATOM 0 HD12 ILE A 34 -0.366 7.474 6.145 1.00 10.00 H new ATOM 0 HD13 ILE A 34 -0.575 5.708 6.213 1.00 10.00 H new ATOM 294 N LYS A 35 -1.779 9.548 9.442 1.00 10.00 N ATOM 295 CA LYS A 35 -1.946 10.977 9.268 1.00 10.00 C ATOM 296 C LYS A 35 -1.911 11.322 7.785 1.00 10.00 C ATOM 297 O LYS A 35 -1.323 10.595 6.984 1.00 10.00 O ATOM 298 CB LYS A 35 -0.863 11.745 10.028 1.00 10.00 C ATOM 299 CG LYS A 35 -0.767 11.347 11.493 1.00 10.00 C ATOM 300 CD LYS A 35 -0.252 12.486 12.356 1.00 10.00 C ATOM 301 CE LYS A 35 -0.158 12.073 13.814 1.00 10.00 C ATOM 302 NZ LYS A 35 0.207 13.215 14.695 1.00 10.00 N ATOM 0 H LYS A 35 -0.811 9.238 9.530 1.00 10.00 H new ATOM 0 HA LYS A 35 -2.913 11.271 9.676 1.00 10.00 H new ATOM 0 HB2 LYS A 35 0.100 11.574 9.547 1.00 10.00 H new ATOM 0 HB3 LYS A 35 -1.068 12.813 9.960 1.00 10.00 H new ATOM 0 HG2 LYS A 35 -1.749 11.036 11.850 1.00 10.00 H new ATOM 0 HG3 LYS A 35 -0.105 10.487 11.593 1.00 10.00 H new ATOM 0 HD2 LYS A 35 0.729 12.800 12.000 1.00 10.00 H new ATOM 0 HD3 LYS A 35 -0.915 13.346 12.261 1.00 10.00 H new ATOM 0 HE2 LYS A 35 -1.113 11.658 14.135 1.00 10.00 H new ATOM 0 HE3 LYS A 35 0.585 11.282 13.920 1.00 10.00 H new ATOM 0 HZ1 LYS A 35 0.260 12.889 15.681 1.00 10.00 H new ATOM 0 HZ2 LYS A 35 1.131 13.595 14.406 1.00 10.00 H new ATOM 0 HZ3 LYS A 35 -0.515 13.960 14.615 1.00 10.00 H new ATOM 316 N ARG A 36 -2.523 12.437 7.422 1.00 10.00 N ATOM 317 CA ARG A 36 -2.581 12.855 6.025 1.00 10.00 C ATOM 318 C ARG A 36 -1.210 13.285 5.497 1.00 10.00 C ATOM 319 O ARG A 36 -1.045 13.514 4.298 1.00 10.00 O ATOM 320 CB ARG A 36 -3.606 13.979 5.855 1.00 10.00 C ATOM 321 CG ARG A 36 -5.035 13.535 6.141 1.00 10.00 C ATOM 322 CD ARG A 36 -6.021 14.694 6.058 1.00 10.00 C ATOM 323 NE ARG A 36 -6.234 15.143 4.683 1.00 10.00 N ATOM 324 CZ ARG A 36 -7.387 15.018 4.019 1.00 10.00 C ATOM 325 NH1 ARG A 36 -8.434 14.421 4.583 1.00 10.00 N ATOM 326 NH2 ARG A 36 -7.489 15.488 2.785 1.00 10.00 N ATOM 0 H ARG A 36 -2.987 13.071 8.072 1.00 10.00 H new ATOM 0 HA ARG A 36 -2.895 11.995 5.433 1.00 10.00 H new ATOM 0 HB2 ARG A 36 -3.348 14.802 6.522 1.00 10.00 H new ATOM 0 HB3 ARG A 36 -3.549 14.364 4.837 1.00 10.00 H new ATOM 0 HG2 ARG A 36 -5.324 12.762 5.429 1.00 10.00 H new ATOM 0 HG3 ARG A 36 -5.084 13.088 7.134 1.00 10.00 H new ATOM 0 HD2 ARG A 36 -6.974 14.389 6.490 1.00 10.00 H new ATOM 0 HD3 ARG A 36 -5.651 15.526 6.657 1.00 10.00 H new ATOM 0 HE ARG A 36 -5.451 15.581 4.198 1.00 10.00 H new ATOM 0 HH11 ARG A 36 -8.361 14.053 5.532 1.00 10.00 H new ATOM 0 HH12 ARG A 36 -9.309 14.331 4.067 1.00 10.00 H new ATOM 0 HH21 ARG A 36 -6.689 15.943 2.345 1.00 10.00 H new ATOM 0 HH22 ARG A 36 -8.367 15.395 2.275 1.00 10.00 H new ATOM 340 N HIS A 37 -0.226 13.371 6.386 1.00 10.00 N ATOM 341 CA HIS A 37 1.123 13.767 5.992 1.00 10.00 C ATOM 342 C HIS A 37 2.088 12.581 6.033 1.00 10.00 C ATOM 343 O HIS A 37 3.264 12.716 5.692 1.00 10.00 O ATOM 344 CB HIS A 37 1.642 14.905 6.884 1.00 10.00 C ATOM 345 CG HIS A 37 1.756 14.571 8.346 1.00 10.00 C ATOM 346 ND1 HIS A 37 2.629 13.614 8.804 1.00 10.00 N ATOM 347 CD2 HIS A 37 1.111 15.117 9.402 1.00 10.00 C ATOM 348 CE1 HIS A 37 2.502 13.606 10.118 1.00 10.00 C ATOM 349 NE2 HIS A 37 1.591 14.500 10.529 1.00 10.00 N ATOM 0 H HIS A 37 -0.336 13.173 7.381 1.00 10.00 H new ATOM 0 HA HIS A 37 1.070 14.125 4.964 1.00 10.00 H new ATOM 0 HB2 HIS A 37 2.623 15.212 6.520 1.00 10.00 H new ATOM 0 HB3 HIS A 37 0.978 15.763 6.774 1.00 10.00 H new ATOM 0 HD2 HIS A 37 0.360 15.892 9.365 1.00 10.00 H new ATOM 0 HE1 HIS A 37 3.062 12.961 10.779 1.00 10.00 H new ATOM 0 HE2 HIS A 37 1.310 14.685 11.492 1.00 10.00 H new ATOM 357 N THR A 38 1.582 11.421 6.433 1.00 10.00 N ATOM 358 CA THR A 38 2.401 10.221 6.533 1.00 10.00 C ATOM 359 C THR A 38 2.610 9.578 5.161 1.00 10.00 C ATOM 360 O THR A 38 1.643 9.284 4.459 1.00 10.00 O ATOM 361 CB THR A 38 1.759 9.205 7.494 1.00 10.00 C ATOM 362 OG1 THR A 38 1.390 9.865 8.712 1.00 10.00 O ATOM 363 CG2 THR A 38 2.713 8.059 7.803 1.00 10.00 C ATOM 0 H THR A 38 0.605 11.286 6.694 1.00 10.00 H new ATOM 0 HA THR A 38 3.373 10.517 6.927 1.00 10.00 H new ATOM 0 HB THR A 38 0.874 8.791 7.012 1.00 10.00 H new ATOM 0 HG1 THR A 38 1.283 9.201 9.425 1.00 10.00 H new ATOM 0 HG21 THR A 38 2.231 7.358 8.484 1.00 10.00 H new ATOM 0 HG22 THR A 38 2.975 7.545 6.879 1.00 10.00 H new ATOM 0 HG23 THR A 38 3.617 8.453 8.268 1.00 10.00 H new ATOM 371 N PRO A 39 3.879 9.385 4.756 1.00 10.00 N ATOM 372 CA PRO A 39 4.221 8.770 3.468 1.00 10.00 C ATOM 373 C PRO A 39 3.565 7.403 3.283 1.00 10.00 C ATOM 374 O PRO A 39 3.612 6.552 4.177 1.00 10.00 O ATOM 375 CB PRO A 39 5.744 8.625 3.531 1.00 10.00 C ATOM 376 CG PRO A 39 6.187 9.658 4.508 1.00 10.00 C ATOM 377 CD PRO A 39 5.082 9.770 5.521 1.00 10.00 C ATOM 0 HA PRO A 39 3.871 9.371 2.628 1.00 10.00 H new ATOM 0 HB2 PRO A 39 6.033 7.625 3.855 1.00 10.00 H new ATOM 0 HB3 PRO A 39 6.197 8.786 2.553 1.00 10.00 H new ATOM 0 HG2 PRO A 39 7.124 9.369 4.983 1.00 10.00 H new ATOM 0 HG3 PRO A 39 6.362 10.614 4.014 1.00 10.00 H new ATOM 0 HD2 PRO A 39 5.247 9.108 6.371 1.00 10.00 H new ATOM 0 HD3 PRO A 39 5.000 10.782 5.917 1.00 10.00 H new ATOM 385 N LEU A 40 2.974 7.189 2.110 1.00 10.00 N ATOM 386 CA LEU A 40 2.293 5.934 1.804 1.00 10.00 C ATOM 387 C LEU A 40 3.280 4.777 1.670 1.00 10.00 C ATOM 388 O LEU A 40 2.884 3.610 1.630 1.00 10.00 O ATOM 389 CB LEU A 40 1.462 6.078 0.526 1.00 10.00 C ATOM 390 CG LEU A 40 0.259 7.021 0.640 1.00 10.00 C ATOM 391 CD1 LEU A 40 -0.384 7.235 -0.717 1.00 10.00 C ATOM 392 CD2 LEU A 40 -0.759 6.470 1.628 1.00 10.00 C ATOM 0 H LEU A 40 2.953 7.872 1.353 1.00 10.00 H new ATOM 0 HA LEU A 40 1.627 5.706 2.636 1.00 10.00 H new ATOM 0 HB2 LEU A 40 2.111 6.436 -0.273 1.00 10.00 H new ATOM 0 HB3 LEU A 40 1.105 5.092 0.229 1.00 10.00 H new ATOM 0 HG LEU A 40 0.614 7.984 1.008 1.00 10.00 H new ATOM 0 HD11 LEU A 40 -1.236 7.907 -0.614 1.00 10.00 H new ATOM 0 HD12 LEU A 40 0.344 7.674 -1.399 1.00 10.00 H new ATOM 0 HD13 LEU A 40 -0.723 6.278 -1.114 1.00 10.00 H new ATOM 0 HD21 LEU A 40 -1.606 7.152 1.696 1.00 10.00 H new ATOM 0 HD22 LEU A 40 -1.106 5.494 1.287 1.00 10.00 H new ATOM 0 HD23 LEU A 40 -0.295 6.368 2.609 1.00 10.00 H new ATOM 404 N SER A 41 4.565 5.103 1.614 1.00 10.00 N ATOM 405 CA SER A 41 5.609 4.097 1.506 1.00 10.00 C ATOM 406 C SER A 41 5.596 3.197 2.737 1.00 10.00 C ATOM 407 O SER A 41 5.739 1.977 2.637 1.00 10.00 O ATOM 408 CB SER A 41 6.965 4.782 1.361 1.00 10.00 C ATOM 409 OG SER A 41 6.838 6.182 1.556 1.00 10.00 O ATOM 0 H SER A 41 4.909 6.063 1.642 1.00 10.00 H new ATOM 0 HA SER A 41 5.428 3.481 0.626 1.00 10.00 H new ATOM 0 HB2 SER A 41 7.667 4.370 2.086 1.00 10.00 H new ATOM 0 HB3 SER A 41 7.376 4.582 0.371 1.00 10.00 H new ATOM 0 HG SER A 41 7.099 6.651 0.736 1.00 10.00 H new ATOM 415 N LYS A 42 5.397 3.807 3.900 1.00 10.00 N ATOM 416 CA LYS A 42 5.349 3.067 5.149 1.00 10.00 C ATOM 417 C LYS A 42 4.048 2.281 5.236 1.00 10.00 C ATOM 418 O LYS A 42 3.998 1.209 5.835 1.00 10.00 O ATOM 419 CB LYS A 42 5.494 4.015 6.339 1.00 10.00 C ATOM 420 CG LYS A 42 6.833 4.738 6.365 1.00 10.00 C ATOM 421 CD LYS A 42 7.019 5.558 7.633 1.00 10.00 C ATOM 422 CE LYS A 42 8.469 5.993 7.789 1.00 10.00 C ATOM 423 NZ LYS A 42 8.683 6.793 9.021 1.00 10.00 N ATOM 0 H LYS A 42 5.266 4.814 4.001 1.00 10.00 H new ATOM 0 HA LYS A 42 6.182 2.364 5.177 1.00 10.00 H new ATOM 0 HB2 LYS A 42 4.691 4.751 6.310 1.00 10.00 H new ATOM 0 HB3 LYS A 42 5.375 3.450 7.263 1.00 10.00 H new ATOM 0 HG2 LYS A 42 7.639 4.009 6.284 1.00 10.00 H new ATOM 0 HG3 LYS A 42 6.907 5.393 5.497 1.00 10.00 H new ATOM 0 HD2 LYS A 42 6.373 6.435 7.602 1.00 10.00 H new ATOM 0 HD3 LYS A 42 6.716 4.970 8.499 1.00 10.00 H new ATOM 0 HE2 LYS A 42 9.111 5.112 7.813 1.00 10.00 H new ATOM 0 HE3 LYS A 42 8.766 6.580 6.920 1.00 10.00 H new ATOM 0 HZ1 LYS A 42 8.927 7.770 8.762 1.00 10.00 H new ATOM 0 HZ2 LYS A 42 7.813 6.793 9.591 1.00 10.00 H new ATOM 0 HZ3 LYS A 42 9.459 6.377 9.574 1.00 10.00 H new ATOM 437 N LEU A 43 3.002 2.820 4.617 1.00 10.00 N ATOM 438 CA LEU A 43 1.698 2.166 4.593 1.00 10.00 C ATOM 439 C LEU A 43 1.806 0.853 3.823 1.00 10.00 C ATOM 440 O LEU A 43 1.320 -0.188 4.267 1.00 10.00 O ATOM 441 CB LEU A 43 0.657 3.092 3.942 1.00 10.00 C ATOM 442 CG LEU A 43 -0.746 2.501 3.752 1.00 10.00 C ATOM 443 CD1 LEU A 43 -1.805 3.563 4.007 1.00 10.00 C ATOM 444 CD2 LEU A 43 -0.908 1.932 2.348 1.00 10.00 C ATOM 0 H LEU A 43 3.033 3.712 4.123 1.00 10.00 H new ATOM 0 HA LEU A 43 1.376 1.954 5.613 1.00 10.00 H new ATOM 0 HB2 LEU A 43 0.571 3.992 4.550 1.00 10.00 H new ATOM 0 HB3 LEU A 43 1.034 3.401 2.967 1.00 10.00 H new ATOM 0 HG LEU A 43 -0.874 1.691 4.471 1.00 10.00 H new ATOM 0 HD11 LEU A 43 -2.796 3.130 3.869 1.00 10.00 H new ATOM 0 HD12 LEU A 43 -1.710 3.933 5.028 1.00 10.00 H new ATOM 0 HD13 LEU A 43 -1.669 4.388 3.308 1.00 10.00 H new ATOM 0 HD21 LEU A 43 -1.910 1.518 2.236 1.00 10.00 H new ATOM 0 HD22 LEU A 43 -0.759 2.725 1.615 1.00 10.00 H new ATOM 0 HD23 LEU A 43 -0.171 1.145 2.187 1.00 10.00 H new ATOM 456 N MET A 44 2.474 0.918 2.677 1.00 10.00 N ATOM 457 CA MET A 44 2.672 -0.251 1.831 1.00 10.00 C ATOM 458 C MET A 44 3.493 -1.305 2.561 1.00 10.00 C ATOM 459 O MET A 44 3.150 -2.486 2.556 1.00 10.00 O ATOM 460 CB MET A 44 3.372 0.142 0.526 1.00 10.00 C ATOM 461 CG MET A 44 2.538 1.043 -0.372 1.00 10.00 C ATOM 462 SD MET A 44 3.239 1.232 -2.024 1.00 10.00 S ATOM 463 CE MET A 44 4.718 2.178 -1.670 1.00 10.00 C ATOM 0 H MET A 44 2.890 1.775 2.311 1.00 10.00 H new ATOM 0 HA MET A 44 1.693 -0.668 1.594 1.00 10.00 H new ATOM 0 HB2 MET A 44 4.307 0.648 0.765 1.00 10.00 H new ATOM 0 HB3 MET A 44 3.631 -0.763 -0.023 1.00 10.00 H new ATOM 0 HG2 MET A 44 1.531 0.633 -0.455 1.00 10.00 H new ATOM 0 HG3 MET A 44 2.445 2.025 0.092 1.00 10.00 H new ATOM 0 HE1 MET A 44 5.336 2.235 -2.566 1.00 10.00 H new ATOM 0 HE2 MET A 44 4.440 3.184 -1.356 1.00 10.00 H new ATOM 0 HE3 MET A 44 5.279 1.691 -0.872 1.00 10.00 H new ATOM 473 N LYS A 45 4.569 -0.865 3.203 1.00 10.00 N ATOM 474 CA LYS A 45 5.442 -1.770 3.939 1.00 10.00 C ATOM 475 C LYS A 45 4.707 -2.413 5.109 1.00 10.00 C ATOM 476 O LYS A 45 4.812 -3.617 5.320 1.00 10.00 O ATOM 477 CB LYS A 45 6.686 -1.032 4.439 1.00 10.00 C ATOM 478 CG LYS A 45 7.699 -0.738 3.345 1.00 10.00 C ATOM 479 CD LYS A 45 9.042 -0.308 3.916 1.00 10.00 C ATOM 480 CE LYS A 45 8.972 1.071 4.549 1.00 10.00 C ATOM 481 NZ LYS A 45 10.300 1.521 5.043 1.00 10.00 N ATOM 0 H LYS A 45 4.857 0.113 3.228 1.00 10.00 H new ATOM 0 HA LYS A 45 5.753 -2.560 3.256 1.00 10.00 H new ATOM 0 HB2 LYS A 45 6.380 -0.093 4.901 1.00 10.00 H new ATOM 0 HB3 LYS A 45 7.165 -1.629 5.215 1.00 10.00 H new ATOM 0 HG2 LYS A 45 7.835 -1.626 2.728 1.00 10.00 H new ATOM 0 HG3 LYS A 45 7.313 0.047 2.694 1.00 10.00 H new ATOM 0 HD2 LYS A 45 9.369 -1.033 4.661 1.00 10.00 H new ATOM 0 HD3 LYS A 45 9.790 -0.306 3.123 1.00 10.00 H new ATOM 0 HE2 LYS A 45 8.594 1.787 3.819 1.00 10.00 H new ATOM 0 HE3 LYS A 45 8.263 1.055 5.377 1.00 10.00 H new ATOM 0 HZ1 LYS A 45 10.210 2.466 5.468 1.00 10.00 H new ATOM 0 HZ2 LYS A 45 10.649 0.852 5.758 1.00 10.00 H new ATOM 0 HZ3 LYS A 45 10.971 1.561 4.249 1.00 10.00 H new ATOM 495 N ALA A 46 3.956 -1.611 5.858 1.00 10.00 N ATOM 496 CA ALA A 46 3.213 -2.112 7.009 1.00 10.00 C ATOM 497 C ALA A 46 2.271 -3.246 6.613 1.00 10.00 C ATOM 498 O ALA A 46 2.203 -4.274 7.289 1.00 10.00 O ATOM 499 CB ALA A 46 2.440 -0.984 7.675 1.00 10.00 C ATOM 0 H ALA A 46 3.846 -0.611 5.688 1.00 10.00 H new ATOM 0 HA ALA A 46 3.933 -2.512 7.723 1.00 10.00 H new ATOM 0 HB1 ALA A 46 1.891 -1.375 8.532 1.00 10.00 H new ATOM 0 HB2 ALA A 46 3.136 -0.215 8.010 1.00 10.00 H new ATOM 0 HB3 ALA A 46 1.738 -0.553 6.961 1.00 10.00 H new ATOM 505 N TYR A 47 1.555 -3.062 5.509 1.00 10.00 N ATOM 506 CA TYR A 47 0.629 -4.077 5.031 1.00 10.00 C ATOM 507 C TYR A 47 1.394 -5.293 4.517 1.00 10.00 C ATOM 508 O TYR A 47 1.029 -6.435 4.795 1.00 10.00 O ATOM 509 CB TYR A 47 -0.266 -3.510 3.924 1.00 10.00 C ATOM 510 CG TYR A 47 -1.369 -4.453 3.492 1.00 10.00 C ATOM 511 CD1 TYR A 47 -1.394 -4.988 2.209 1.00 10.00 C ATOM 512 CD2 TYR A 47 -2.385 -4.809 4.371 1.00 10.00 C ATOM 513 CE1 TYR A 47 -2.400 -5.853 1.817 1.00 10.00 C ATOM 514 CE2 TYR A 47 -3.393 -5.673 3.985 1.00 10.00 C ATOM 515 CZ TYR A 47 -3.396 -6.190 2.707 1.00 10.00 C ATOM 516 OH TYR A 47 -4.398 -7.050 2.320 1.00 10.00 O ATOM 0 H TYR A 47 1.599 -2.222 4.932 1.00 10.00 H new ATOM 0 HA TYR A 47 -0.002 -4.386 5.864 1.00 10.00 H new ATOM 0 HB2 TYR A 47 -0.712 -2.578 4.271 1.00 10.00 H new ATOM 0 HB3 TYR A 47 0.351 -3.266 3.059 1.00 10.00 H new ATOM 0 HD1 TYR A 47 -0.616 -4.724 1.508 1.00 10.00 H new ATOM 0 HD2 TYR A 47 -2.387 -4.404 5.372 1.00 10.00 H new ATOM 0 HE1 TYR A 47 -2.404 -6.262 0.818 1.00 10.00 H new ATOM 0 HE2 TYR A 47 -4.174 -5.941 4.681 1.00 10.00 H new ATOM 0 HH TYR A 47 -5.020 -7.185 3.066 1.00 10.00 H new ATOM 526 N CYS A 48 2.473 -5.033 3.790 1.00 10.00 N ATOM 527 CA CYS A 48 3.300 -6.092 3.225 1.00 10.00 C ATOM 528 C CYS A 48 3.901 -6.962 4.327 1.00 10.00 C ATOM 529 O CYS A 48 3.954 -8.188 4.203 1.00 10.00 O ATOM 530 CB CYS A 48 4.414 -5.484 2.373 1.00 10.00 C ATOM 531 SG CYS A 48 5.093 -6.608 1.137 1.00 10.00 S ATOM 0 H CYS A 48 2.798 -4.090 3.576 1.00 10.00 H new ATOM 0 HA CYS A 48 2.669 -6.722 2.598 1.00 10.00 H new ATOM 0 HB2 CYS A 48 4.029 -4.597 1.869 1.00 10.00 H new ATOM 0 HB3 CYS A 48 5.219 -5.153 3.029 1.00 10.00 H new ATOM 0 HG CYS A 48 5.967 -7.391 1.696 1.00 10.00 H new ATOM 537 N GLU A 49 4.355 -6.319 5.399 1.00 10.00 N ATOM 538 CA GLU A 49 4.948 -7.022 6.531 1.00 10.00 C ATOM 539 C GLU A 49 3.949 -7.987 7.160 1.00 10.00 C ATOM 540 O GLU A 49 4.307 -9.103 7.533 1.00 10.00 O ATOM 541 CB GLU A 49 5.427 -6.024 7.589 1.00 10.00 C ATOM 542 CG GLU A 49 6.672 -5.249 7.189 1.00 10.00 C ATOM 543 CD GLU A 49 7.910 -6.114 7.118 1.00 10.00 C ATOM 544 OE1 GLU A 49 7.998 -7.102 7.875 1.00 10.00 O ATOM 545 OE2 GLU A 49 8.818 -5.794 6.325 1.00 10.00 O ATOM 0 H GLU A 49 4.323 -5.305 5.507 1.00 10.00 H new ATOM 0 HA GLU A 49 5.800 -7.591 6.159 1.00 10.00 H new ATOM 0 HB2 GLU A 49 4.623 -5.318 7.798 1.00 10.00 H new ATOM 0 HB3 GLU A 49 5.628 -6.561 8.516 1.00 10.00 H new ATOM 0 HG2 GLU A 49 6.506 -4.782 6.218 1.00 10.00 H new ATOM 0 HG3 GLU A 49 6.838 -4.445 7.906 1.00 10.00 H new ATOM 552 N ARG A 50 2.700 -7.553 7.254 1.00 10.00 N ATOM 553 CA ARG A 50 1.643 -8.365 7.845 1.00 10.00 C ATOM 554 C ARG A 50 1.317 -9.585 6.992 1.00 10.00 C ATOM 555 O ARG A 50 0.892 -10.619 7.506 1.00 10.00 O ATOM 556 CB ARG A 50 0.390 -7.521 8.049 1.00 10.00 C ATOM 557 CG ARG A 50 0.507 -6.543 9.203 1.00 10.00 C ATOM 558 CD ARG A 50 -0.525 -5.440 9.090 1.00 10.00 C ATOM 559 NE ARG A 50 -0.979 -4.967 10.396 1.00 10.00 N ATOM 560 CZ ARG A 50 -2.263 -4.837 10.725 1.00 10.00 C ATOM 561 NH1 ARG A 50 -3.209 -5.205 9.876 1.00 10.00 N ATOM 562 NH2 ARG A 50 -2.606 -4.364 11.915 1.00 10.00 N ATOM 0 H ARG A 50 2.392 -6.638 6.927 1.00 10.00 H new ATOM 0 HA ARG A 50 2.003 -8.724 8.809 1.00 10.00 H new ATOM 0 HB2 ARG A 50 0.179 -6.968 7.133 1.00 10.00 H new ATOM 0 HB3 ARG A 50 -0.459 -8.181 8.226 1.00 10.00 H new ATOM 0 HG2 ARG A 50 0.376 -7.072 10.147 1.00 10.00 H new ATOM 0 HG3 ARG A 50 1.507 -6.110 9.216 1.00 10.00 H new ATOM 0 HD2 ARG A 50 -0.101 -4.605 8.531 1.00 10.00 H new ATOM 0 HD3 ARG A 50 -1.380 -5.803 8.520 1.00 10.00 H new ATOM 0 HE ARG A 50 -0.275 -4.723 11.093 1.00 10.00 H new ATOM 0 HH11 ARG A 50 -2.956 -5.590 8.966 1.00 10.00 H new ATOM 0 HH12 ARG A 50 -4.191 -5.104 10.132 1.00 10.00 H new ATOM 0 HH21 ARG A 50 -1.885 -4.097 12.585 1.00 10.00 H new ATOM 0 HH22 ARG A 50 -3.591 -4.267 12.161 1.00 10.00 H new ATOM 576 N GLN A 51 1.512 -9.469 5.688 1.00 10.00 N ATOM 577 CA GLN A 51 1.239 -10.581 4.790 1.00 10.00 C ATOM 578 C GLN A 51 2.473 -11.469 4.665 1.00 10.00 C ATOM 579 O GLN A 51 2.412 -12.556 4.090 1.00 10.00 O ATOM 580 CB GLN A 51 0.794 -10.076 3.415 1.00 10.00 C ATOM 581 CG GLN A 51 -0.364 -9.086 3.471 1.00 10.00 C ATOM 582 CD GLN A 51 -1.527 -9.575 4.320 1.00 10.00 C ATOM 583 OE1 GLN A 51 -1.557 -9.367 5.532 1.00 10.00 O ATOM 584 NE2 GLN A 51 -2.496 -10.222 3.690 1.00 10.00 N ATOM 0 H GLN A 51 1.855 -8.624 5.230 1.00 10.00 H new ATOM 0 HA GLN A 51 0.424 -11.172 5.209 1.00 10.00 H new ATOM 0 HB2 GLN A 51 1.642 -9.602 2.920 1.00 10.00 H new ATOM 0 HB3 GLN A 51 0.502 -10.928 2.802 1.00 10.00 H new ATOM 0 HG2 GLN A 51 -0.004 -8.138 3.870 1.00 10.00 H new ATOM 0 HG3 GLN A 51 -0.718 -8.892 2.458 1.00 10.00 H new ATOM 0 HE21 GLN A 51 -2.436 -10.376 2.683 1.00 10.00 H new ATOM 0 HE22 GLN A 51 -3.302 -10.567 4.211 1.00 10.00 H new ATOM 593 N GLY A 52 3.587 -10.997 5.223 1.00 10.00 N ATOM 594 CA GLY A 52 4.831 -11.746 5.183 1.00 10.00 C ATOM 595 C GLY A 52 5.361 -11.917 3.775 1.00 10.00 C ATOM 596 O GLY A 52 5.858 -12.987 3.414 1.00 10.00 O ATOM 0 H GLY A 52 3.648 -10.101 5.706 1.00 10.00 H new ATOM 0 HA2 GLY A 52 5.579 -11.235 5.789 1.00 10.00 H new ATOM 0 HA3 GLY A 52 4.675 -12.728 5.630 1.00 10.00 H new ATOM 600 N LEU A 53 5.261 -10.865 2.979 1.00 10.00 N ATOM 601 CA LEU A 53 5.726 -10.910 1.601 1.00 10.00 C ATOM 602 C LEU A 53 6.679 -9.754 1.320 1.00 10.00 C ATOM 603 O LEU A 53 6.850 -8.862 2.155 1.00 10.00 O ATOM 604 CB LEU A 53 4.536 -10.862 0.635 1.00 10.00 C ATOM 605 CG LEU A 53 3.547 -12.023 0.763 1.00 10.00 C ATOM 606 CD1 LEU A 53 2.352 -11.805 -0.153 1.00 10.00 C ATOM 607 CD2 LEU A 53 4.231 -13.349 0.453 1.00 10.00 C ATOM 0 H LEU A 53 4.862 -9.970 3.262 1.00 10.00 H new ATOM 0 HA LEU A 53 6.263 -11.846 1.449 1.00 10.00 H new ATOM 0 HB2 LEU A 53 3.997 -9.928 0.793 1.00 10.00 H new ATOM 0 HB3 LEU A 53 4.918 -10.841 -0.386 1.00 10.00 H new ATOM 0 HG LEU A 53 3.189 -12.060 1.792 1.00 10.00 H new ATOM 0 HD11 LEU A 53 1.658 -12.639 -0.050 1.00 10.00 H new ATOM 0 HD12 LEU A 53 1.848 -10.878 0.121 1.00 10.00 H new ATOM 0 HD13 LEU A 53 2.693 -11.741 -1.186 1.00 10.00 H new ATOM 0 HD21 LEU A 53 3.511 -14.161 0.550 1.00 10.00 H new ATOM 0 HD22 LEU A 53 4.620 -13.328 -0.565 1.00 10.00 H new ATOM 0 HD23 LEU A 53 5.052 -13.507 1.152 1.00 10.00 H new ATOM 619 N SER A 54 7.296 -9.781 0.150 1.00 10.00 N ATOM 620 CA SER A 54 8.231 -8.741 -0.248 1.00 10.00 C ATOM 621 C SER A 54 7.481 -7.557 -0.849 1.00 10.00 C ATOM 622 O SER A 54 6.477 -7.738 -1.542 1.00 10.00 O ATOM 623 CB SER A 54 9.234 -9.299 -1.260 1.00 10.00 C ATOM 624 OG SER A 54 10.222 -8.341 -1.593 1.00 10.00 O ATOM 0 H SER A 54 7.165 -10.516 -0.545 1.00 10.00 H new ATOM 0 HA SER A 54 8.772 -8.399 0.634 1.00 10.00 H new ATOM 0 HB2 SER A 54 9.712 -10.188 -0.848 1.00 10.00 H new ATOM 0 HB3 SER A 54 8.708 -9.609 -2.163 1.00 10.00 H new ATOM 0 HG SER A 54 10.848 -8.728 -2.240 1.00 10.00 H new ATOM 630 N MET A 55 7.975 -6.350 -0.590 1.00 10.00 N ATOM 631 CA MET A 55 7.341 -5.135 -1.099 1.00 10.00 C ATOM 632 C MET A 55 7.384 -5.097 -2.625 1.00 10.00 C ATOM 633 O MET A 55 6.555 -4.457 -3.269 1.00 10.00 O ATOM 634 CB MET A 55 8.032 -3.895 -0.525 1.00 10.00 C ATOM 635 CG MET A 55 7.237 -2.612 -0.711 1.00 10.00 C ATOM 636 SD MET A 55 8.200 -1.132 -0.323 1.00 10.00 S ATOM 637 CE MET A 55 9.320 -1.080 -1.723 1.00 10.00 C ATOM 0 H MET A 55 8.812 -6.186 -0.031 1.00 10.00 H new ATOM 0 HA MET A 55 6.298 -5.139 -0.783 1.00 10.00 H new ATOM 0 HB2 MET A 55 8.212 -4.050 0.539 1.00 10.00 H new ATOM 0 HB3 MET A 55 9.007 -3.780 -1.000 1.00 10.00 H new ATOM 0 HG2 MET A 55 6.887 -2.553 -1.741 1.00 10.00 H new ATOM 0 HG3 MET A 55 6.352 -2.642 -0.075 1.00 10.00 H new ATOM 0 HE1 MET A 55 9.751 -0.083 -1.807 1.00 10.00 H new ATOM 0 HE2 MET A 55 10.117 -1.809 -1.578 1.00 10.00 H new ATOM 0 HE3 MET A 55 8.773 -1.317 -2.636 1.00 10.00 H new ATOM 647 N ARG A 56 8.346 -5.804 -3.201 1.00 10.00 N ATOM 648 CA ARG A 56 8.500 -5.853 -4.647 1.00 10.00 C ATOM 649 C ARG A 56 7.634 -6.958 -5.252 1.00 10.00 C ATOM 650 O ARG A 56 7.616 -7.147 -6.467 1.00 10.00 O ATOM 651 CB ARG A 56 9.968 -6.072 -5.012 1.00 10.00 C ATOM 652 CG ARG A 56 10.310 -5.715 -6.449 1.00 10.00 C ATOM 653 CD ARG A 56 11.788 -5.914 -6.721 1.00 10.00 C ATOM 654 NE ARG A 56 12.148 -5.597 -8.099 1.00 10.00 N ATOM 655 CZ ARG A 56 13.380 -5.277 -8.485 1.00 10.00 C ATOM 656 NH1 ARG A 56 14.358 -5.208 -7.589 1.00 10.00 N ATOM 657 NH2 ARG A 56 13.633 -5.020 -9.761 1.00 10.00 N ATOM 0 H ARG A 56 9.034 -6.354 -2.686 1.00 10.00 H new ATOM 0 HA ARG A 56 8.170 -4.899 -5.059 1.00 10.00 H new ATOM 0 HB2 ARG A 56 10.590 -5.477 -4.343 1.00 10.00 H new ATOM 0 HB3 ARG A 56 10.222 -7.118 -4.838 1.00 10.00 H new ATOM 0 HG2 ARG A 56 9.725 -6.333 -7.130 1.00 10.00 H new ATOM 0 HG3 ARG A 56 10.037 -4.678 -6.645 1.00 10.00 H new ATOM 0 HD2 ARG A 56 12.367 -5.286 -6.044 1.00 10.00 H new ATOM 0 HD3 ARG A 56 12.058 -6.948 -6.507 1.00 10.00 H new ATOM 0 HE ARG A 56 11.413 -5.622 -8.806 1.00 10.00 H new ATOM 0 HH11 ARG A 56 14.164 -5.400 -6.606 1.00 10.00 H new ATOM 0 HH12 ARG A 56 15.303 -4.963 -7.884 1.00 10.00 H new ATOM 0 HH21 ARG A 56 12.882 -5.067 -10.449 1.00 10.00 H new ATOM 0 HH22 ARG A 56 14.579 -4.775 -10.054 1.00 10.00 H new ATOM 671 N GLN A 57 6.892 -7.662 -4.409 1.00 10.00 N ATOM 672 CA GLN A 57 6.031 -8.740 -4.881 1.00 10.00 C ATOM 673 C GLN A 57 4.617 -8.230 -5.157 1.00 10.00 C ATOM 674 O GLN A 57 3.995 -8.602 -6.151 1.00 10.00 O ATOM 675 CB GLN A 57 5.992 -9.879 -3.860 1.00 10.00 C ATOM 676 CG GLN A 57 5.245 -11.107 -4.354 1.00 10.00 C ATOM 677 CD GLN A 57 5.059 -12.159 -3.278 1.00 10.00 C ATOM 678 OE1 GLN A 57 5.883 -12.299 -2.375 1.00 10.00 O ATOM 679 NE2 GLN A 57 3.969 -12.904 -3.370 1.00 10.00 N ATOM 0 H GLN A 57 6.868 -7.509 -3.401 1.00 10.00 H new ATOM 0 HA GLN A 57 6.446 -9.119 -5.815 1.00 10.00 H new ATOM 0 HB2 GLN A 57 7.013 -10.162 -3.604 1.00 10.00 H new ATOM 0 HB3 GLN A 57 5.521 -9.520 -2.945 1.00 10.00 H new ATOM 0 HG2 GLN A 57 4.268 -10.804 -4.731 1.00 10.00 H new ATOM 0 HG3 GLN A 57 5.789 -11.544 -5.192 1.00 10.00 H new ATOM 0 HE21 GLN A 57 3.312 -12.754 -4.136 1.00 10.00 H new ATOM 0 HE22 GLN A 57 3.786 -13.628 -2.675 1.00 10.00 H new ATOM 688 N ILE A 58 4.119 -7.364 -4.284 1.00 10.00 N ATOM 689 CA ILE A 58 2.775 -6.820 -4.441 1.00 10.00 C ATOM 690 C ILE A 58 2.812 -5.386 -4.961 1.00 10.00 C ATOM 691 O ILE A 58 3.846 -4.720 -4.906 1.00 10.00 O ATOM 692 CB ILE A 58 1.983 -6.862 -3.117 1.00 10.00 C ATOM 693 CG1 ILE A 58 2.782 -6.212 -1.983 1.00 10.00 C ATOM 694 CG2 ILE A 58 1.623 -8.299 -2.766 1.00 10.00 C ATOM 695 CD1 ILE A 58 2.006 -6.087 -0.687 1.00 10.00 C ATOM 0 H ILE A 58 4.622 -7.024 -3.464 1.00 10.00 H new ATOM 0 HA ILE A 58 2.269 -7.451 -5.172 1.00 10.00 H new ATOM 0 HB ILE A 58 1.062 -6.294 -3.247 1.00 10.00 H new ATOM 0 HG12 ILE A 58 3.683 -6.799 -1.802 1.00 10.00 H new ATOM 0 HG13 ILE A 58 3.106 -5.221 -2.300 1.00 10.00 H new ATOM 0 HG21 ILE A 58 1.065 -8.316 -1.830 1.00 10.00 H new ATOM 0 HG22 ILE A 58 1.012 -8.726 -3.561 1.00 10.00 H new ATOM 0 HG23 ILE A 58 2.535 -8.886 -2.655 1.00 10.00 H new ATOM 0 HD11 ILE A 58 2.635 -5.618 0.070 1.00 10.00 H new ATOM 0 HD12 ILE A 58 1.119 -5.475 -0.852 1.00 10.00 H new ATOM 0 HD13 ILE A 58 1.705 -7.078 -0.346 1.00 10.00 H new ATOM 707 N ARG A 59 1.684 -4.923 -5.484 1.00 10.00 N ATOM 708 CA ARG A 59 1.572 -3.569 -6.019 1.00 10.00 C ATOM 709 C ARG A 59 0.326 -2.896 -5.468 1.00 10.00 C ATOM 710 O ARG A 59 -0.714 -3.536 -5.320 1.00 10.00 O ATOM 711 CB ARG A 59 1.503 -3.586 -7.553 1.00 10.00 C ATOM 712 CG ARG A 59 2.741 -4.150 -8.229 1.00 10.00 C ATOM 713 CD ARG A 59 3.968 -3.294 -7.960 1.00 10.00 C ATOM 714 NE ARG A 59 5.155 -3.840 -8.612 1.00 10.00 N ATOM 715 CZ ARG A 59 5.897 -4.820 -8.104 1.00 10.00 C ATOM 716 NH1 ARG A 59 5.635 -5.304 -6.899 1.00 10.00 N ATOM 717 NH2 ARG A 59 6.916 -5.309 -8.796 1.00 10.00 N ATOM 0 H ARG A 59 0.825 -5.470 -5.550 1.00 10.00 H new ATOM 0 HA ARG A 59 2.458 -3.012 -5.715 1.00 10.00 H new ATOM 0 HB2 ARG A 59 0.637 -4.173 -7.859 1.00 10.00 H new ATOM 0 HB3 ARG A 59 1.341 -2.569 -7.909 1.00 10.00 H new ATOM 0 HG2 ARG A 59 2.920 -5.164 -7.873 1.00 10.00 H new ATOM 0 HG3 ARG A 59 2.571 -4.215 -9.304 1.00 10.00 H new ATOM 0 HD2 ARG A 59 3.790 -2.279 -8.316 1.00 10.00 H new ATOM 0 HD3 ARG A 59 4.139 -3.229 -6.885 1.00 10.00 H new ATOM 0 HE ARG A 59 5.432 -3.446 -9.511 1.00 10.00 H new ATOM 0 HH11 ARG A 59 4.860 -4.925 -6.355 1.00 10.00 H new ATOM 0 HH12 ARG A 59 6.208 -6.056 -6.516 1.00 10.00 H new ATOM 0 HH21 ARG A 59 7.132 -4.934 -9.720 1.00 10.00 H new ATOM 0 HH22 ARG A 59 7.484 -6.061 -8.405 1.00 10.00 H new ATOM 731 N PHE A 60 0.432 -1.611 -5.171 1.00 10.00 N ATOM 732 CA PHE A 60 -0.692 -0.855 -4.636 1.00 10.00 C ATOM 733 C PHE A 60 -1.278 0.065 -5.702 1.00 10.00 C ATOM 734 O PHE A 60 -0.550 0.789 -6.386 1.00 10.00 O ATOM 735 CB PHE A 60 -0.259 -0.041 -3.413 1.00 10.00 C ATOM 736 CG PHE A 60 -0.056 -0.875 -2.176 1.00 10.00 C ATOM 737 CD1 PHE A 60 0.979 -1.795 -2.104 1.00 10.00 C ATOM 738 CD2 PHE A 60 -0.896 -0.734 -1.084 1.00 10.00 C ATOM 739 CE1 PHE A 60 1.169 -2.558 -0.969 1.00 10.00 C ATOM 740 CE2 PHE A 60 -0.711 -1.496 0.056 1.00 10.00 C ATOM 741 CZ PHE A 60 0.324 -2.408 0.113 1.00 10.00 C ATOM 0 H PHE A 60 1.287 -1.067 -5.291 1.00 10.00 H new ATOM 0 HA PHE A 60 -1.462 -1.562 -4.328 1.00 10.00 H new ATOM 0 HB2 PHE A 60 0.669 0.482 -3.645 1.00 10.00 H new ATOM 0 HB3 PHE A 60 -1.012 0.720 -3.208 1.00 10.00 H new ATOM 0 HD1 PHE A 60 1.645 -1.916 -2.946 1.00 10.00 H new ATOM 0 HD2 PHE A 60 -1.706 -0.020 -1.123 1.00 10.00 H new ATOM 0 HE1 PHE A 60 1.978 -3.272 -0.927 1.00 10.00 H new ATOM 0 HE2 PHE A 60 -1.375 -1.378 0.900 1.00 10.00 H new ATOM 0 HZ PHE A 60 0.473 -3.003 1.002 1.00 10.00 H new ATOM 751 N ARG A 61 -2.594 0.027 -5.841 1.00 10.00 N ATOM 752 CA ARG A 61 -3.288 0.840 -6.827 1.00 10.00 C ATOM 753 C ARG A 61 -4.295 1.763 -6.148 1.00 10.00 C ATOM 754 O ARG A 61 -5.116 1.314 -5.348 1.00 10.00 O ATOM 755 CB ARG A 61 -4.008 -0.067 -7.829 1.00 10.00 C ATOM 756 CG ARG A 61 -4.146 0.528 -9.218 1.00 10.00 C ATOM 757 CD ARG A 61 -4.855 -0.436 -10.155 1.00 10.00 C ATOM 758 NE ARG A 61 -4.612 -0.121 -11.562 1.00 10.00 N ATOM 759 CZ ARG A 61 -4.537 -1.040 -12.527 1.00 10.00 C ATOM 760 NH1 ARG A 61 -4.721 -2.325 -12.243 1.00 10.00 N ATOM 761 NH2 ARG A 61 -4.289 -0.674 -13.777 1.00 10.00 N ATOM 0 H ARG A 61 -3.207 -0.563 -5.278 1.00 10.00 H new ATOM 0 HA ARG A 61 -2.556 1.453 -7.353 1.00 10.00 H new ATOM 0 HB2 ARG A 61 -3.467 -1.010 -7.902 1.00 10.00 H new ATOM 0 HB3 ARG A 61 -5.001 -0.298 -7.444 1.00 10.00 H new ATOM 0 HG2 ARG A 61 -4.703 1.463 -9.163 1.00 10.00 H new ATOM 0 HG3 ARG A 61 -3.159 0.767 -9.615 1.00 10.00 H new ATOM 0 HD2 ARG A 61 -4.519 -1.452 -9.949 1.00 10.00 H new ATOM 0 HD3 ARG A 61 -5.927 -0.408 -9.958 1.00 10.00 H new ATOM 0 HE ARG A 61 -4.493 0.858 -11.821 1.00 10.00 H new ATOM 0 HH11 ARG A 61 -4.920 -2.612 -11.285 1.00 10.00 H new ATOM 0 HH12 ARG A 61 -4.663 -3.024 -12.983 1.00 10.00 H new ATOM 0 HH21 ARG A 61 -4.155 0.312 -14.003 1.00 10.00 H new ATOM 0 HH22 ARG A 61 -4.232 -1.378 -14.513 1.00 10.00 H new ATOM 775 N PHE A 62 -4.226 3.047 -6.463 1.00 10.00 N ATOM 776 CA PHE A 62 -5.141 4.021 -5.887 1.00 10.00 C ATOM 777 C PHE A 62 -5.976 4.661 -6.984 1.00 10.00 C ATOM 778 O PHE A 62 -5.427 5.261 -7.912 1.00 10.00 O ATOM 779 CB PHE A 62 -4.375 5.099 -5.114 1.00 10.00 C ATOM 780 CG PHE A 62 -5.234 6.271 -4.717 1.00 10.00 C ATOM 781 CD1 PHE A 62 -6.249 6.119 -3.786 1.00 10.00 C ATOM 782 CD2 PHE A 62 -5.028 7.521 -5.280 1.00 10.00 C ATOM 783 CE1 PHE A 62 -7.048 7.190 -3.432 1.00 10.00 C ATOM 784 CE2 PHE A 62 -5.822 8.595 -4.928 1.00 10.00 C ATOM 785 CZ PHE A 62 -6.830 8.429 -4.000 1.00 10.00 C ATOM 0 H PHE A 62 -3.546 3.439 -7.114 1.00 10.00 H new ATOM 0 HA PHE A 62 -5.800 3.503 -5.190 1.00 10.00 H new ATOM 0 HB2 PHE A 62 -3.942 4.655 -4.218 1.00 10.00 H new ATOM 0 HB3 PHE A 62 -3.546 5.455 -5.726 1.00 10.00 H new ATOM 0 HD1 PHE A 62 -6.418 5.154 -3.332 1.00 10.00 H new ATOM 0 HD2 PHE A 62 -4.237 7.657 -6.003 1.00 10.00 H new ATOM 0 HE1 PHE A 62 -7.842 7.058 -2.712 1.00 10.00 H new ATOM 0 HE2 PHE A 62 -5.654 9.562 -5.378 1.00 10.00 H new ATOM 0 HZ PHE A 62 -7.448 9.269 -3.718 1.00 10.00 H new ATOM 795 N ASP A 63 -7.299 4.508 -6.871 1.00 10.00 N ATOM 796 CA ASP A 63 -8.264 5.054 -7.834 1.00 10.00 C ATOM 797 C ASP A 63 -8.171 4.348 -9.184 1.00 10.00 C ATOM 798 O ASP A 63 -9.154 3.789 -9.668 1.00 10.00 O ATOM 799 CB ASP A 63 -8.083 6.565 -8.012 1.00 10.00 C ATOM 800 CG ASP A 63 -9.157 7.176 -8.892 1.00 10.00 C ATOM 801 OD1 ASP A 63 -10.354 6.983 -8.597 1.00 10.00 O ATOM 802 OD2 ASP A 63 -8.809 7.856 -9.876 1.00 10.00 O ATOM 0 H ASP A 63 -7.735 3.998 -6.103 1.00 10.00 H new ATOM 0 HA ASP A 63 -9.258 4.874 -7.424 1.00 10.00 H new ATOM 0 HB2 ASP A 63 -8.099 7.048 -7.035 1.00 10.00 H new ATOM 0 HB3 ASP A 63 -7.104 6.762 -8.448 1.00 10.00 H new ATOM 807 N GLY A 64 -6.989 4.364 -9.774 1.00 10.00 N ATOM 808 CA GLY A 64 -6.781 3.729 -11.055 1.00 10.00 C ATOM 809 C GLY A 64 -5.309 3.575 -11.375 1.00 10.00 C ATOM 810 O GLY A 64 -4.911 2.637 -12.063 1.00 10.00 O ATOM 0 H GLY A 64 -6.160 4.811 -9.383 1.00 10.00 H new ATOM 0 HA2 GLY A 64 -7.258 2.749 -11.056 1.00 10.00 H new ATOM 0 HA3 GLY A 64 -7.263 4.318 -11.835 1.00 10.00 H new ATOM 814 N GLN A 65 -4.497 4.483 -10.854 1.00 10.00 N ATOM 815 CA GLN A 65 -3.060 4.455 -11.098 1.00 10.00 C ATOM 816 C GLN A 65 -2.308 3.902 -9.886 1.00 10.00 C ATOM 817 O GLN A 65 -2.810 3.950 -8.762 1.00 10.00 O ATOM 818 CB GLN A 65 -2.566 5.867 -11.423 1.00 10.00 C ATOM 819 CG GLN A 65 -3.116 6.413 -12.729 1.00 10.00 C ATOM 820 CD GLN A 65 -2.408 5.847 -13.943 1.00 10.00 C ATOM 821 OE1 GLN A 65 -2.787 4.803 -14.477 1.00 10.00 O ATOM 822 NE2 GLN A 65 -1.368 6.533 -14.385 1.00 10.00 N ATOM 0 H GLN A 65 -4.808 5.250 -10.258 1.00 10.00 H new ATOM 0 HA GLN A 65 -2.866 3.797 -11.945 1.00 10.00 H new ATOM 0 HB2 GLN A 65 -2.846 6.538 -10.611 1.00 10.00 H new ATOM 0 HB3 GLN A 65 -1.477 5.861 -11.470 1.00 10.00 H new ATOM 0 HG2 GLN A 65 -4.180 6.184 -12.794 1.00 10.00 H new ATOM 0 HG3 GLN A 65 -3.022 7.499 -12.732 1.00 10.00 H new ATOM 0 HE21 GLN A 65 -1.087 7.393 -13.914 1.00 10.00 H new ATOM 0 HE22 GLN A 65 -0.847 6.202 -15.197 1.00 10.00 H new ATOM 831 N PRO A 66 -1.105 3.337 -10.099 1.00 10.00 N ATOM 832 CA PRO A 66 -0.282 2.790 -9.016 1.00 10.00 C ATOM 833 C PRO A 66 0.309 3.891 -8.138 1.00 10.00 C ATOM 834 O PRO A 66 0.610 4.985 -8.622 1.00 10.00 O ATOM 835 CB PRO A 66 0.842 2.033 -9.746 1.00 10.00 C ATOM 836 CG PRO A 66 0.417 1.969 -11.178 1.00 10.00 C ATOM 837 CD PRO A 66 -0.456 3.166 -11.406 1.00 10.00 C ATOM 0 HA PRO A 66 -0.865 2.158 -8.346 1.00 10.00 H new ATOM 0 HB2 PRO A 66 1.795 2.551 -9.643 1.00 10.00 H new ATOM 0 HB3 PRO A 66 0.976 1.034 -9.331 1.00 10.00 H new ATOM 0 HG2 PRO A 66 1.281 1.985 -11.842 1.00 10.00 H new ATOM 0 HG3 PRO A 66 -0.126 1.046 -11.383 1.00 10.00 H new ATOM 0 HD2 PRO A 66 0.124 4.044 -11.689 1.00 10.00 H new ATOM 0 HD3 PRO A 66 -1.182 2.994 -12.201 1.00 10.00 H new ATOM 845 N ILE A 67 0.483 3.592 -6.859 1.00 10.00 N ATOM 846 CA ILE A 67 1.031 4.555 -5.909 1.00 10.00 C ATOM 847 C ILE A 67 2.558 4.545 -5.940 1.00 10.00 C ATOM 848 O ILE A 67 3.173 3.503 -6.172 1.00 10.00 O ATOM 849 CB ILE A 67 0.551 4.250 -4.472 1.00 10.00 C ATOM 850 CG1 ILE A 67 -0.963 4.028 -4.452 1.00 10.00 C ATOM 851 CG2 ILE A 67 0.936 5.381 -3.526 1.00 10.00 C ATOM 852 CD1 ILE A 67 -1.509 3.669 -3.085 1.00 10.00 C ATOM 0 H ILE A 67 0.252 2.686 -6.452 1.00 10.00 H new ATOM 0 HA ILE A 67 0.673 5.541 -6.204 1.00 10.00 H new ATOM 0 HB ILE A 67 1.040 3.337 -4.132 1.00 10.00 H new ATOM 0 HG12 ILE A 67 -1.458 4.932 -4.805 1.00 10.00 H new ATOM 0 HG13 ILE A 67 -1.214 3.233 -5.154 1.00 10.00 H new ATOM 0 HG21 ILE A 67 0.589 5.147 -2.519 1.00 10.00 H new ATOM 0 HG22 ILE A 67 2.020 5.496 -3.519 1.00 10.00 H new ATOM 0 HG23 ILE A 67 0.475 6.310 -3.862 1.00 10.00 H new ATOM 0 HD11 ILE A 67 -2.588 3.527 -3.150 1.00 10.00 H new ATOM 0 HD12 ILE A 67 -1.042 2.748 -2.737 1.00 10.00 H new ATOM 0 HD13 ILE A 67 -1.291 4.474 -2.383 1.00 10.00 H new ATOM 864 N ASN A 68 3.162 5.707 -5.724 1.00 10.00 N ATOM 865 CA ASN A 68 4.611 5.823 -5.712 1.00 10.00 C ATOM 866 C ASN A 68 5.108 5.850 -4.273 1.00 10.00 C ATOM 867 O ASN A 68 4.316 5.999 -3.340 1.00 10.00 O ATOM 868 CB ASN A 68 5.065 7.088 -6.451 1.00 10.00 C ATOM 869 CG ASN A 68 4.441 7.219 -7.829 1.00 10.00 C ATOM 870 OD1 ASN A 68 4.949 6.682 -8.814 1.00 10.00 O ATOM 871 ND2 ASN A 68 3.325 7.930 -7.905 1.00 10.00 N ATOM 0 H ASN A 68 2.668 6.583 -5.555 1.00 10.00 H new ATOM 0 HA ASN A 68 5.034 4.960 -6.227 1.00 10.00 H new ATOM 0 HB2 ASN A 68 4.807 7.964 -5.855 1.00 10.00 H new ATOM 0 HB3 ASN A 68 6.151 7.077 -6.548 1.00 10.00 H new ATOM 0 HD21 ASN A 68 2.856 8.048 -8.803 1.00 10.00 H new ATOM 0 HD22 ASN A 68 2.936 8.359 -7.066 1.00 10.00 H new ATOM 878 N GLU A 69 6.415 5.717 -4.087 1.00 10.00 N ATOM 879 CA GLU A 69 6.991 5.710 -2.747 1.00 10.00 C ATOM 880 C GLU A 69 6.981 7.100 -2.121 1.00 10.00 C ATOM 881 O GLU A 69 6.878 7.237 -0.903 1.00 10.00 O ATOM 882 CB GLU A 69 8.416 5.159 -2.778 1.00 10.00 C ATOM 883 CG GLU A 69 8.480 3.653 -2.969 1.00 10.00 C ATOM 884 CD GLU A 69 9.832 3.087 -2.596 1.00 10.00 C ATOM 885 OE1 GLU A 69 9.951 2.481 -1.513 1.00 10.00 O ATOM 886 OE2 GLU A 69 10.790 3.263 -3.375 1.00 10.00 O ATOM 0 H GLU A 69 7.093 5.613 -4.842 1.00 10.00 H new ATOM 0 HA GLU A 69 6.371 5.060 -2.130 1.00 10.00 H new ATOM 0 HB2 GLU A 69 8.967 5.643 -3.584 1.00 10.00 H new ATOM 0 HB3 GLU A 69 8.919 5.421 -1.847 1.00 10.00 H new ATOM 0 HG2 GLU A 69 7.709 3.178 -2.362 1.00 10.00 H new ATOM 0 HG3 GLU A 69 8.261 3.411 -4.009 1.00 10.00 H new ATOM 893 N THR A 70 7.073 8.130 -2.947 1.00 10.00 N ATOM 894 CA THR A 70 7.078 9.497 -2.449 1.00 10.00 C ATOM 895 C THR A 70 5.684 10.117 -2.519 1.00 10.00 C ATOM 896 O THR A 70 5.529 11.305 -2.801 1.00 10.00 O ATOM 897 CB THR A 70 8.071 10.367 -3.239 1.00 10.00 C ATOM 898 OG1 THR A 70 9.148 9.551 -3.715 1.00 10.00 O ATOM 899 CG2 THR A 70 8.626 11.485 -2.370 1.00 10.00 C ATOM 0 H THR A 70 7.145 8.047 -3.961 1.00 10.00 H new ATOM 0 HA THR A 70 7.391 9.460 -1.406 1.00 10.00 H new ATOM 0 HB THR A 70 7.544 10.815 -4.081 1.00 10.00 H new ATOM 0 HG1 THR A 70 9.780 10.105 -4.220 1.00 10.00 H new ATOM 0 HG21 THR A 70 9.325 12.085 -2.952 1.00 10.00 H new ATOM 0 HG22 THR A 70 7.808 12.116 -2.023 1.00 10.00 H new ATOM 0 HG23 THR A 70 9.143 11.056 -1.512 1.00 10.00 H new ATOM 907 N ASP A 71 4.672 9.304 -2.263 1.00 10.00 N ATOM 908 CA ASP A 71 3.295 9.774 -2.292 1.00 10.00 C ATOM 909 C ASP A 71 2.721 9.842 -0.884 1.00 10.00 C ATOM 910 O ASP A 71 3.083 9.046 -0.013 1.00 10.00 O ATOM 911 CB ASP A 71 2.423 8.862 -3.156 1.00 10.00 C ATOM 912 CG ASP A 71 2.320 9.333 -4.593 1.00 10.00 C ATOM 913 OD1 ASP A 71 2.222 10.558 -4.820 1.00 10.00 O ATOM 914 OD2 ASP A 71 2.331 8.478 -5.503 1.00 10.00 O ATOM 0 H ASP A 71 4.777 8.316 -2.033 1.00 10.00 H new ATOM 0 HA ASP A 71 3.296 10.774 -2.726 1.00 10.00 H new ATOM 0 HB2 ASP A 71 2.833 7.852 -3.138 1.00 10.00 H new ATOM 0 HB3 ASP A 71 1.424 8.808 -2.724 1.00 10.00 H new ATOM 919 N THR A 72 1.839 10.802 -0.663 1.00 10.00 N ATOM 920 CA THR A 72 1.190 10.979 0.625 1.00 10.00 C ATOM 921 C THR A 72 -0.317 11.110 0.420 1.00 10.00 C ATOM 922 O THR A 72 -0.760 11.433 -0.685 1.00 10.00 O ATOM 923 CB THR A 72 1.724 12.233 1.352 1.00 10.00 C ATOM 924 OG1 THR A 72 1.958 13.286 0.412 1.00 10.00 O ATOM 925 CG2 THR A 72 3.011 11.929 2.102 1.00 10.00 C ATOM 0 H THR A 72 1.553 11.479 -1.370 1.00 10.00 H new ATOM 0 HA THR A 72 1.409 10.108 1.243 1.00 10.00 H new ATOM 0 HB THR A 72 0.969 12.546 2.073 1.00 10.00 H new ATOM 0 HG1 THR A 72 1.294 13.995 0.543 1.00 10.00 H new ATOM 0 HG21 THR A 72 3.362 12.831 2.603 1.00 10.00 H new ATOM 0 HG22 THR A 72 2.825 11.151 2.843 1.00 10.00 H new ATOM 0 HG23 THR A 72 3.770 11.586 1.399 1.00 10.00 H new ATOM 933 N PRO A 73 -1.128 10.849 1.462 1.00 10.00 N ATOM 934 CA PRO A 73 -2.588 10.956 1.365 1.00 10.00 C ATOM 935 C PRO A 73 -3.027 12.326 0.854 1.00 10.00 C ATOM 936 O PRO A 73 -3.888 12.430 -0.018 1.00 10.00 O ATOM 937 CB PRO A 73 -3.062 10.742 2.807 1.00 10.00 C ATOM 938 CG PRO A 73 -1.978 9.950 3.448 1.00 10.00 C ATOM 939 CD PRO A 73 -0.698 10.409 2.806 1.00 10.00 C ATOM 0 HA PRO A 73 -3.006 10.238 0.660 1.00 10.00 H new ATOM 0 HB2 PRO A 73 -3.214 11.692 3.319 1.00 10.00 H new ATOM 0 HB3 PRO A 73 -4.012 10.209 2.836 1.00 10.00 H new ATOM 0 HG2 PRO A 73 -1.957 10.117 4.525 1.00 10.00 H new ATOM 0 HG3 PRO A 73 -2.131 8.882 3.294 1.00 10.00 H new ATOM 0 HD2 PRO A 73 -0.236 11.222 3.366 1.00 10.00 H new ATOM 0 HD3 PRO A 73 0.035 9.604 2.750 1.00 10.00 H new ATOM 947 N ALA A 74 -2.411 13.372 1.386 1.00 10.00 N ATOM 948 CA ALA A 74 -2.734 14.733 0.984 1.00 10.00 C ATOM 949 C ALA A 74 -2.264 15.020 -0.441 1.00 10.00 C ATOM 950 O ALA A 74 -2.884 15.799 -1.163 1.00 10.00 O ATOM 951 CB ALA A 74 -2.112 15.722 1.955 1.00 10.00 C ATOM 0 H ALA A 74 -1.684 13.304 2.098 1.00 10.00 H new ATOM 0 HA ALA A 74 -3.818 14.844 1.004 1.00 10.00 H new ATOM 0 HB1 ALA A 74 -2.358 16.738 1.647 1.00 10.00 H new ATOM 0 HB2 ALA A 74 -2.501 15.542 2.957 1.00 10.00 H new ATOM 0 HB3 ALA A 74 -1.029 15.596 1.959 1.00 10.00 H new ATOM 957 N GLN A 75 -1.179 14.372 -0.848 1.00 10.00 N ATOM 958 CA GLN A 75 -0.619 14.569 -2.181 1.00 10.00 C ATOM 959 C GLN A 75 -1.557 14.041 -3.259 1.00 10.00 C ATOM 960 O GLN A 75 -1.767 14.685 -4.284 1.00 10.00 O ATOM 961 CB GLN A 75 0.736 13.870 -2.292 1.00 10.00 C ATOM 962 CG GLN A 75 1.535 14.263 -3.522 1.00 10.00 C ATOM 963 CD GLN A 75 1.863 15.742 -3.560 1.00 10.00 C ATOM 964 OE1 GLN A 75 1.961 16.400 -2.521 1.00 10.00 O ATOM 965 NE2 GLN A 75 2.034 16.274 -4.756 1.00 10.00 N ATOM 0 H GLN A 75 -0.667 13.703 -0.272 1.00 10.00 H new ATOM 0 HA GLN A 75 -0.490 15.641 -2.333 1.00 10.00 H new ATOM 0 HB2 GLN A 75 1.324 14.096 -1.402 1.00 10.00 H new ATOM 0 HB3 GLN A 75 0.577 12.792 -2.304 1.00 10.00 H new ATOM 0 HG2 GLN A 75 2.461 13.689 -3.547 1.00 10.00 H new ATOM 0 HG3 GLN A 75 0.971 13.997 -4.416 1.00 10.00 H new ATOM 0 HE21 GLN A 75 1.944 15.694 -5.590 1.00 10.00 H new ATOM 0 HE22 GLN A 75 2.256 17.265 -4.846 1.00 10.00 H new ATOM 974 N LEU A 76 -2.134 12.877 -3.012 1.00 10.00 N ATOM 975 CA LEU A 76 -3.033 12.256 -3.973 1.00 10.00 C ATOM 976 C LEU A 76 -4.486 12.672 -3.752 1.00 10.00 C ATOM 977 O LEU A 76 -5.394 12.081 -4.338 1.00 10.00 O ATOM 978 CB LEU A 76 -2.910 10.733 -3.895 1.00 10.00 C ATOM 979 CG LEU A 76 -1.553 10.160 -4.312 1.00 10.00 C ATOM 980 CD1 LEU A 76 -1.481 8.680 -3.981 1.00 10.00 C ATOM 981 CD2 LEU A 76 -1.316 10.383 -5.798 1.00 10.00 C ATOM 0 H LEU A 76 -1.997 12.342 -2.154 1.00 10.00 H new ATOM 0 HA LEU A 76 -2.740 12.599 -4.965 1.00 10.00 H new ATOM 0 HB2 LEU A 76 -3.118 10.421 -2.871 1.00 10.00 H new ATOM 0 HB3 LEU A 76 -3.681 10.291 -4.526 1.00 10.00 H new ATOM 0 HG LEU A 76 -0.772 10.679 -3.756 1.00 10.00 H new ATOM 0 HD11 LEU A 76 -0.511 8.286 -4.283 1.00 10.00 H new ATOM 0 HD12 LEU A 76 -1.611 8.540 -2.908 1.00 10.00 H new ATOM 0 HD13 LEU A 76 -2.270 8.149 -4.514 1.00 10.00 H new ATOM 0 HD21 LEU A 76 -0.347 9.970 -6.078 1.00 10.00 H new ATOM 0 HD22 LEU A 76 -2.101 9.888 -6.370 1.00 10.00 H new ATOM 0 HD23 LEU A 76 -1.330 11.452 -6.012 1.00 10.00 H new ATOM 993 N GLU A 77 -4.697 13.686 -2.913 1.00 10.00 N ATOM 994 CA GLU A 77 -6.043 14.183 -2.614 1.00 10.00 C ATOM 995 C GLU A 77 -6.934 13.064 -2.075 1.00 10.00 C ATOM 996 O GLU A 77 -8.117 12.975 -2.408 1.00 10.00 O ATOM 997 CB GLU A 77 -6.678 14.809 -3.864 1.00 10.00 C ATOM 998 CG GLU A 77 -6.147 16.197 -4.191 1.00 10.00 C ATOM 999 CD GLU A 77 -6.866 17.291 -3.428 1.00 10.00 C ATOM 1000 OE1 GLU A 77 -7.873 17.819 -3.947 1.00 10.00 O ATOM 1001 OE2 GLU A 77 -6.426 17.636 -2.312 1.00 10.00 O ATOM 0 H GLU A 77 -3.951 14.182 -2.426 1.00 10.00 H new ATOM 0 HA GLU A 77 -5.953 14.950 -1.845 1.00 10.00 H new ATOM 0 HB2 GLU A 77 -6.503 14.153 -4.717 1.00 10.00 H new ATOM 0 HB3 GLU A 77 -7.757 14.867 -3.722 1.00 10.00 H new ATOM 0 HG2 GLU A 77 -5.082 16.238 -3.961 1.00 10.00 H new ATOM 0 HG3 GLU A 77 -6.249 16.378 -5.261 1.00 10.00 H new ATOM 1008 N MET A 78 -6.355 12.210 -1.244 1.00 10.00 N ATOM 1009 CA MET A 78 -7.092 11.101 -0.657 1.00 10.00 C ATOM 1010 C MET A 78 -7.903 11.599 0.524 1.00 10.00 C ATOM 1011 O MET A 78 -7.402 12.365 1.351 1.00 10.00 O ATOM 1012 CB MET A 78 -6.142 9.993 -0.196 1.00 10.00 C ATOM 1013 CG MET A 78 -5.128 9.581 -1.246 1.00 10.00 C ATOM 1014 SD MET A 78 -3.921 8.392 -0.630 1.00 10.00 S ATOM 1015 CE MET A 78 -4.945 6.934 -0.462 1.00 10.00 C ATOM 0 H MET A 78 -5.377 12.264 -0.961 1.00 10.00 H new ATOM 0 HA MET A 78 -7.757 10.690 -1.416 1.00 10.00 H new ATOM 0 HB2 MET A 78 -5.612 10.329 0.695 1.00 10.00 H new ATOM 0 HB3 MET A 78 -6.729 9.120 0.092 1.00 10.00 H new ATOM 0 HG2 MET A 78 -5.651 9.150 -2.100 1.00 10.00 H new ATOM 0 HG3 MET A 78 -4.606 10.467 -1.606 1.00 10.00 H new ATOM 0 HE1 MET A 78 -4.958 6.617 0.581 1.00 10.00 H new ATOM 0 HE2 MET A 78 -5.961 7.164 -0.784 1.00 10.00 H new ATOM 0 HE3 MET A 78 -4.541 6.132 -1.080 1.00 10.00 H new ATOM 1025 N GLU A 79 -9.150 11.180 0.600 1.00 10.00 N ATOM 1026 CA GLU A 79 -10.009 11.594 1.691 1.00 10.00 C ATOM 1027 C GLU A 79 -10.307 10.429 2.620 1.00 10.00 C ATOM 1028 O GLU A 79 -9.884 9.299 2.376 1.00 10.00 O ATOM 1029 CB GLU A 79 -11.306 12.202 1.159 1.00 10.00 C ATOM 1030 CG GLU A 79 -11.184 13.680 0.824 1.00 10.00 C ATOM 1031 CD GLU A 79 -10.565 14.482 1.954 1.00 10.00 C ATOM 1032 OE1 GLU A 79 -10.735 14.100 3.134 1.00 10.00 O ATOM 1033 OE2 GLU A 79 -9.909 15.508 1.675 1.00 10.00 O ATOM 0 H GLU A 79 -9.590 10.556 -0.077 1.00 10.00 H new ATOM 0 HA GLU A 79 -9.481 12.358 2.262 1.00 10.00 H new ATOM 0 HB2 GLU A 79 -11.614 11.658 0.266 1.00 10.00 H new ATOM 0 HB3 GLU A 79 -12.093 12.068 1.901 1.00 10.00 H new ATOM 0 HG2 GLU A 79 -10.578 13.797 -0.075 1.00 10.00 H new ATOM 0 HG3 GLU A 79 -12.172 14.081 0.597 1.00 10.00 H new ATOM 1040 N ASP A 80 -11.030 10.722 3.688 1.00 10.00 N ATOM 1041 CA ASP A 80 -11.385 9.718 4.681 1.00 10.00 C ATOM 1042 C ASP A 80 -12.307 8.659 4.084 1.00 10.00 C ATOM 1043 O ASP A 80 -13.124 8.966 3.214 1.00 10.00 O ATOM 1044 CB ASP A 80 -12.066 10.396 5.873 1.00 10.00 C ATOM 1045 CG ASP A 80 -11.664 9.789 7.200 1.00 10.00 C ATOM 1046 OD1 ASP A 80 -11.870 10.445 8.245 1.00 10.00 O ATOM 1047 OD2 ASP A 80 -11.137 8.662 7.204 1.00 10.00 O ATOM 0 H ASP A 80 -11.386 11.656 3.892 1.00 10.00 H new ATOM 0 HA ASP A 80 -10.474 9.222 5.015 1.00 10.00 H new ATOM 0 HB2 ASP A 80 -11.816 11.457 5.873 1.00 10.00 H new ATOM 0 HB3 ASP A 80 -13.147 10.323 5.758 1.00 10.00 H new ATOM 1052 N GLU A 81 -12.149 7.416 4.546 1.00 10.00 N ATOM 1053 CA GLU A 81 -12.962 6.279 4.095 1.00 10.00 C ATOM 1054 C GLU A 81 -12.631 5.863 2.658 1.00 10.00 C ATOM 1055 O GLU A 81 -13.445 5.215 1.994 1.00 10.00 O ATOM 1056 CB GLU A 81 -14.459 6.591 4.216 1.00 10.00 C ATOM 1057 CG GLU A 81 -14.939 6.764 5.650 1.00 10.00 C ATOM 1058 CD GLU A 81 -15.397 5.464 6.277 1.00 10.00 C ATOM 1059 OE1 GLU A 81 -15.313 5.336 7.516 1.00 10.00 O ATOM 1060 OE2 GLU A 81 -15.852 4.565 5.539 1.00 10.00 O ATOM 0 H GLU A 81 -11.451 7.167 5.247 1.00 10.00 H new ATOM 0 HA GLU A 81 -12.717 5.442 4.749 1.00 10.00 H new ATOM 0 HB2 GLU A 81 -14.677 7.502 3.658 1.00 10.00 H new ATOM 0 HB3 GLU A 81 -15.027 5.787 3.748 1.00 10.00 H new ATOM 0 HG2 GLU A 81 -14.133 7.187 6.249 1.00 10.00 H new ATOM 0 HG3 GLU A 81 -15.760 7.480 5.669 1.00 10.00 H new ATOM 1067 N ASP A 82 -11.440 6.213 2.182 1.00 10.00 N ATOM 1068 CA ASP A 82 -11.032 5.852 0.823 1.00 10.00 C ATOM 1069 C ASP A 82 -10.638 4.376 0.764 1.00 10.00 C ATOM 1070 O ASP A 82 -10.530 3.717 1.799 1.00 10.00 O ATOM 1071 CB ASP A 82 -9.870 6.724 0.348 1.00 10.00 C ATOM 1072 CG ASP A 82 -9.924 6.995 -1.146 1.00 10.00 C ATOM 1073 OD1 ASP A 82 -10.317 6.086 -1.913 1.00 10.00 O ATOM 1074 OD2 ASP A 82 -9.579 8.121 -1.554 1.00 10.00 O ATOM 0 H ASP A 82 -10.744 6.741 2.709 1.00 10.00 H new ATOM 0 HA ASP A 82 -11.880 6.022 0.159 1.00 10.00 H new ATOM 0 HB2 ASP A 82 -9.886 7.671 0.887 1.00 10.00 H new ATOM 0 HB3 ASP A 82 -8.928 6.234 0.592 1.00 10.00 H new ATOM 1079 N THR A 83 -10.410 3.862 -0.437 1.00 10.00 N ATOM 1080 CA THR A 83 -10.058 2.457 -0.610 1.00 10.00 C ATOM 1081 C THR A 83 -8.875 2.276 -1.563 1.00 10.00 C ATOM 1082 O THR A 83 -8.829 2.872 -2.639 1.00 10.00 O ATOM 1083 CB THR A 83 -11.265 1.659 -1.142 1.00 10.00 C ATOM 1084 OG1 THR A 83 -12.474 2.193 -0.582 1.00 10.00 O ATOM 1085 CG2 THR A 83 -11.147 0.181 -0.789 1.00 10.00 C ATOM 0 H THR A 83 -10.462 4.395 -1.305 1.00 10.00 H new ATOM 0 HA THR A 83 -9.768 2.079 0.371 1.00 10.00 H new ATOM 0 HB THR A 83 -11.285 1.749 -2.228 1.00 10.00 H new ATOM 0 HG1 THR A 83 -13.242 1.688 -0.921 1.00 10.00 H new ATOM 0 HG21 THR A 83 -12.012 -0.356 -1.177 1.00 10.00 H new ATOM 0 HG22 THR A 83 -10.238 -0.227 -1.231 1.00 10.00 H new ATOM 0 HG23 THR A 83 -11.106 0.068 0.294 1.00 10.00 H new ATOM 1093 N ILE A 84 -7.920 1.452 -1.148 1.00 10.00 N ATOM 1094 CA ILE A 84 -6.739 1.157 -1.946 1.00 10.00 C ATOM 1095 C ILE A 84 -6.757 -0.319 -2.343 1.00 10.00 C ATOM 1096 O ILE A 84 -7.218 -1.164 -1.570 1.00 10.00 O ATOM 1097 CB ILE A 84 -5.437 1.467 -1.168 1.00 10.00 C ATOM 1098 CG1 ILE A 84 -5.492 2.877 -0.567 1.00 10.00 C ATOM 1099 CG2 ILE A 84 -4.222 1.321 -2.075 1.00 10.00 C ATOM 1100 CD1 ILE A 84 -4.355 3.176 0.389 1.00 10.00 C ATOM 0 H ILE A 84 -7.944 0.970 -0.249 1.00 10.00 H new ATOM 0 HA ILE A 84 -6.759 1.789 -2.834 1.00 10.00 H new ATOM 0 HB ILE A 84 -5.346 0.748 -0.354 1.00 10.00 H new ATOM 0 HG12 ILE A 84 -5.477 3.608 -1.375 1.00 10.00 H new ATOM 0 HG13 ILE A 84 -6.439 3.002 -0.042 1.00 10.00 H new ATOM 0 HG21 ILE A 84 -3.317 1.543 -1.509 1.00 10.00 H new ATOM 0 HG22 ILE A 84 -4.172 0.300 -2.454 1.00 10.00 H new ATOM 0 HG23 ILE A 84 -4.307 2.015 -2.911 1.00 10.00 H new ATOM 0 HD11 ILE A 84 -4.460 4.190 0.774 1.00 10.00 H new ATOM 0 HD12 ILE A 84 -4.381 2.469 1.218 1.00 10.00 H new ATOM 0 HD13 ILE A 84 -3.404 3.084 -0.136 1.00 10.00 H new ATOM 1112 N ASP A 85 -6.283 -0.625 -3.544 1.00 10.00 N ATOM 1113 CA ASP A 85 -6.265 -2.006 -4.023 1.00 10.00 C ATOM 1114 C ASP A 85 -4.843 -2.558 -4.045 1.00 10.00 C ATOM 1115 O ASP A 85 -3.886 -1.818 -4.281 1.00 10.00 O ATOM 1116 CB ASP A 85 -6.881 -2.097 -5.421 1.00 10.00 C ATOM 1117 CG ASP A 85 -7.473 -3.464 -5.703 1.00 10.00 C ATOM 1118 OD1 ASP A 85 -7.745 -3.766 -6.883 1.00 10.00 O ATOM 1119 OD2 ASP A 85 -7.678 -4.238 -4.745 1.00 10.00 O ATOM 0 H ASP A 85 -5.908 0.058 -4.202 1.00 10.00 H new ATOM 0 HA ASP A 85 -6.859 -2.607 -3.334 1.00 10.00 H new ATOM 0 HB2 ASP A 85 -7.658 -1.339 -5.523 1.00 10.00 H new ATOM 0 HB3 ASP A 85 -6.118 -1.873 -6.167 1.00 10.00 H new ATOM 1124 N VAL A 86 -4.710 -3.854 -3.799 1.00 10.00 N ATOM 1125 CA VAL A 86 -3.406 -4.508 -3.785 1.00 10.00 C ATOM 1126 C VAL A 86 -3.380 -5.688 -4.752 1.00 10.00 C ATOM 1127 O VAL A 86 -4.184 -6.612 -4.640 1.00 10.00 O ATOM 1128 CB VAL A 86 -3.035 -5.010 -2.371 1.00 10.00 C ATOM 1129 CG1 VAL A 86 -1.619 -5.568 -2.350 1.00 10.00 C ATOM 1130 CG2 VAL A 86 -3.188 -3.897 -1.344 1.00 10.00 C ATOM 0 H VAL A 86 -5.494 -4.478 -3.605 1.00 10.00 H new ATOM 0 HA VAL A 86 -2.675 -3.762 -4.097 1.00 10.00 H new ATOM 0 HB VAL A 86 -3.722 -5.814 -2.107 1.00 10.00 H new ATOM 0 HG11 VAL A 86 -1.380 -5.915 -1.345 1.00 10.00 H new ATOM 0 HG12 VAL A 86 -1.546 -6.401 -3.049 1.00 10.00 H new ATOM 0 HG13 VAL A 86 -0.916 -4.788 -2.641 1.00 10.00 H new ATOM 0 HG21 VAL A 86 -2.921 -4.274 -0.357 1.00 10.00 H new ATOM 0 HG22 VAL A 86 -2.531 -3.068 -1.606 1.00 10.00 H new ATOM 0 HG23 VAL A 86 -4.222 -3.551 -1.333 1.00 10.00 H new ATOM 1140 N PHE A 87 -2.452 -5.650 -5.697 1.00 10.00 N ATOM 1141 CA PHE A 87 -2.318 -6.714 -6.683 1.00 10.00 C ATOM 1142 C PHE A 87 -0.995 -7.451 -6.503 1.00 10.00 C ATOM 1143 O PHE A 87 -0.117 -6.989 -5.779 1.00 10.00 O ATOM 1144 CB PHE A 87 -2.402 -6.142 -8.099 1.00 10.00 C ATOM 1145 CG PHE A 87 -3.797 -5.803 -8.529 1.00 10.00 C ATOM 1146 CD1 PHE A 87 -4.747 -6.798 -8.687 1.00 10.00 C ATOM 1147 CD2 PHE A 87 -4.158 -4.491 -8.785 1.00 10.00 C ATOM 1148 CE1 PHE A 87 -6.035 -6.490 -9.082 1.00 10.00 C ATOM 1149 CE2 PHE A 87 -5.443 -4.177 -9.180 1.00 10.00 C ATOM 1150 CZ PHE A 87 -6.382 -5.179 -9.334 1.00 10.00 C ATOM 0 H PHE A 87 -1.778 -4.891 -5.802 1.00 10.00 H new ATOM 0 HA PHE A 87 -3.136 -7.419 -6.534 1.00 10.00 H new ATOM 0 HB2 PHE A 87 -1.785 -5.245 -8.156 1.00 10.00 H new ATOM 0 HB3 PHE A 87 -1.981 -6.864 -8.799 1.00 10.00 H new ATOM 0 HD1 PHE A 87 -4.478 -7.827 -8.499 1.00 10.00 H new ATOM 0 HD2 PHE A 87 -3.426 -3.705 -8.674 1.00 10.00 H new ATOM 0 HE1 PHE A 87 -6.769 -7.275 -9.193 1.00 10.00 H new ATOM 0 HE2 PHE A 87 -5.714 -3.149 -9.369 1.00 10.00 H new ATOM 0 HZ PHE A 87 -7.385 -4.936 -9.651 1.00 10.00 H new ATOM 1160 N GLN A 88 -0.861 -8.589 -7.171 1.00 10.00 N ATOM 1161 CA GLN A 88 0.353 -9.394 -7.099 1.00 10.00 C ATOM 1162 C GLN A 88 1.060 -9.381 -8.447 1.00 10.00 C ATOM 1163 O GLN A 88 0.410 -9.456 -9.490 1.00 10.00 O ATOM 1164 CB GLN A 88 0.015 -10.833 -6.708 1.00 10.00 C ATOM 1165 CG GLN A 88 -0.329 -11.007 -5.236 1.00 10.00 C ATOM 1166 CD GLN A 88 0.823 -11.585 -4.434 1.00 10.00 C ATOM 1167 OE1 GLN A 88 1.991 -11.365 -4.752 1.00 10.00 O ATOM 1168 NE2 GLN A 88 0.504 -12.332 -3.388 1.00 10.00 N ATOM 0 H GLN A 88 -1.585 -8.979 -7.774 1.00 10.00 H new ATOM 0 HA GLN A 88 1.011 -8.969 -6.341 1.00 10.00 H new ATOM 0 HB2 GLN A 88 -0.827 -11.175 -7.311 1.00 10.00 H new ATOM 0 HB3 GLN A 88 0.862 -11.474 -6.951 1.00 10.00 H new ATOM 0 HG2 GLN A 88 -0.612 -10.042 -4.816 1.00 10.00 H new ATOM 0 HG3 GLN A 88 -1.196 -11.661 -5.144 1.00 10.00 H new ATOM 0 HE21 GLN A 88 -0.476 -12.492 -3.155 1.00 10.00 H new ATOM 0 HE22 GLN A 88 1.238 -12.747 -2.815 1.00 10.00 H new ATOM 1177 N GLN A 89 2.382 -9.283 -8.427 1.00 10.00 N ATOM 1178 CA GLN A 89 3.162 -9.262 -9.657 1.00 10.00 C ATOM 1179 C GLN A 89 3.112 -10.629 -10.334 1.00 10.00 C ATOM 1180 O GLN A 89 2.971 -11.655 -9.664 1.00 10.00 O ATOM 1181 CB GLN A 89 4.617 -8.869 -9.364 1.00 10.00 C ATOM 1182 CG GLN A 89 5.391 -8.410 -10.592 1.00 10.00 C ATOM 1183 CD GLN A 89 4.774 -7.193 -11.256 1.00 10.00 C ATOM 1184 OE1 GLN A 89 4.168 -6.349 -10.599 1.00 10.00 O ATOM 1185 NE2 GLN A 89 4.916 -7.100 -12.567 1.00 10.00 N ATOM 0 H GLN A 89 2.937 -9.217 -7.574 1.00 10.00 H new ATOM 0 HA GLN A 89 2.731 -8.519 -10.329 1.00 10.00 H new ATOM 0 HB2 GLN A 89 4.625 -8.070 -8.622 1.00 10.00 H new ATOM 0 HB3 GLN A 89 5.131 -9.722 -8.920 1.00 10.00 H new ATOM 0 HG2 GLN A 89 6.417 -8.180 -10.304 1.00 10.00 H new ATOM 0 HG3 GLN A 89 5.438 -9.227 -11.312 1.00 10.00 H new ATOM 0 HE21 GLN A 89 5.426 -7.821 -13.077 1.00 10.00 H new ATOM 0 HE22 GLN A 89 4.516 -6.307 -13.068 1.00 10.00 H new ATOM 1194 N GLN A 90 3.212 -10.637 -11.657 1.00 10.00 N ATOM 1195 CA GLN A 90 3.177 -11.879 -12.420 1.00 10.00 C ATOM 1196 C GLN A 90 4.409 -12.721 -12.124 1.00 10.00 C ATOM 1197 O GLN A 90 5.530 -12.212 -12.130 1.00 10.00 O ATOM 1198 CB GLN A 90 3.096 -11.596 -13.922 1.00 10.00 C ATOM 1199 CG GLN A 90 1.806 -10.918 -14.358 1.00 10.00 C ATOM 1200 CD GLN A 90 1.831 -9.417 -14.143 1.00 10.00 C ATOM 1201 OE1 GLN A 90 2.886 -8.786 -14.198 1.00 10.00 O ATOM 1202 NE2 GLN A 90 0.671 -8.837 -13.887 1.00 10.00 N ATOM 0 H GLN A 90 3.318 -9.796 -12.225 1.00 10.00 H new ATOM 0 HA GLN A 90 2.286 -12.430 -12.119 1.00 10.00 H new ATOM 0 HB2 GLN A 90 3.939 -10.967 -14.208 1.00 10.00 H new ATOM 0 HB3 GLN A 90 3.201 -12.536 -14.464 1.00 10.00 H new ATOM 0 HG2 GLN A 90 1.630 -11.127 -15.413 1.00 10.00 H new ATOM 0 HG3 GLN A 90 0.970 -11.346 -13.804 1.00 10.00 H new ATOM 0 HE21 GLN A 90 -0.181 -9.396 -13.850 1.00 10.00 H new ATOM 0 HE22 GLN A 90 0.628 -7.831 -13.726 1.00 10.00 H new ATOM 1211 N THR A 91 4.198 -14.001 -11.862 1.00 10.00 N ATOM 1212 CA THR A 91 5.291 -14.912 -11.567 1.00 10.00 C ATOM 1213 C THR A 91 6.164 -15.137 -12.799 1.00 10.00 C ATOM 1214 O THR A 91 7.392 -15.160 -12.711 1.00 10.00 O ATOM 1215 CB THR A 91 4.745 -16.263 -11.077 1.00 10.00 C ATOM 1216 OG1 THR A 91 3.323 -16.169 -10.898 1.00 10.00 O ATOM 1217 CG2 THR A 91 5.406 -16.671 -9.770 1.00 10.00 C ATOM 0 H THR A 91 3.274 -14.434 -11.848 1.00 10.00 H new ATOM 0 HA THR A 91 5.898 -14.459 -10.783 1.00 10.00 H new ATOM 0 HB THR A 91 4.970 -17.023 -11.825 1.00 10.00 H new ATOM 0 HG1 THR A 91 2.975 -17.031 -10.587 1.00 10.00 H new ATOM 0 HG21 THR A 91 5.004 -17.630 -9.443 1.00 10.00 H new ATOM 0 HG22 THR A 91 6.482 -16.761 -9.919 1.00 10.00 H new ATOM 0 HG23 THR A 91 5.207 -15.915 -9.010 1.00 10.00 H new ATOM 1225 N GLY A 92 5.522 -15.294 -13.945 1.00 10.00 N ATOM 1226 CA GLY A 92 6.242 -15.513 -15.176 1.00 10.00 C ATOM 1227 C GLY A 92 5.472 -16.418 -16.106 1.00 10.00 C ATOM 1228 O GLY A 92 4.225 -16.392 -16.059 1.00 10.00 O ATOM 0 H GLY A 92 4.507 -15.273 -14.042 1.00 10.00 H new ATOM 0 HA2 GLY A 92 6.428 -14.557 -15.666 1.00 10.00 H new ATOM 0 HA3 GLY A 92 7.215 -15.954 -14.958 1.00 10.00 H new TER 1232 GLY A 92 ATOM 1233 N ASN B 357 -15.074 -11.034 6.378 1.00 10.00 N ATOM 1234 CA ASN B 357 -14.042 -10.000 6.152 1.00 10.00 C ATOM 1235 C ASN B 357 -13.527 -9.507 7.491 1.00 10.00 C ATOM 1236 O ASN B 357 -14.271 -9.476 8.472 1.00 10.00 O ATOM 1237 CB ASN B 357 -14.617 -8.828 5.336 1.00 10.00 C ATOM 1238 CG ASN B 357 -15.034 -7.633 6.185 1.00 10.00 C ATOM 1239 OD1 ASN B 357 -14.245 -6.713 6.412 1.00 10.00 O ATOM 1240 ND2 ASN B 357 -16.275 -7.628 6.646 1.00 10.00 N ATOM 0 HA ASN B 357 -13.219 -10.435 5.584 1.00 10.00 H new ATOM 0 HB2 ASN B 357 -13.872 -8.503 4.610 1.00 10.00 H new ATOM 0 HB3 ASN B 357 -15.481 -9.180 4.772 1.00 10.00 H new ATOM 0 HD21 ASN B 357 -16.607 -6.845 7.209 1.00 10.00 H new ATOM 0 HD22 ASN B 357 -16.900 -8.407 6.438 1.00 10.00 H new ATOM 1247 N ASN B 358 -12.255 -9.153 7.556 1.00 10.00 N ATOM 1248 CA ASN B 358 -11.698 -8.665 8.804 1.00 10.00 C ATOM 1249 C ASN B 358 -11.144 -7.267 8.640 1.00 10.00 C ATOM 1250 O ASN B 358 -10.385 -6.993 7.711 1.00 10.00 O ATOM 1251 CB ASN B 358 -10.624 -9.625 9.349 1.00 10.00 C ATOM 1252 CG ASN B 358 -9.249 -9.430 8.731 1.00 10.00 C ATOM 1253 OD1 ASN B 358 -8.435 -8.651 9.228 1.00 10.00 O ATOM 1254 ND2 ASN B 358 -8.977 -10.144 7.650 1.00 10.00 N ATOM 0 H ASN B 358 -11.600 -9.193 6.775 1.00 10.00 H new ATOM 0 HA ASN B 358 -12.506 -8.623 9.534 1.00 10.00 H new ATOM 0 HB2 ASN B 358 -10.548 -9.493 10.428 1.00 10.00 H new ATOM 0 HB3 ASN B 358 -10.947 -10.651 9.175 1.00 10.00 H new ATOM 0 HD21 ASN B 358 -8.066 -10.059 7.199 1.00 10.00 H new ATOM 0 HD22 ASN B 358 -9.678 -10.779 7.268 1.00 10.00 H new ATOM 1261 N ARG B 359 -11.573 -6.368 9.515 1.00 10.00 N ATOM 1262 CA ARG B 359 -11.081 -5.003 9.483 1.00 10.00 C ATOM 1263 C ARG B 359 -10.443 -4.643 10.816 1.00 10.00 C ATOM 1264 O ARG B 359 -11.078 -4.721 11.870 1.00 10.00 O ATOM 1265 CB ARG B 359 -12.212 -4.021 9.160 1.00 10.00 C ATOM 1266 CG ARG B 359 -13.594 -4.536 9.522 1.00 10.00 C ATOM 1267 CD ARG B 359 -14.671 -3.509 9.225 1.00 10.00 C ATOM 1268 NE ARG B 359 -14.727 -2.467 10.252 1.00 10.00 N ATOM 1269 CZ ARG B 359 -15.865 -1.975 10.750 1.00 10.00 C ATOM 1270 NH1 ARG B 359 -17.038 -2.402 10.297 1.00 10.00 N ATOM 1271 NH2 ARG B 359 -15.826 -1.055 11.704 1.00 10.00 N ATOM 0 H ARG B 359 -12.255 -6.559 10.249 1.00 10.00 H new ATOM 0 HA ARG B 359 -10.329 -4.931 8.697 1.00 10.00 H new ATOM 0 HB2 ARG B 359 -12.032 -3.087 9.692 1.00 10.00 H new ATOM 0 HB3 ARG B 359 -12.188 -3.791 8.095 1.00 10.00 H new ATOM 0 HG2 ARG B 359 -13.799 -5.450 8.965 1.00 10.00 H new ATOM 0 HG3 ARG B 359 -13.620 -4.795 10.580 1.00 10.00 H new ATOM 0 HD2 ARG B 359 -14.480 -3.052 8.254 1.00 10.00 H new ATOM 0 HD3 ARG B 359 -15.639 -4.006 9.158 1.00 10.00 H new ATOM 0 HE ARG B 359 -13.846 -2.095 10.608 1.00 10.00 H new ATOM 0 HH11 ARG B 359 -17.074 -3.110 9.564 1.00 10.00 H new ATOM 0 HH12 ARG B 359 -17.903 -2.022 10.682 1.00 10.00 H new ATOM 0 HH21 ARG B 359 -14.928 -0.724 12.057 1.00 10.00 H new ATOM 0 HH22 ARG B 359 -16.694 -0.678 12.085 1.00 10.00 H new ATOM 1285 N ASP B 360 -9.183 -4.265 10.748 1.00 10.00 N ATOM 1286 CA ASP B 360 -8.404 -3.852 11.907 1.00 10.00 C ATOM 1287 C ASP B 360 -7.782 -2.491 11.616 1.00 10.00 C ATOM 1288 O ASP B 360 -7.349 -2.255 10.490 1.00 10.00 O ATOM 1289 CB ASP B 360 -7.358 -4.913 12.293 1.00 10.00 C ATOM 1290 CG ASP B 360 -5.959 -4.591 11.824 1.00 10.00 C ATOM 1291 OD1 ASP B 360 -5.624 -4.973 10.690 1.00 10.00 O ATOM 1292 OD2 ASP B 360 -5.181 -3.988 12.603 1.00 10.00 O ATOM 0 H ASP B 360 -8.659 -4.234 9.873 1.00 10.00 H new ATOM 0 HA ASP B 360 -9.056 -3.757 12.775 1.00 10.00 H new ATOM 0 HB2 ASP B 360 -7.351 -5.024 13.377 1.00 10.00 H new ATOM 0 HB3 ASP B 360 -7.658 -5.874 11.876 1.00 10.00 H new ATOM 1297 N PRO B 361 -7.735 -1.560 12.580 1.00 10.00 N ATOM 1298 CA PRO B 361 -7.178 -0.241 12.332 1.00 10.00 C ATOM 1299 C PRO B 361 -5.782 -0.064 12.928 1.00 10.00 C ATOM 1300 O PRO B 361 -5.525 -0.368 14.092 1.00 10.00 O ATOM 1301 CB PRO B 361 -8.181 0.648 13.068 1.00 10.00 C ATOM 1302 CG PRO B 361 -8.703 -0.196 14.204 1.00 10.00 C ATOM 1303 CD PRO B 361 -8.333 -1.636 13.916 1.00 10.00 C ATOM 0 HA PRO B 361 -7.050 -0.027 11.271 1.00 10.00 H new ATOM 0 HB2 PRO B 361 -7.704 1.555 13.439 1.00 10.00 H new ATOM 0 HB3 PRO B 361 -8.989 0.960 12.407 1.00 10.00 H new ATOM 0 HG2 PRO B 361 -8.271 0.128 15.151 1.00 10.00 H new ATOM 0 HG3 PRO B 361 -9.784 -0.090 14.294 1.00 10.00 H new ATOM 0 HD2 PRO B 361 -7.630 -2.027 14.651 1.00 10.00 H new ATOM 0 HD3 PRO B 361 -9.206 -2.288 13.931 1.00 10.00 H new ATOM 1311 N ILE B 362 -4.883 0.434 12.084 1.00 10.00 N ATOM 1312 CA ILE B 362 -3.478 0.622 12.436 1.00 10.00 C ATOM 1313 C ILE B 362 -3.097 2.091 12.376 1.00 10.00 C ATOM 1314 O ILE B 362 -3.445 2.789 11.427 1.00 10.00 O ATOM 1315 CB ILE B 362 -2.554 -0.164 11.474 1.00 10.00 C ATOM 1316 CG1 ILE B 362 -3.295 -1.365 10.872 1.00 10.00 C ATOM 1317 CG2 ILE B 362 -1.290 -0.617 12.192 1.00 10.00 C ATOM 1318 CD1 ILE B 362 -2.880 -1.673 9.449 1.00 10.00 C ATOM 0 H ILE B 362 -5.109 0.720 11.131 1.00 10.00 H new ATOM 0 HA ILE B 362 -3.349 0.249 13.452 1.00 10.00 H new ATOM 0 HB ILE B 362 -2.264 0.501 10.660 1.00 10.00 H new ATOM 0 HG12 ILE B 362 -3.116 -2.242 11.493 1.00 10.00 H new ATOM 0 HG13 ILE B 362 -4.367 -1.171 10.896 1.00 10.00 H new ATOM 0 HG21 ILE B 362 -0.655 -1.167 11.498 1.00 10.00 H new ATOM 0 HG22 ILE B 362 -0.751 0.254 12.564 1.00 10.00 H new ATOM 0 HG23 ILE B 362 -1.558 -1.263 13.028 1.00 10.00 H new ATOM 0 HD11 ILE B 362 -3.442 -2.533 9.084 1.00 10.00 H new ATOM 0 HD12 ILE B 362 -3.085 -0.810 8.815 1.00 10.00 H new ATOM 0 HD13 ILE B 362 -1.814 -1.898 9.422 1.00 10.00 H new ATOM 1330 N VAL B 363 -2.396 2.565 13.393 1.00 10.00 N ATOM 1331 CA VAL B 363 -1.988 3.958 13.433 1.00 10.00 C ATOM 1332 C VAL B 363 -0.472 4.075 13.406 1.00 10.00 C ATOM 1333 O VAL B 363 0.229 3.449 14.198 1.00 10.00 O ATOM 1334 CB VAL B 363 -2.505 4.655 14.708 1.00 10.00 C ATOM 1335 CG1 VAL B 363 -2.063 6.110 14.753 1.00 10.00 C ATOM 1336 CG2 VAL B 363 -4.017 4.539 14.809 1.00 10.00 C ATOM 0 H VAL B 363 -2.100 2.010 14.196 1.00 10.00 H new ATOM 0 HA VAL B 363 -2.416 4.442 12.555 1.00 10.00 H new ATOM 0 HB VAL B 363 -2.069 4.150 15.570 1.00 10.00 H new ATOM 0 HG11 VAL B 363 -2.441 6.577 15.662 1.00 10.00 H new ATOM 0 HG12 VAL B 363 -0.974 6.160 14.745 1.00 10.00 H new ATOM 0 HG13 VAL B 363 -2.456 6.637 13.884 1.00 10.00 H new ATOM 0 HG21 VAL B 363 -4.360 5.037 15.716 1.00 10.00 H new ATOM 0 HG22 VAL B 363 -4.477 5.009 13.940 1.00 10.00 H new ATOM 0 HG23 VAL B 363 -4.300 3.487 14.844 1.00 10.00 H new ATOM 1346 N ILE B 364 0.008 4.882 12.481 1.00 10.00 N ATOM 1347 CA ILE B 364 1.430 5.133 12.314 1.00 10.00 C ATOM 1348 C ILE B 364 1.707 6.623 12.496 1.00 10.00 C ATOM 1349 O ILE B 364 0.981 7.464 11.967 1.00 10.00 O ATOM 1350 CB ILE B 364 1.946 4.683 10.922 1.00 10.00 C ATOM 1351 CG1 ILE B 364 1.795 3.169 10.735 1.00 10.00 C ATOM 1352 CG2 ILE B 364 3.403 5.080 10.734 1.00 10.00 C ATOM 1353 CD1 ILE B 364 2.189 2.679 9.352 1.00 10.00 C ATOM 0 H ILE B 364 -0.580 5.387 11.818 1.00 10.00 H new ATOM 0 HA ILE B 364 1.958 4.549 13.068 1.00 10.00 H new ATOM 0 HB ILE B 364 1.339 5.187 10.170 1.00 10.00 H new ATOM 0 HG12 ILE B 364 2.406 2.658 11.479 1.00 10.00 H new ATOM 0 HG13 ILE B 364 0.759 2.890 10.927 1.00 10.00 H new ATOM 0 HG21 ILE B 364 3.745 4.755 9.751 1.00 10.00 H new ATOM 0 HG22 ILE B 364 3.498 6.163 10.811 1.00 10.00 H new ATOM 0 HG23 ILE B 364 4.011 4.607 11.505 1.00 10.00 H new ATOM 0 HD11 ILE B 364 2.055 1.599 9.297 1.00 10.00 H new ATOM 0 HD12 ILE B 364 1.561 3.161 8.603 1.00 10.00 H new ATOM 0 HD13 ILE B 364 3.234 2.925 9.163 1.00 10.00 H new ATOM 1365 N SER B 365 2.734 6.943 13.262 1.00 10.00 N ATOM 1366 CA SER B 365 3.105 8.328 13.503 1.00 10.00 C ATOM 1367 C SER B 365 4.495 8.566 12.939 1.00 10.00 C ATOM 1368 O SER B 365 5.416 7.788 13.196 1.00 10.00 O ATOM 1369 CB SER B 365 3.073 8.621 15.006 1.00 10.00 C ATOM 1370 OG SER B 365 2.067 7.844 15.648 1.00 10.00 O ATOM 0 H SER B 365 3.329 6.260 13.730 1.00 10.00 H new ATOM 0 HA SER B 365 2.398 8.997 13.012 1.00 10.00 H new ATOM 0 HB2 SER B 365 4.046 8.401 15.446 1.00 10.00 H new ATOM 0 HB3 SER B 365 2.882 9.681 15.171 1.00 10.00 H new ATOM 0 HG SER B 365 2.062 8.043 16.608 1.00 10.00 H new ATOM 1376 N ASP B 366 4.642 9.613 12.147 1.00 10.00 N ATOM 1377 CA ASP B 366 5.926 9.909 11.536 1.00 10.00 C ATOM 1378 C ASP B 366 6.435 11.280 11.951 1.00 10.00 C ATOM 1379 O ASP B 366 5.702 12.273 11.887 1.00 10.00 O ATOM 1380 CB ASP B 366 5.806 9.831 10.017 1.00 10.00 C ATOM 1381 CG ASP B 366 7.073 9.328 9.359 1.00 10.00 C ATOM 1382 OD1 ASP B 366 7.010 8.885 8.197 1.00 10.00 O ATOM 1383 OD2 ASP B 366 8.135 9.332 10.012 1.00 10.00 O ATOM 0 H ASP B 366 3.896 10.268 11.913 1.00 10.00 H new ATOM 0 HA ASP B 366 6.646 9.167 11.882 1.00 10.00 H new ATOM 0 HB2 ASP B 366 4.978 9.172 9.755 1.00 10.00 H new ATOM 0 HB3 ASP B 366 5.564 10.818 9.624 1.00 10.00 H new ATOM 1388 N SER B 367 7.684 11.319 12.400 1.00 10.00 N ATOM 1389 CA SER B 367 8.331 12.559 12.820 1.00 10.00 C ATOM 1390 C SER B 367 9.227 13.107 11.699 1.00 10.00 C ATOM 1391 O SER B 367 10.211 12.462 11.321 1.00 10.00 O ATOM 1392 CB SER B 367 9.163 12.312 14.091 1.00 10.00 C ATOM 1393 OG SER B 367 9.502 10.941 14.225 1.00 10.00 O ATOM 0 H SER B 367 8.277 10.494 12.484 1.00 10.00 H new ATOM 0 HA SER B 367 7.560 13.298 13.037 1.00 10.00 H new ATOM 0 HB2 SER B 367 10.072 12.912 14.056 1.00 10.00 H new ATOM 0 HB3 SER B 367 8.600 12.637 14.966 1.00 10.00 H new ATOM 0 HG SER B 367 10.032 10.813 15.040 1.00 10.00 H new ATOM 1399 N PRO B 368 8.898 14.300 11.158 1.00 10.00 N ATOM 1400 CA PRO B 368 9.674 14.926 10.078 1.00 10.00 C ATOM 1401 C PRO B 368 11.144 15.115 10.450 1.00 10.00 C ATOM 1402 O PRO B 368 11.421 15.893 11.384 1.00 10.00 O ATOM 1403 CB PRO B 368 8.996 16.289 9.880 1.00 10.00 C ATOM 1404 CG PRO B 368 7.626 16.125 10.437 1.00 10.00 C ATOM 1405 CD PRO B 368 7.742 15.127 11.553 1.00 10.00 C ATOM 0 HA PRO B 368 9.682 14.307 9.181 1.00 10.00 H new ATOM 0 HB2 PRO B 368 9.540 17.079 10.398 1.00 10.00 H new ATOM 0 HB3 PRO B 368 8.963 16.563 8.826 1.00 10.00 H new ATOM 0 HG2 PRO B 368 7.239 17.076 10.804 1.00 10.00 H new ATOM 0 HG3 PRO B 368 6.934 15.774 9.671 1.00 10.00 H new ATOM 0 HD2 PRO B 368 7.908 15.616 12.513 1.00 10.00 H new ATOM 0 HD3 PRO B 368 6.836 14.529 11.652 1.00 10.00 H new TER 1413 PRO B 368