USER MOD reduce.3.24.130724 H: found=0, std=0, add=698, rem=0, adj=18 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 19 ASN : amide:sc= 0.702 K(o=0.67,f=-3.6) USER MOD Set 1.2: A 31 GLN : amide:sc= -0.032 K(o=0.67,f=-7.2!) USER MOD Set 2.1: A 28 SER OG : rot -90:sc= 1.22 USER MOD Set 2.2: A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 HIS : no HD1:sc= 0 X(o=0,f=-0.00032) USER MOD Single : A 21 LYS NZ :NH3+ -176:sc= 1.24 (180deg=1.2) USER MOD Single : A 25 GLN : amide:sc= 2.25 K(o=2.2,f=-0.94) 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= 0 X(o=0,f=0) USER MOD Single : A 38 THR OG1 : rot -156:sc= -0.788 USER MOD Single : A 41 SER OG : rot -105:sc= 1.4 USER MOD Single : A 42 LYS NZ :NH3+ 151:sc= 1.18 (180deg=0.996) USER MOD Single : A 44 MET CE :methyl -145:sc= -0.222 (180deg=-0.892) USER MOD Single : A 45 LYS NZ :NH3+ -124:sc= 1.29 (180deg=-0.403) USER MOD Single : A 48 CYS SG : rot -82:sc= 0.0809 USER MOD Single : A 51 GLN : amide:sc= -0.0241 X(o=-0.024,f=-0.05) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 55 MET CE :methyl 145:sc= 0 (180deg=-1.02) USER MOD Single : A 57 GLN : amide:sc= -0.164 K(o=-0.16,f=-1.4) USER MOD Single : A 65 GLN : amide:sc= -0.0285 X(o=-0.029,f=-0.058) USER MOD Single : A 68 ASN : amide:sc= 1.18 K(o=1.2,f=-0.071) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0.00294 USER MOD Single : A 72 THR OG1 : rot 180:sc= -1.04 USER MOD Single : A 75 GLN : amide:sc= -0.0514 K(o=-0.051,f=-0.96) USER MOD Single : A 78 MET CE :methyl -143:sc= -1.07 (180deg=-2.33) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 88 GLN : amide:sc= 0 X(o=0,f=-0.44) USER MOD Single : A 89 GLN : amide:sc=-0.00495 X(o=-0.0049,f=-0.38) USER MOD Single : A 90 GLN : amide:sc= -1.08 K(o=-1.1,f=-2.8) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0.0756 USER MOD Single : B 357 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 358 ASN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : B 365 SER OG : rot 180:sc= 0 USER MOD Single : B 367 SER OG : rot 180:sc= 0.0362 USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 16 -7.263 15.675 11.496 1.00 10.00 N ATOM 2 CA ASP A 16 -7.213 14.405 12.265 1.00 10.00 C ATOM 3 C ASP A 16 -6.626 13.297 11.406 1.00 10.00 C ATOM 4 O ASP A 16 -6.132 13.555 10.310 1.00 10.00 O ATOM 5 CB ASP A 16 -8.614 14.001 12.744 1.00 10.00 C ATOM 6 CG ASP A 16 -9.138 14.897 13.846 1.00 10.00 C ATOM 7 OD1 ASP A 16 -9.631 14.368 14.868 1.00 10.00 O ATOM 8 OD2 ASP A 16 -9.055 16.134 13.700 1.00 10.00 O ATOM 0 HA ASP A 16 -6.579 14.560 13.138 1.00 10.00 H new ATOM 0 HB2 ASP A 16 -9.304 14.029 11.900 1.00 10.00 H new ATOM 0 HB3 ASP A 16 -8.588 12.971 13.101 1.00 10.00 H new ATOM 13 N HIS A 17 -6.672 12.069 11.907 1.00 10.00 N ATOM 14 CA HIS A 17 -6.157 10.925 11.168 1.00 10.00 C ATOM 15 C HIS A 17 -7.127 10.549 10.050 1.00 10.00 C ATOM 16 O HIS A 17 -8.334 10.771 10.170 1.00 10.00 O ATOM 17 CB HIS A 17 -5.947 9.731 12.103 1.00 10.00 C ATOM 18 CG HIS A 17 -5.034 10.007 13.261 1.00 10.00 C ATOM 19 ND1 HIS A 17 -5.527 10.233 14.526 1.00 10.00 N ATOM 20 CD2 HIS A 17 -3.680 10.079 13.296 1.00 10.00 C ATOM 21 CE1 HIS A 17 -4.469 10.433 15.297 1.00 10.00 C ATOM 22 NE2 HIS A 17 -3.332 10.349 14.596 1.00 10.00 N ATOM 0 H HIS A 17 -7.061 11.840 12.822 1.00 10.00 H new ATOM 0 HA HIS A 17 -5.196 11.196 10.732 1.00 10.00 H new ATOM 0 HB2 HIS A 17 -6.915 9.411 12.487 1.00 10.00 H new ATOM 0 HB3 HIS A 17 -5.542 8.900 11.526 1.00 10.00 H new ATOM 0 HD2 HIS A 17 -3.006 9.949 12.462 1.00 10.00 H new ATOM 0 HE1 HIS A 17 -4.518 10.638 16.356 1.00 10.00 H new ATOM 0 HE2 HIS A 17 -2.386 10.464 14.959 1.00 10.00 H new ATOM 30 N ILE A 18 -6.598 9.982 8.980 1.00 10.00 N ATOM 31 CA ILE A 18 -7.409 9.588 7.837 1.00 10.00 C ATOM 32 C ILE A 18 -7.634 8.078 7.841 1.00 10.00 C ATOM 33 O ILE A 18 -6.707 7.301 8.069 1.00 10.00 O ATOM 34 CB ILE A 18 -6.752 10.035 6.504 1.00 10.00 C ATOM 35 CG1 ILE A 18 -7.634 9.661 5.310 1.00 10.00 C ATOM 36 CG2 ILE A 18 -5.359 9.437 6.351 1.00 10.00 C ATOM 37 CD1 ILE A 18 -7.156 10.254 4.002 1.00 10.00 C ATOM 0 H ILE A 18 -5.603 9.782 8.877 1.00 10.00 H new ATOM 0 HA ILE A 18 -8.375 10.087 7.920 1.00 10.00 H new ATOM 0 HB ILE A 18 -6.652 11.120 6.529 1.00 10.00 H new ATOM 0 HG12 ILE A 18 -7.667 8.575 5.218 1.00 10.00 H new ATOM 0 HG13 ILE A 18 -8.653 9.996 5.501 1.00 10.00 H new ATOM 0 HG21 ILE A 18 -4.923 9.767 5.408 1.00 10.00 H new ATOM 0 HG22 ILE A 18 -4.729 9.766 7.177 1.00 10.00 H new ATOM 0 HG23 ILE A 18 -5.427 8.349 6.358 1.00 10.00 H new ATOM 0 HD11 ILE A 18 -7.826 9.949 3.198 1.00 10.00 H new ATOM 0 HD12 ILE A 18 -7.149 11.341 4.076 1.00 10.00 H new ATOM 0 HD13 ILE A 18 -6.148 9.899 3.788 1.00 10.00 H new ATOM 49 N ASN A 19 -8.875 7.670 7.622 1.00 10.00 N ATOM 50 CA ASN A 19 -9.223 6.255 7.599 1.00 10.00 C ATOM 51 C ASN A 19 -9.052 5.679 6.204 1.00 10.00 C ATOM 52 O ASN A 19 -9.962 5.752 5.377 1.00 10.00 O ATOM 53 CB ASN A 19 -10.667 6.044 8.052 1.00 10.00 C ATOM 54 CG ASN A 19 -10.854 6.223 9.542 1.00 10.00 C ATOM 55 OD1 ASN A 19 -10.791 5.261 10.309 1.00 10.00 O ATOM 56 ND2 ASN A 19 -11.090 7.456 9.961 1.00 10.00 N ATOM 0 H ASN A 19 -9.660 8.300 7.457 1.00 10.00 H new ATOM 0 HA ASN A 19 -8.550 5.741 8.286 1.00 10.00 H new ATOM 0 HB2 ASN A 19 -11.313 6.745 7.524 1.00 10.00 H new ATOM 0 HB3 ASN A 19 -10.987 5.041 7.770 1.00 10.00 H new ATOM 0 HD21 ASN A 19 -11.228 7.639 10.955 1.00 10.00 H new ATOM 0 HD22 ASN A 19 -11.134 8.223 9.290 1.00 10.00 H new ATOM 63 N LEU A 20 -7.885 5.120 5.942 1.00 10.00 N ATOM 64 CA LEU A 20 -7.610 4.521 4.647 1.00 10.00 C ATOM 65 C LEU A 20 -7.950 3.038 4.676 1.00 10.00 C ATOM 66 O LEU A 20 -7.494 2.305 5.554 1.00 10.00 O ATOM 67 CB LEU A 20 -6.144 4.726 4.257 1.00 10.00 C ATOM 68 CG LEU A 20 -5.749 6.173 3.958 1.00 10.00 C ATOM 69 CD1 LEU A 20 -4.254 6.275 3.685 1.00 10.00 C ATOM 70 CD2 LEU A 20 -6.548 6.703 2.776 1.00 10.00 C ATOM 0 H LEU A 20 -7.113 5.068 6.607 1.00 10.00 H new ATOM 0 HA LEU A 20 -8.233 5.010 3.898 1.00 10.00 H new ATOM 0 HB2 LEU A 20 -5.514 4.353 5.064 1.00 10.00 H new ATOM 0 HB3 LEU A 20 -5.929 4.118 3.378 1.00 10.00 H new ATOM 0 HG LEU A 20 -5.977 6.783 4.832 1.00 10.00 H new ATOM 0 HD11 LEU A 20 -3.993 7.312 3.474 1.00 10.00 H new ATOM 0 HD12 LEU A 20 -3.700 5.931 4.559 1.00 10.00 H new ATOM 0 HD13 LEU A 20 -3.998 5.655 2.826 1.00 10.00 H new ATOM 0 HD21 LEU A 20 -6.258 7.734 2.573 1.00 10.00 H new ATOM 0 HD22 LEU A 20 -6.348 6.090 1.897 1.00 10.00 H new ATOM 0 HD23 LEU A 20 -7.612 6.665 3.010 1.00 10.00 H new ATOM 82 N LYS A 21 -8.754 2.602 3.720 1.00 10.00 N ATOM 83 CA LYS A 21 -9.166 1.209 3.647 1.00 10.00 C ATOM 84 C LYS A 21 -8.295 0.432 2.677 1.00 10.00 C ATOM 85 O LYS A 21 -8.123 0.829 1.526 1.00 10.00 O ATOM 86 CB LYS A 21 -10.624 1.105 3.196 1.00 10.00 C ATOM 87 CG LYS A 21 -11.611 1.844 4.084 1.00 10.00 C ATOM 88 CD LYS A 21 -13.023 1.730 3.534 1.00 10.00 C ATOM 89 CE LYS A 21 -14.034 2.434 4.421 1.00 10.00 C ATOM 90 NZ LYS A 21 -15.408 2.374 3.856 1.00 10.00 N ATOM 0 H LYS A 21 -9.135 3.194 2.982 1.00 10.00 H new ATOM 0 HA LYS A 21 -9.058 0.783 4.644 1.00 10.00 H new ATOM 0 HB2 LYS A 21 -10.706 1.494 2.181 1.00 10.00 H new ATOM 0 HB3 LYS A 21 -10.906 0.053 3.158 1.00 10.00 H new ATOM 0 HG2 LYS A 21 -11.575 1.435 5.094 1.00 10.00 H new ATOM 0 HG3 LYS A 21 -11.327 2.894 4.155 1.00 10.00 H new ATOM 0 HD2 LYS A 21 -13.058 2.158 2.532 1.00 10.00 H new ATOM 0 HD3 LYS A 21 -13.292 0.678 3.440 1.00 10.00 H new ATOM 0 HE2 LYS A 21 -14.029 1.977 5.410 1.00 10.00 H new ATOM 0 HE3 LYS A 21 -13.740 3.476 4.550 1.00 10.00 H new ATOM 0 HZ1 LYS A 21 -16.055 2.924 4.457 1.00 10.00 H new ATOM 0 HZ2 LYS A 21 -15.406 2.772 2.895 1.00 10.00 H new ATOM 0 HZ3 LYS A 21 -15.726 1.384 3.820 1.00 10.00 H new ATOM 104 N VAL A 22 -7.738 -0.667 3.144 1.00 10.00 N ATOM 105 CA VAL A 22 -6.915 -1.514 2.302 1.00 10.00 C ATOM 106 C VAL A 22 -7.552 -2.893 2.225 1.00 10.00 C ATOM 107 O VAL A 22 -7.458 -3.689 3.160 1.00 10.00 O ATOM 108 CB VAL A 22 -5.464 -1.621 2.825 1.00 10.00 C ATOM 109 CG1 VAL A 22 -4.639 -2.550 1.944 1.00 10.00 C ATOM 110 CG2 VAL A 22 -4.820 -0.244 2.904 1.00 10.00 C ATOM 0 H VAL A 22 -7.840 -0.996 4.104 1.00 10.00 H new ATOM 0 HA VAL A 22 -6.860 -1.066 1.310 1.00 10.00 H new ATOM 0 HB VAL A 22 -5.494 -2.044 3.829 1.00 10.00 H new ATOM 0 HG11 VAL A 22 -3.622 -2.610 2.331 1.00 10.00 H new ATOM 0 HG12 VAL A 22 -5.087 -3.544 1.944 1.00 10.00 H new ATOM 0 HG13 VAL A 22 -4.618 -2.162 0.926 1.00 10.00 H new ATOM 0 HG21 VAL A 22 -3.799 -0.340 3.274 1.00 10.00 H new ATOM 0 HG22 VAL A 22 -4.805 0.208 1.912 1.00 10.00 H new ATOM 0 HG23 VAL A 22 -5.394 0.388 3.582 1.00 10.00 H new ATOM 120 N ALA A 23 -8.233 -3.155 1.122 1.00 10.00 N ATOM 121 CA ALA A 23 -8.909 -4.426 0.935 1.00 10.00 C ATOM 122 C ALA A 23 -8.167 -5.300 -0.066 1.00 10.00 C ATOM 123 O ALA A 23 -7.927 -4.889 -1.204 1.00 10.00 O ATOM 124 CB ALA A 23 -10.343 -4.199 0.481 1.00 10.00 C ATOM 0 H ALA A 23 -8.332 -2.504 0.343 1.00 10.00 H new ATOM 0 HA ALA A 23 -8.921 -4.947 1.892 1.00 10.00 H new ATOM 0 HB1 ALA A 23 -10.838 -5.161 0.345 1.00 10.00 H new ATOM 0 HB2 ALA A 23 -10.876 -3.620 1.235 1.00 10.00 H new ATOM 0 HB3 ALA A 23 -10.344 -3.653 -0.463 1.00 10.00 H new ATOM 130 N GLY A 24 -7.805 -6.500 0.367 1.00 10.00 N ATOM 131 CA GLY A 24 -7.097 -7.418 -0.500 1.00 10.00 C ATOM 132 C GLY A 24 -8.025 -8.103 -1.482 1.00 10.00 C ATOM 133 O GLY A 24 -9.226 -7.815 -1.519 1.00 10.00 O ATOM 0 H GLY A 24 -7.990 -6.854 1.306 1.00 10.00 H new ATOM 0 HA2 GLY A 24 -6.325 -6.877 -1.048 1.00 10.00 H new ATOM 0 HA3 GLY A 24 -6.591 -8.170 0.105 1.00 10.00 H new ATOM 137 N GLN A 25 -7.483 -9.026 -2.263 1.00 10.00 N ATOM 138 CA GLN A 25 -8.278 -9.748 -3.251 1.00 10.00 C ATOM 139 C GLN A 25 -8.941 -10.972 -2.621 1.00 10.00 C ATOM 140 O GLN A 25 -9.287 -11.930 -3.310 1.00 10.00 O ATOM 141 CB GLN A 25 -7.410 -10.179 -4.439 1.00 10.00 C ATOM 142 CG GLN A 25 -6.553 -9.063 -5.025 1.00 10.00 C ATOM 143 CD GLN A 25 -7.348 -7.815 -5.365 1.00 10.00 C ATOM 144 OE1 GLN A 25 -8.521 -7.886 -5.735 1.00 10.00 O ATOM 145 NE2 GLN A 25 -6.709 -6.669 -5.242 1.00 10.00 N ATOM 0 H GLN A 25 -6.499 -9.294 -2.234 1.00 10.00 H new ATOM 0 HA GLN A 25 -9.055 -9.074 -3.612 1.00 10.00 H new ATOM 0 HB2 GLN A 25 -6.759 -10.993 -4.122 1.00 10.00 H new ATOM 0 HB3 GLN A 25 -8.057 -10.575 -5.222 1.00 10.00 H new ATOM 0 HG2 GLN A 25 -5.769 -8.804 -4.314 1.00 10.00 H new ATOM 0 HG3 GLN A 25 -6.059 -9.428 -5.925 1.00 10.00 H new ATOM 0 HE21 GLN A 25 -5.737 -6.658 -4.932 1.00 10.00 H new ATOM 0 HE22 GLN A 25 -7.186 -5.793 -5.457 1.00 10.00 H new ATOM 154 N ASP A 26 -9.118 -10.930 -1.306 1.00 10.00 N ATOM 155 CA ASP A 26 -9.737 -12.030 -0.578 1.00 10.00 C ATOM 156 C ASP A 26 -10.941 -11.541 0.228 1.00 10.00 C ATOM 157 O ASP A 26 -12.087 -11.760 -0.159 1.00 10.00 O ATOM 158 CB ASP A 26 -8.718 -12.731 0.342 1.00 10.00 C ATOM 159 CG ASP A 26 -7.704 -11.786 0.976 1.00 10.00 C ATOM 160 OD1 ASP A 26 -6.492 -12.067 0.884 1.00 10.00 O ATOM 161 OD2 ASP A 26 -8.110 -10.766 1.572 1.00 10.00 O ATOM 0 H ASP A 26 -8.840 -10.142 -0.720 1.00 10.00 H new ATOM 0 HA ASP A 26 -10.087 -12.757 -1.310 1.00 10.00 H new ATOM 0 HB2 ASP A 26 -9.257 -13.253 1.133 1.00 10.00 H new ATOM 0 HB3 ASP A 26 -8.184 -13.487 -0.233 1.00 10.00 H new ATOM 166 N GLY A 27 -10.669 -10.883 1.342 1.00 10.00 N ATOM 167 CA GLY A 27 -11.726 -10.367 2.187 1.00 10.00 C ATOM 168 C GLY A 27 -11.185 -9.590 3.373 1.00 10.00 C ATOM 169 O GLY A 27 -11.917 -9.294 4.321 1.00 10.00 O ATOM 0 H GLY A 27 -9.725 -10.695 1.680 1.00 10.00 H new ATOM 0 HA2 GLY A 27 -12.377 -9.721 1.598 1.00 10.00 H new ATOM 0 HA3 GLY A 27 -12.338 -11.194 2.546 1.00 10.00 H new ATOM 173 N SER A 28 -9.897 -9.271 3.330 1.00 10.00 N ATOM 174 CA SER A 28 -9.257 -8.518 4.401 1.00 10.00 C ATOM 175 C SER A 28 -9.541 -7.028 4.238 1.00 10.00 C ATOM 176 O SER A 28 -9.297 -6.459 3.173 1.00 10.00 O ATOM 177 CB SER A 28 -7.747 -8.774 4.388 1.00 10.00 C ATOM 178 OG SER A 28 -7.236 -8.777 3.064 1.00 10.00 O ATOM 0 H SER A 28 -9.274 -9.523 2.563 1.00 10.00 H new ATOM 0 HA SER A 28 -9.663 -8.847 5.358 1.00 10.00 H new ATOM 0 HB2 SER A 28 -7.241 -8.007 4.974 1.00 10.00 H new ATOM 0 HB3 SER A 28 -7.534 -9.731 4.864 1.00 10.00 H new ATOM 0 HG SER A 28 -7.271 -9.687 2.702 1.00 10.00 H new ATOM 184 N VAL A 29 -10.073 -6.398 5.282 1.00 10.00 N ATOM 185 CA VAL A 29 -10.382 -4.974 5.221 1.00 10.00 C ATOM 186 C VAL A 29 -9.699 -4.232 6.364 1.00 10.00 C ATOM 187 O VAL A 29 -10.336 -3.857 7.349 1.00 10.00 O ATOM 188 CB VAL A 29 -11.905 -4.705 5.272 1.00 10.00 C ATOM 189 CG1 VAL A 29 -12.205 -3.268 4.870 1.00 10.00 C ATOM 190 CG2 VAL A 29 -12.664 -5.680 4.379 1.00 10.00 C ATOM 0 H VAL A 29 -10.297 -6.846 6.171 1.00 10.00 H new ATOM 0 HA VAL A 29 -10.006 -4.608 4.265 1.00 10.00 H new ATOM 0 HB VAL A 29 -12.241 -4.857 6.298 1.00 10.00 H new ATOM 0 HG11 VAL A 29 -13.280 -3.096 4.911 1.00 10.00 H new ATOM 0 HG12 VAL A 29 -11.702 -2.586 5.555 1.00 10.00 H new ATOM 0 HG13 VAL A 29 -11.848 -3.092 3.855 1.00 10.00 H new ATOM 0 HG21 VAL A 29 -13.732 -5.468 4.434 1.00 10.00 H new ATOM 0 HG22 VAL A 29 -12.325 -5.570 3.349 1.00 10.00 H new ATOM 0 HG23 VAL A 29 -12.479 -6.700 4.715 1.00 10.00 H new ATOM 200 N VAL A 30 -8.396 -4.035 6.237 1.00 10.00 N ATOM 201 CA VAL A 30 -7.641 -3.339 7.266 1.00 10.00 C ATOM 202 C VAL A 30 -7.844 -1.832 7.151 1.00 10.00 C ATOM 203 O VAL A 30 -7.936 -1.286 6.045 1.00 10.00 O ATOM 204 CB VAL A 30 -6.134 -3.684 7.216 1.00 10.00 C ATOM 205 CG1 VAL A 30 -5.920 -5.169 7.468 1.00 10.00 C ATOM 206 CG2 VAL A 30 -5.520 -3.277 5.890 1.00 10.00 C ATOM 0 H VAL A 30 -7.843 -4.345 5.438 1.00 10.00 H new ATOM 0 HA VAL A 30 -8.021 -3.677 8.230 1.00 10.00 H new ATOM 0 HB VAL A 30 -5.635 -3.120 8.003 1.00 10.00 H new ATOM 0 HG11 VAL A 30 -4.854 -5.395 7.429 1.00 10.00 H new ATOM 0 HG12 VAL A 30 -6.311 -5.431 8.451 1.00 10.00 H new ATOM 0 HG13 VAL A 30 -6.441 -5.746 6.704 1.00 10.00 H new ATOM 0 HG21 VAL A 30 -4.460 -3.533 5.886 1.00 10.00 H new ATOM 0 HG22 VAL A 30 -6.023 -3.803 5.079 1.00 10.00 H new ATOM 0 HG23 VAL A 30 -5.634 -2.202 5.751 1.00 10.00 H new ATOM 216 N GLN A 31 -7.936 -1.168 8.293 1.00 10.00 N ATOM 217 CA GLN A 31 -8.152 0.270 8.324 1.00 10.00 C ATOM 218 C GLN A 31 -6.891 0.989 8.787 1.00 10.00 C ATOM 219 O GLN A 31 -6.517 0.922 9.958 1.00 10.00 O ATOM 220 CB GLN A 31 -9.318 0.607 9.256 1.00 10.00 C ATOM 221 CG GLN A 31 -9.895 2.000 9.047 1.00 10.00 C ATOM 222 CD GLN A 31 -11.185 1.983 8.246 1.00 10.00 C ATOM 223 OE1 GLN A 31 -11.398 1.111 7.401 1.00 10.00 O ATOM 224 NE2 GLN A 31 -12.059 2.939 8.511 1.00 10.00 N ATOM 0 H GLN A 31 -7.864 -1.603 9.213 1.00 10.00 H new ATOM 0 HA GLN A 31 -8.394 0.605 7.316 1.00 10.00 H new ATOM 0 HB2 GLN A 31 -10.109 -0.128 9.111 1.00 10.00 H new ATOM 0 HB3 GLN A 31 -8.982 0.515 10.289 1.00 10.00 H new ATOM 0 HG2 GLN A 31 -10.080 2.462 10.017 1.00 10.00 H new ATOM 0 HG3 GLN A 31 -9.161 2.620 8.533 1.00 10.00 H new ATOM 0 HE21 GLN A 31 -11.846 3.643 9.218 1.00 10.00 H new ATOM 0 HE22 GLN A 31 -12.946 2.972 8.009 1.00 10.00 H new ATOM 233 N PHE A 32 -6.231 1.666 7.866 1.00 10.00 N ATOM 234 CA PHE A 32 -5.021 2.394 8.191 1.00 10.00 C ATOM 235 C PHE A 32 -5.359 3.817 8.603 1.00 10.00 C ATOM 236 O PHE A 32 -5.533 4.697 7.761 1.00 10.00 O ATOM 237 CB PHE A 32 -4.058 2.396 7.006 1.00 10.00 C ATOM 238 CG PHE A 32 -3.171 1.185 6.957 1.00 10.00 C ATOM 239 CD1 PHE A 32 -3.527 0.076 6.206 1.00 10.00 C ATOM 240 CD2 PHE A 32 -1.978 1.155 7.662 1.00 10.00 C ATOM 241 CE1 PHE A 32 -2.714 -1.040 6.162 1.00 10.00 C ATOM 242 CE2 PHE A 32 -1.162 0.041 7.621 1.00 10.00 C ATOM 243 CZ PHE A 32 -1.530 -1.057 6.869 1.00 10.00 C ATOM 0 H PHE A 32 -6.513 1.726 6.888 1.00 10.00 H new ATOM 0 HA PHE A 32 -4.532 1.895 9.027 1.00 10.00 H new ATOM 0 HB2 PHE A 32 -4.632 2.455 6.081 1.00 10.00 H new ATOM 0 HB3 PHE A 32 -3.437 3.291 7.053 1.00 10.00 H new ATOM 0 HD1 PHE A 32 -4.452 0.084 5.648 1.00 10.00 H new ATOM 0 HD2 PHE A 32 -1.683 2.012 8.250 1.00 10.00 H new ATOM 0 HE1 PHE A 32 -3.005 -1.898 5.575 1.00 10.00 H new ATOM 0 HE2 PHE A 32 -0.236 0.029 8.177 1.00 10.00 H new ATOM 0 HZ PHE A 32 -0.892 -1.928 6.835 1.00 10.00 H new ATOM 253 N LYS A 33 -5.464 4.029 9.905 1.00 10.00 N ATOM 254 CA LYS A 33 -5.779 5.340 10.446 1.00 10.00 C ATOM 255 C LYS A 33 -4.483 6.112 10.680 1.00 10.00 C ATOM 256 O LYS A 33 -4.022 6.263 11.810 1.00 10.00 O ATOM 257 CB LYS A 33 -6.582 5.204 11.747 1.00 10.00 C ATOM 258 CG LYS A 33 -7.038 6.533 12.331 1.00 10.00 C ATOM 259 CD LYS A 33 -7.954 6.345 13.530 1.00 10.00 C ATOM 260 CE LYS A 33 -8.123 7.641 14.310 1.00 10.00 C ATOM 261 NZ LYS A 33 -9.304 7.607 15.215 1.00 10.00 N ATOM 0 H LYS A 33 -5.335 3.304 10.611 1.00 10.00 H new ATOM 0 HA LYS A 33 -6.394 5.890 9.734 1.00 10.00 H new ATOM 0 HB2 LYS A 33 -7.457 4.581 11.559 1.00 10.00 H new ATOM 0 HB3 LYS A 33 -5.973 4.683 12.486 1.00 10.00 H new ATOM 0 HG2 LYS A 33 -6.167 7.116 12.629 1.00 10.00 H new ATOM 0 HG3 LYS A 33 -7.558 7.106 11.564 1.00 10.00 H new ATOM 0 HD2 LYS A 33 -8.929 5.992 13.193 1.00 10.00 H new ATOM 0 HD3 LYS A 33 -7.545 5.575 14.185 1.00 10.00 H new ATOM 0 HE2 LYS A 33 -7.224 7.829 14.897 1.00 10.00 H new ATOM 0 HE3 LYS A 33 -8.227 8.471 13.612 1.00 10.00 H new ATOM 0 HZ1 LYS A 33 -9.377 8.511 15.724 1.00 10.00 H new ATOM 0 HZ2 LYS A 33 -10.167 7.454 14.654 1.00 10.00 H new ATOM 0 HZ3 LYS A 33 -9.194 6.832 15.900 1.00 10.00 H new ATOM 275 N ILE A 34 -3.894 6.578 9.591 1.00 10.00 N ATOM 276 CA ILE A 34 -2.641 7.315 9.648 1.00 10.00 C ATOM 277 C ILE A 34 -2.874 8.802 9.430 1.00 10.00 C ATOM 278 O ILE A 34 -4.011 9.246 9.289 1.00 10.00 O ATOM 279 CB ILE A 34 -1.643 6.799 8.585 1.00 10.00 C ATOM 280 CG1 ILE A 34 -2.210 6.990 7.173 1.00 10.00 C ATOM 281 CG2 ILE A 34 -1.320 5.333 8.835 1.00 10.00 C ATOM 282 CD1 ILE A 34 -1.200 6.741 6.072 1.00 10.00 C ATOM 0 H ILE A 34 -4.267 6.458 8.649 1.00 10.00 H new ATOM 0 HA ILE A 34 -2.220 7.158 10.641 1.00 10.00 H new ATOM 0 HB ILE A 34 -0.723 7.378 8.664 1.00 10.00 H new ATOM 0 HG12 ILE A 34 -3.056 6.316 7.037 1.00 10.00 H new ATOM 0 HG13 ILE A 34 -2.593 8.006 7.079 1.00 10.00 H new ATOM 0 HG21 ILE A 34 -0.617 4.982 8.080 1.00 10.00 H new ATOM 0 HG22 ILE A 34 -0.876 5.222 9.824 1.00 10.00 H new ATOM 0 HG23 ILE A 34 -2.236 4.744 8.780 1.00 10.00 H new ATOM 0 HD11 ILE A 34 -1.673 6.895 5.102 1.00 10.00 H new ATOM 0 HD12 ILE A 34 -0.364 7.432 6.182 1.00 10.00 H new ATOM 0 HD13 ILE A 34 -0.835 5.716 6.138 1.00 10.00 H new ATOM 294 N LYS A 35 -1.799 9.572 9.410 1.00 10.00 N ATOM 295 CA LYS A 35 -1.903 11.002 9.190 1.00 10.00 C ATOM 296 C LYS A 35 -1.853 11.281 7.692 1.00 10.00 C ATOM 297 O LYS A 35 -1.297 10.493 6.929 1.00 10.00 O ATOM 298 CB LYS A 35 -0.774 11.746 9.909 1.00 10.00 C ATOM 299 CG LYS A 35 -0.788 11.569 11.418 1.00 10.00 C ATOM 300 CD LYS A 35 0.287 12.407 12.091 1.00 10.00 C ATOM 301 CE LYS A 35 0.264 12.224 13.599 1.00 10.00 C ATOM 302 NZ LYS A 35 1.237 13.112 14.286 1.00 10.00 N ATOM 0 H LYS A 35 -0.847 9.231 9.543 1.00 10.00 H new ATOM 0 HA LYS A 35 -2.850 11.358 9.596 1.00 10.00 H new ATOM 0 HB2 LYS A 35 0.183 11.398 9.520 1.00 10.00 H new ATOM 0 HB3 LYS A 35 -0.845 12.808 9.676 1.00 10.00 H new ATOM 0 HG2 LYS A 35 -1.766 11.850 11.809 1.00 10.00 H new ATOM 0 HG3 LYS A 35 -0.637 10.518 11.663 1.00 10.00 H new ATOM 0 HD2 LYS A 35 1.266 12.126 11.703 1.00 10.00 H new ATOM 0 HD3 LYS A 35 0.137 13.459 11.848 1.00 10.00 H new ATOM 0 HE2 LYS A 35 -0.739 12.429 13.973 1.00 10.00 H new ATOM 0 HE3 LYS A 35 0.489 11.185 13.841 1.00 10.00 H new ATOM 0 HZ1 LYS A 35 1.187 12.953 15.313 1.00 10.00 H new ATOM 0 HZ2 LYS A 35 2.198 12.900 13.949 1.00 10.00 H new ATOM 0 HZ3 LYS A 35 1.008 14.105 14.078 1.00 10.00 H new ATOM 316 N ARG A 36 -2.427 12.400 7.274 1.00 10.00 N ATOM 317 CA ARG A 36 -2.448 12.762 5.859 1.00 10.00 C ATOM 318 C ARG A 36 -1.052 13.147 5.366 1.00 10.00 C ATOM 319 O ARG A 36 -0.826 13.298 4.164 1.00 10.00 O ATOM 320 CB ARG A 36 -3.440 13.906 5.616 1.00 10.00 C ATOM 321 CG ARG A 36 -4.889 13.507 5.854 1.00 10.00 C ATOM 322 CD ARG A 36 -5.837 14.688 5.701 1.00 10.00 C ATOM 323 NE ARG A 36 -6.111 15.004 4.298 1.00 10.00 N ATOM 324 CZ ARG A 36 -7.304 14.851 3.713 1.00 10.00 C ATOM 325 NH1 ARG A 36 -8.318 14.316 4.376 1.00 10.00 N ATOM 326 NH2 ARG A 36 -7.480 15.221 2.450 1.00 10.00 N ATOM 0 H ARG A 36 -2.884 13.073 7.890 1.00 10.00 H new ATOM 0 HA ARG A 36 -2.774 11.890 5.292 1.00 10.00 H new ATOM 0 HB2 ARG A 36 -3.188 14.741 6.270 1.00 10.00 H new ATOM 0 HB3 ARG A 36 -3.332 14.260 4.591 1.00 10.00 H new ATOM 0 HG2 ARG A 36 -5.170 12.723 5.151 1.00 10.00 H new ATOM 0 HG3 ARG A 36 -4.990 13.088 6.855 1.00 10.00 H new ATOM 0 HD2 ARG A 36 -6.775 14.466 6.211 1.00 10.00 H new ATOM 0 HD3 ARG A 36 -5.407 15.562 6.190 1.00 10.00 H new ATOM 0 HE ARG A 36 -5.343 15.364 3.731 1.00 10.00 H new ATOM 0 HH11 ARG A 36 -8.194 14.016 5.343 1.00 10.00 H new ATOM 0 HH12 ARG A 36 -9.223 14.204 3.920 1.00 10.00 H new ATOM 0 HH21 ARG A 36 -6.704 15.623 1.924 1.00 10.00 H new ATOM 0 HH22 ARG A 36 -8.391 15.103 2.006 1.00 10.00 H new ATOM 340 N HIS A 37 -0.120 13.286 6.301 1.00 10.00 N ATOM 341 CA HIS A 37 1.255 13.649 5.972 1.00 10.00 C ATOM 342 C HIS A 37 2.162 12.422 5.998 1.00 10.00 C ATOM 343 O HIS A 37 3.321 12.491 5.589 1.00 10.00 O ATOM 344 CB HIS A 37 1.784 14.692 6.958 1.00 10.00 C ATOM 345 CG HIS A 37 0.844 15.834 7.198 1.00 10.00 C ATOM 346 ND1 HIS A 37 0.047 15.884 8.319 1.00 10.00 N ATOM 347 CD2 HIS A 37 0.610 16.930 6.440 1.00 10.00 C ATOM 348 CE1 HIS A 37 -0.645 17.005 8.219 1.00 10.00 C ATOM 349 NE2 HIS A 37 -0.336 17.672 7.097 1.00 10.00 N ATOM 0 H HIS A 37 -0.292 13.152 7.298 1.00 10.00 H new ATOM 0 HA HIS A 37 1.257 14.069 4.966 1.00 10.00 H new ATOM 0 HB2 HIS A 37 1.996 14.203 7.909 1.00 10.00 H new ATOM 0 HB3 HIS A 37 2.729 15.085 6.583 1.00 10.00 H new ATOM 0 HD2 HIS A 37 1.079 17.173 5.498 1.00 10.00 H new ATOM 0 HE1 HIS A 37 -1.367 17.341 8.948 1.00 10.00 H new ATOM 0 HE2 HIS A 37 -0.730 18.562 6.791 1.00 10.00 H new ATOM 357 N THR A 38 1.627 11.305 6.482 1.00 10.00 N ATOM 358 CA THR A 38 2.387 10.066 6.573 1.00 10.00 C ATOM 359 C THR A 38 2.581 9.441 5.189 1.00 10.00 C ATOM 360 O THR A 38 1.606 9.131 4.501 1.00 10.00 O ATOM 361 CB THR A 38 1.686 9.051 7.504 1.00 10.00 C ATOM 362 OG1 THR A 38 1.411 9.654 8.780 1.00 10.00 O ATOM 363 CG2 THR A 38 2.543 7.806 7.702 1.00 10.00 C ATOM 0 H THR A 38 0.667 11.234 6.818 1.00 10.00 H new ATOM 0 HA THR A 38 3.363 10.312 6.992 1.00 10.00 H new ATOM 0 HB THR A 38 0.749 8.756 7.032 1.00 10.00 H new ATOM 0 HG1 THR A 38 1.330 8.955 9.462 1.00 10.00 H new ATOM 0 HG21 THR A 38 2.025 7.109 8.361 1.00 10.00 H new ATOM 0 HG22 THR A 38 2.721 7.330 6.738 1.00 10.00 H new ATOM 0 HG23 THR A 38 3.496 8.088 8.149 1.00 10.00 H new ATOM 371 N PRO A 39 3.845 9.269 4.756 1.00 10.00 N ATOM 372 CA PRO A 39 4.168 8.677 3.450 1.00 10.00 C ATOM 373 C PRO A 39 3.518 7.308 3.256 1.00 10.00 C ATOM 374 O PRO A 39 3.629 6.426 4.113 1.00 10.00 O ATOM 375 CB PRO A 39 5.695 8.546 3.481 1.00 10.00 C ATOM 376 CG PRO A 39 6.147 9.560 4.471 1.00 10.00 C ATOM 377 CD PRO A 39 5.057 9.652 5.502 1.00 10.00 C ATOM 0 HA PRO A 39 3.798 9.287 2.626 1.00 10.00 H new ATOM 0 HB2 PRO A 39 5.999 7.542 3.777 1.00 10.00 H new ATOM 0 HB3 PRO A 39 6.127 8.733 2.498 1.00 10.00 H new ATOM 0 HG2 PRO A 39 7.091 9.264 4.928 1.00 10.00 H new ATOM 0 HG3 PRO A 39 6.313 10.525 3.992 1.00 10.00 H new ATOM 0 HD2 PRO A 39 5.241 8.981 6.341 1.00 10.00 H new ATOM 0 HD3 PRO A 39 4.975 10.659 5.911 1.00 10.00 H new ATOM 385 N LEU A 40 2.854 7.134 2.115 1.00 10.00 N ATOM 386 CA LEU A 40 2.171 5.882 1.801 1.00 10.00 C ATOM 387 C LEU A 40 3.165 4.742 1.615 1.00 10.00 C ATOM 388 O LEU A 40 2.790 3.570 1.633 1.00 10.00 O ATOM 389 CB LEU A 40 1.313 6.047 0.544 1.00 10.00 C ATOM 390 CG LEU A 40 0.125 7.001 0.695 1.00 10.00 C ATOM 391 CD1 LEU A 40 -0.514 7.275 -0.654 1.00 10.00 C ATOM 392 CD2 LEU A 40 -0.899 6.432 1.664 1.00 10.00 C ATOM 0 H LEU A 40 2.775 7.848 1.391 1.00 10.00 H new ATOM 0 HA LEU A 40 1.525 5.631 2.642 1.00 10.00 H new ATOM 0 HB2 LEU A 40 1.947 6.405 -0.267 1.00 10.00 H new ATOM 0 HB3 LEU A 40 0.938 5.068 0.246 1.00 10.00 H new ATOM 0 HG LEU A 40 0.493 7.944 1.099 1.00 10.00 H new ATOM 0 HD11 LEU A 40 -1.356 7.955 -0.526 1.00 10.00 H new ATOM 0 HD12 LEU A 40 0.221 7.729 -1.319 1.00 10.00 H new ATOM 0 HD13 LEU A 40 -0.866 6.339 -1.087 1.00 10.00 H new ATOM 0 HD21 LEU A 40 -1.735 7.125 1.758 1.00 10.00 H new ATOM 0 HD22 LEU A 40 -1.261 5.474 1.290 1.00 10.00 H new ATOM 0 HD23 LEU A 40 -0.436 6.288 2.640 1.00 10.00 H new ATOM 404 N SER A 41 4.433 5.092 1.445 1.00 10.00 N ATOM 405 CA SER A 41 5.488 4.107 1.278 1.00 10.00 C ATOM 406 C SER A 41 5.570 3.216 2.512 1.00 10.00 C ATOM 407 O SER A 41 5.716 1.995 2.410 1.00 10.00 O ATOM 408 CB SER A 41 6.812 4.831 1.059 1.00 10.00 C ATOM 409 OG SER A 41 6.646 6.226 1.260 1.00 10.00 O ATOM 0 H SER A 41 4.755 6.059 1.419 1.00 10.00 H new ATOM 0 HA SER A 41 5.271 3.479 0.414 1.00 10.00 H new ATOM 0 HB2 SER A 41 7.565 4.444 1.746 1.00 10.00 H new ATOM 0 HB3 SER A 41 7.175 4.642 0.049 1.00 10.00 H new ATOM 0 HG SER A 41 6.639 6.683 0.393 1.00 10.00 H new ATOM 415 N LYS A 42 5.434 3.839 3.676 1.00 10.00 N ATOM 416 CA LYS A 42 5.485 3.125 4.942 1.00 10.00 C ATOM 417 C LYS A 42 4.204 2.323 5.142 1.00 10.00 C ATOM 418 O LYS A 42 4.216 1.255 5.750 1.00 10.00 O ATOM 419 CB LYS A 42 5.696 4.111 6.096 1.00 10.00 C ATOM 420 CG LYS A 42 6.740 5.171 5.785 1.00 10.00 C ATOM 421 CD LYS A 42 7.393 5.726 7.041 1.00 10.00 C ATOM 422 CE LYS A 42 8.565 6.631 6.693 1.00 10.00 C ATOM 423 NZ LYS A 42 9.391 6.968 7.884 1.00 10.00 N ATOM 0 H LYS A 42 5.287 4.844 3.767 1.00 10.00 H new ATOM 0 HA LYS A 42 6.326 2.432 4.926 1.00 10.00 H new ATOM 0 HB2 LYS A 42 4.749 4.598 6.329 1.00 10.00 H new ATOM 0 HB3 LYS A 42 5.999 3.561 6.987 1.00 10.00 H new ATOM 0 HG2 LYS A 42 7.507 4.744 5.138 1.00 10.00 H new ATOM 0 HG3 LYS A 42 6.273 5.985 5.231 1.00 10.00 H new ATOM 0 HD2 LYS A 42 6.658 6.284 7.621 1.00 10.00 H new ATOM 0 HD3 LYS A 42 7.738 4.905 7.669 1.00 10.00 H new ATOM 0 HE2 LYS A 42 9.190 6.141 5.947 1.00 10.00 H new ATOM 0 HE3 LYS A 42 8.190 7.550 6.242 1.00 10.00 H new ATOM 0 HZ1 LYS A 42 10.374 7.136 7.588 1.00 10.00 H new ATOM 0 HZ2 LYS A 42 9.014 7.825 8.337 1.00 10.00 H new ATOM 0 HZ3 LYS A 42 9.363 6.178 8.560 1.00 10.00 H new ATOM 437 N LEU A 43 3.106 2.843 4.599 1.00 10.00 N ATOM 438 CA LEU A 43 1.808 2.183 4.690 1.00 10.00 C ATOM 439 C LEU A 43 1.840 0.874 3.907 1.00 10.00 C ATOM 440 O LEU A 43 1.350 -0.157 4.373 1.00 10.00 O ATOM 441 CB LEU A 43 0.711 3.110 4.145 1.00 10.00 C ATOM 442 CG LEU A 43 -0.683 2.487 4.002 1.00 10.00 C ATOM 443 CD1 LEU A 43 -1.752 3.468 4.458 1.00 10.00 C ATOM 444 CD2 LEU A 43 -0.943 2.063 2.561 1.00 10.00 C ATOM 0 H LEU A 43 3.091 3.726 4.088 1.00 10.00 H new ATOM 0 HA LEU A 43 1.587 1.961 5.734 1.00 10.00 H new ATOM 0 HB2 LEU A 43 0.635 3.976 4.802 1.00 10.00 H new ATOM 0 HB3 LEU A 43 1.025 3.478 3.168 1.00 10.00 H new ATOM 0 HG LEU A 43 -0.724 1.601 4.635 1.00 10.00 H new ATOM 0 HD11 LEU A 43 -2.735 3.011 4.350 1.00 10.00 H new ATOM 0 HD12 LEU A 43 -1.585 3.728 5.503 1.00 10.00 H new ATOM 0 HD13 LEU A 43 -1.702 4.370 3.848 1.00 10.00 H new ATOM 0 HD21 LEU A 43 -1.938 1.624 2.485 1.00 10.00 H new ATOM 0 HD22 LEU A 43 -0.880 2.934 1.908 1.00 10.00 H new ATOM 0 HD23 LEU A 43 -0.198 1.328 2.258 1.00 10.00 H new ATOM 456 N MET A 44 2.427 0.930 2.716 1.00 10.00 N ATOM 457 CA MET A 44 2.540 -0.241 1.856 1.00 10.00 C ATOM 458 C MET A 44 3.384 -1.316 2.528 1.00 10.00 C ATOM 459 O MET A 44 3.019 -2.492 2.540 1.00 10.00 O ATOM 460 CB MET A 44 3.162 0.140 0.510 1.00 10.00 C ATOM 461 CG MET A 44 2.295 1.065 -0.332 1.00 10.00 C ATOM 462 SD MET A 44 2.974 1.344 -1.979 1.00 10.00 S ATOM 463 CE MET A 44 3.292 3.106 -1.926 1.00 10.00 C ATOM 0 H MET A 44 2.834 1.779 2.323 1.00 10.00 H new ATOM 0 HA MET A 44 1.538 -0.634 1.683 1.00 10.00 H new ATOM 0 HB2 MET A 44 4.123 0.622 0.689 1.00 10.00 H new ATOM 0 HB3 MET A 44 3.362 -0.769 -0.057 1.00 10.00 H new ATOM 0 HG2 MET A 44 1.296 0.638 -0.422 1.00 10.00 H new ATOM 0 HG3 MET A 44 2.188 2.022 0.179 1.00 10.00 H new ATOM 0 HE1 MET A 44 3.108 3.539 -2.909 1.00 10.00 H new ATOM 0 HE2 MET A 44 2.632 3.573 -1.195 1.00 10.00 H new ATOM 0 HE3 MET A 44 4.330 3.280 -1.642 1.00 10.00 H new ATOM 473 N LYS A 45 4.505 -0.897 3.103 1.00 10.00 N ATOM 474 CA LYS A 45 5.404 -1.816 3.785 1.00 10.00 C ATOM 475 C LYS A 45 4.735 -2.414 5.019 1.00 10.00 C ATOM 476 O LYS A 45 4.929 -3.589 5.330 1.00 10.00 O ATOM 477 CB LYS A 45 6.697 -1.095 4.174 1.00 10.00 C ATOM 478 CG LYS A 45 7.767 -1.144 3.091 1.00 10.00 C ATOM 479 CD LYS A 45 8.395 0.222 2.851 1.00 10.00 C ATOM 480 CE LYS A 45 9.483 0.151 1.791 1.00 10.00 C ATOM 481 NZ LYS A 45 9.932 1.501 1.356 1.00 10.00 N ATOM 0 H LYS A 45 4.812 0.076 3.110 1.00 10.00 H new ATOM 0 HA LYS A 45 5.647 -2.631 3.103 1.00 10.00 H new ATOM 0 HB2 LYS A 45 6.469 -0.054 4.402 1.00 10.00 H new ATOM 0 HB3 LYS A 45 7.093 -1.542 5.086 1.00 10.00 H new ATOM 0 HG2 LYS A 45 8.542 -1.854 3.378 1.00 10.00 H new ATOM 0 HG3 LYS A 45 7.328 -1.510 2.163 1.00 10.00 H new ATOM 0 HD2 LYS A 45 7.626 0.929 2.539 1.00 10.00 H new ATOM 0 HD3 LYS A 45 8.816 0.600 3.783 1.00 10.00 H new ATOM 0 HE2 LYS A 45 10.335 -0.404 2.184 1.00 10.00 H new ATOM 0 HE3 LYS A 45 9.112 -0.402 0.928 1.00 10.00 H new ATOM 0 HZ1 LYS A 45 9.826 1.587 0.325 1.00 10.00 H new ATOM 0 HZ2 LYS A 45 9.354 2.227 1.825 1.00 10.00 H new ATOM 0 HZ3 LYS A 45 10.931 1.634 1.613 1.00 10.00 H new ATOM 495 N ALA A 46 3.931 -1.607 5.709 1.00 10.00 N ATOM 496 CA ALA A 46 3.233 -2.056 6.908 1.00 10.00 C ATOM 497 C ALA A 46 2.306 -3.228 6.601 1.00 10.00 C ATOM 498 O ALA A 46 2.275 -4.218 7.334 1.00 10.00 O ATOM 499 CB ALA A 46 2.447 -0.910 7.529 1.00 10.00 C ATOM 0 H ALA A 46 3.748 -0.636 5.456 1.00 10.00 H new ATOM 0 HA ALA A 46 3.983 -2.396 7.623 1.00 10.00 H new ATOM 0 HB1 ALA A 46 1.933 -1.264 8.423 1.00 10.00 H new ATOM 0 HB2 ALA A 46 3.130 -0.104 7.798 1.00 10.00 H new ATOM 0 HB3 ALA A 46 1.715 -0.540 6.811 1.00 10.00 H new ATOM 505 N TYR A 47 1.559 -3.121 5.509 1.00 10.00 N ATOM 506 CA TYR A 47 0.644 -4.181 5.112 1.00 10.00 C ATOM 507 C TYR A 47 1.433 -5.399 4.636 1.00 10.00 C ATOM 508 O TYR A 47 1.074 -6.541 4.929 1.00 10.00 O ATOM 509 CB TYR A 47 -0.302 -3.691 4.010 1.00 10.00 C ATOM 510 CG TYR A 47 -1.359 -4.702 3.611 1.00 10.00 C ATOM 511 CD1 TYR A 47 -1.394 -5.231 2.327 1.00 10.00 C ATOM 512 CD2 TYR A 47 -2.318 -5.132 4.523 1.00 10.00 C ATOM 513 CE1 TYR A 47 -2.352 -6.159 1.962 1.00 10.00 C ATOM 514 CE2 TYR A 47 -3.280 -6.060 4.166 1.00 10.00 C ATOM 515 CZ TYR A 47 -3.294 -6.569 2.885 1.00 10.00 C ATOM 516 OH TYR A 47 -4.249 -7.497 2.526 1.00 10.00 O ATOM 0 H TYR A 47 1.569 -2.314 4.885 1.00 10.00 H new ATOM 0 HA TYR A 47 0.043 -4.466 5.975 1.00 10.00 H new ATOM 0 HB2 TYR A 47 -0.795 -2.779 4.347 1.00 10.00 H new ATOM 0 HB3 TYR A 47 0.286 -3.429 3.130 1.00 10.00 H new ATOM 0 HD1 TYR A 47 -0.660 -4.912 1.601 1.00 10.00 H new ATOM 0 HD2 TYR A 47 -2.311 -4.734 5.527 1.00 10.00 H new ATOM 0 HE1 TYR A 47 -2.364 -6.561 0.960 1.00 10.00 H new ATOM 0 HE2 TYR A 47 -4.016 -6.384 4.887 1.00 10.00 H new ATOM 0 HH TYR A 47 -4.834 -7.677 3.291 1.00 10.00 H new ATOM 526 N CYS A 48 2.527 -5.142 3.929 1.00 10.00 N ATOM 527 CA CYS A 48 3.377 -6.205 3.404 1.00 10.00 C ATOM 528 C CYS A 48 3.984 -7.033 4.534 1.00 10.00 C ATOM 529 O CYS A 48 4.131 -8.254 4.416 1.00 10.00 O ATOM 530 CB CYS A 48 4.488 -5.606 2.544 1.00 10.00 C ATOM 531 SG CYS A 48 5.218 -6.773 1.373 1.00 10.00 S ATOM 0 H CYS A 48 2.848 -4.200 3.705 1.00 10.00 H new ATOM 0 HA CYS A 48 2.760 -6.863 2.793 1.00 10.00 H new ATOM 0 HB2 CYS A 48 4.088 -4.755 1.992 1.00 10.00 H new ATOM 0 HB3 CYS A 48 5.272 -5.223 3.197 1.00 10.00 H new ATOM 0 HG CYS A 48 6.109 -7.498 1.981 1.00 10.00 H new ATOM 537 N GLU A 49 4.329 -6.361 5.625 1.00 10.00 N ATOM 538 CA GLU A 49 4.910 -7.017 6.793 1.00 10.00 C ATOM 539 C GLU A 49 3.954 -8.064 7.359 1.00 10.00 C ATOM 540 O GLU A 49 4.374 -9.095 7.883 1.00 10.00 O ATOM 541 CB GLU A 49 5.228 -5.980 7.870 1.00 10.00 C ATOM 542 CG GLU A 49 6.521 -5.225 7.625 1.00 10.00 C ATOM 543 CD GLU A 49 7.725 -5.960 8.168 1.00 10.00 C ATOM 544 OE1 GLU A 49 8.332 -5.472 9.140 1.00 10.00 O ATOM 545 OE2 GLU A 49 8.061 -7.039 7.640 1.00 10.00 O ATOM 0 H GLU A 49 4.216 -5.352 5.727 1.00 10.00 H new ATOM 0 HA GLU A 49 5.829 -7.515 6.483 1.00 10.00 H new ATOM 0 HB2 GLU A 49 4.406 -5.266 7.929 1.00 10.00 H new ATOM 0 HB3 GLU A 49 5.287 -6.479 8.837 1.00 10.00 H new ATOM 0 HG2 GLU A 49 6.648 -5.064 6.554 1.00 10.00 H new ATOM 0 HG3 GLU A 49 6.458 -4.241 8.090 1.00 10.00 H new ATOM 552 N ARG A 50 2.665 -7.790 7.238 1.00 10.00 N ATOM 553 CA ARG A 50 1.639 -8.693 7.736 1.00 10.00 C ATOM 554 C ARG A 50 1.431 -9.862 6.788 1.00 10.00 C ATOM 555 O ARG A 50 1.076 -10.961 7.212 1.00 10.00 O ATOM 556 CB ARG A 50 0.331 -7.937 7.925 1.00 10.00 C ATOM 557 CG ARG A 50 0.429 -6.831 8.955 1.00 10.00 C ATOM 558 CD ARG A 50 -0.758 -5.900 8.879 1.00 10.00 C ATOM 559 NE ARG A 50 -1.008 -5.244 10.154 1.00 10.00 N ATOM 560 CZ ARG A 50 -2.222 -4.980 10.620 1.00 10.00 C ATOM 561 NH1 ARG A 50 -3.294 -5.294 9.906 1.00 10.00 N ATOM 562 NH2 ARG A 50 -2.368 -4.403 11.801 1.00 10.00 N ATOM 0 H ARG A 50 2.303 -6.945 6.797 1.00 10.00 H new ATOM 0 HA ARG A 50 1.970 -9.089 8.696 1.00 10.00 H new ATOM 0 HB2 ARG A 50 0.023 -7.510 6.970 1.00 10.00 H new ATOM 0 HB3 ARG A 50 -0.447 -8.638 8.226 1.00 10.00 H new ATOM 0 HG2 ARG A 50 0.489 -7.265 9.953 1.00 10.00 H new ATOM 0 HG3 ARG A 50 1.347 -6.266 8.798 1.00 10.00 H new ATOM 0 HD2 ARG A 50 -0.582 -5.147 8.110 1.00 10.00 H new ATOM 0 HD3 ARG A 50 -1.643 -6.461 8.579 1.00 10.00 H new ATOM 0 HE ARG A 50 -0.205 -4.972 10.721 1.00 10.00 H new ATOM 0 HH11 ARG A 50 -3.187 -5.740 8.995 1.00 10.00 H new ATOM 0 HH12 ARG A 50 -4.226 -5.089 10.268 1.00 10.00 H new ATOM 0 HH21 ARG A 50 -1.547 -4.160 12.355 1.00 10.00 H new ATOM 0 HH22 ARG A 50 -3.302 -4.201 12.158 1.00 10.00 H new ATOM 576 N GLN A 51 1.647 -9.622 5.503 1.00 10.00 N ATOM 577 CA GLN A 51 1.491 -10.666 4.502 1.00 10.00 C ATOM 578 C GLN A 51 2.674 -11.627 4.565 1.00 10.00 C ATOM 579 O GLN A 51 2.546 -12.812 4.259 1.00 10.00 O ATOM 580 CB GLN A 51 1.374 -10.062 3.099 1.00 10.00 C ATOM 581 CG GLN A 51 0.278 -9.015 2.971 1.00 10.00 C ATOM 582 CD GLN A 51 -1.094 -9.543 3.346 1.00 10.00 C ATOM 583 OE1 GLN A 51 -1.492 -9.505 4.512 1.00 10.00 O ATOM 584 NE2 GLN A 51 -1.831 -10.031 2.360 1.00 10.00 N ATOM 0 H GLN A 51 1.930 -8.716 5.130 1.00 10.00 H new ATOM 0 HA GLN A 51 0.573 -11.214 4.714 1.00 10.00 H new ATOM 0 HB2 GLN A 51 2.328 -9.611 2.827 1.00 10.00 H new ATOM 0 HB3 GLN A 51 1.184 -10.862 2.384 1.00 10.00 H new ATOM 0 HG2 GLN A 51 0.520 -8.164 3.608 1.00 10.00 H new ATOM 0 HG3 GLN A 51 0.252 -8.648 1.945 1.00 10.00 H new ATOM 0 HE21 GLN A 51 -1.465 -10.044 1.408 1.00 10.00 H new ATOM 0 HE22 GLN A 51 -2.765 -10.393 2.552 1.00 10.00 H new ATOM 593 N GLY A 52 3.823 -11.099 4.975 1.00 10.00 N ATOM 594 CA GLY A 52 5.020 -11.906 5.086 1.00 10.00 C ATOM 595 C GLY A 52 5.721 -12.080 3.757 1.00 10.00 C ATOM 596 O GLY A 52 6.410 -13.078 3.535 1.00 10.00 O ATOM 0 H GLY A 52 3.944 -10.120 5.233 1.00 10.00 H new ATOM 0 HA2 GLY A 52 5.704 -11.442 5.797 1.00 10.00 H new ATOM 0 HA3 GLY A 52 4.759 -12.885 5.488 1.00 10.00 H new ATOM 600 N LEU A 53 5.552 -11.106 2.876 1.00 10.00 N ATOM 601 CA LEU A 53 6.168 -11.148 1.557 1.00 10.00 C ATOM 602 C LEU A 53 6.964 -9.879 1.302 1.00 10.00 C ATOM 603 O LEU A 53 7.049 -9.001 2.166 1.00 10.00 O ATOM 604 CB LEU A 53 5.105 -11.313 0.466 1.00 10.00 C ATOM 605 CG LEU A 53 4.446 -12.693 0.393 1.00 10.00 C ATOM 606 CD1 LEU A 53 3.089 -12.672 1.076 1.00 10.00 C ATOM 607 CD2 LEU A 53 4.309 -13.138 -1.056 1.00 10.00 C ATOM 0 H LEU A 53 4.991 -10.273 3.051 1.00 10.00 H new ATOM 0 HA LEU A 53 6.840 -12.005 1.528 1.00 10.00 H new ATOM 0 HB2 LEU A 53 4.327 -10.566 0.625 1.00 10.00 H new ATOM 0 HB3 LEU A 53 5.563 -11.097 -0.499 1.00 10.00 H new ATOM 0 HG LEU A 53 5.081 -13.408 0.916 1.00 10.00 H new ATOM 0 HD11 LEU A 53 2.635 -13.661 1.014 1.00 10.00 H new ATOM 0 HD12 LEU A 53 3.213 -12.394 2.123 1.00 10.00 H new ATOM 0 HD13 LEU A 53 2.444 -11.946 0.582 1.00 10.00 H new ATOM 0 HD21 LEU A 53 3.839 -14.121 -1.092 1.00 10.00 H new ATOM 0 HD22 LEU A 53 3.694 -12.421 -1.600 1.00 10.00 H new ATOM 0 HD23 LEU A 53 5.296 -13.191 -1.515 1.00 10.00 H new ATOM 619 N SER A 54 7.540 -9.783 0.115 1.00 10.00 N ATOM 620 CA SER A 54 8.319 -8.620 -0.262 1.00 10.00 C ATOM 621 C SER A 54 7.427 -7.592 -0.948 1.00 10.00 C ATOM 622 O SER A 54 6.538 -7.949 -1.724 1.00 10.00 O ATOM 623 CB SER A 54 9.464 -9.029 -1.190 1.00 10.00 C ATOM 624 OG SER A 54 10.261 -7.910 -1.542 1.00 10.00 O ATOM 0 H SER A 54 7.481 -10.502 -0.606 1.00 10.00 H new ATOM 0 HA SER A 54 8.742 -8.174 0.638 1.00 10.00 H new ATOM 0 HB2 SER A 54 10.083 -9.780 -0.699 1.00 10.00 H new ATOM 0 HB3 SER A 54 9.059 -9.489 -2.091 1.00 10.00 H new ATOM 0 HG SER A 54 10.987 -8.199 -2.134 1.00 10.00 H new ATOM 630 N MET A 55 7.675 -6.317 -0.666 1.00 10.00 N ATOM 631 CA MET A 55 6.892 -5.231 -1.250 1.00 10.00 C ATOM 632 C MET A 55 7.080 -5.186 -2.763 1.00 10.00 C ATOM 633 O MET A 55 6.230 -4.684 -3.497 1.00 10.00 O ATOM 634 CB MET A 55 7.301 -3.892 -0.626 1.00 10.00 C ATOM 635 CG MET A 55 6.525 -2.697 -1.163 1.00 10.00 C ATOM 636 SD MET A 55 7.107 -1.129 -0.490 1.00 10.00 S ATOM 637 CE MET A 55 6.239 0.029 -1.544 1.00 10.00 C ATOM 0 H MET A 55 8.414 -6.009 -0.035 1.00 10.00 H new ATOM 0 HA MET A 55 5.838 -5.413 -1.039 1.00 10.00 H new ATOM 0 HB2 MET A 55 7.161 -3.948 0.454 1.00 10.00 H new ATOM 0 HB3 MET A 55 8.365 -3.731 -0.802 1.00 10.00 H new ATOM 0 HG2 MET A 55 6.608 -2.674 -2.250 1.00 10.00 H new ATOM 0 HG3 MET A 55 5.468 -2.819 -0.926 1.00 10.00 H new ATOM 0 HE1 MET A 55 5.965 0.912 -0.966 1.00 10.00 H new ATOM 0 HE2 MET A 55 6.885 0.323 -2.371 1.00 10.00 H new ATOM 0 HE3 MET A 55 5.338 -0.442 -1.937 1.00 10.00 H new ATOM 647 N ARG A 56 8.185 -5.746 -3.227 1.00 10.00 N ATOM 648 CA ARG A 56 8.493 -5.765 -4.647 1.00 10.00 C ATOM 649 C ARG A 56 7.653 -6.814 -5.379 1.00 10.00 C ATOM 650 O ARG A 56 7.610 -6.835 -6.610 1.00 10.00 O ATOM 651 CB ARG A 56 9.984 -6.045 -4.845 1.00 10.00 C ATOM 652 CG ARG A 56 10.520 -5.604 -6.195 1.00 10.00 C ATOM 653 CD ARG A 56 12.040 -5.615 -6.223 1.00 10.00 C ATOM 654 NE ARG A 56 12.557 -5.079 -7.480 1.00 10.00 N ATOM 655 CZ ARG A 56 13.224 -3.929 -7.588 1.00 10.00 C ATOM 656 NH1 ARG A 56 13.507 -3.210 -6.506 1.00 10.00 N ATOM 657 NH2 ARG A 56 13.622 -3.508 -8.781 1.00 10.00 N ATOM 0 H ARG A 56 8.886 -6.195 -2.638 1.00 10.00 H new ATOM 0 HA ARG A 56 8.249 -4.790 -5.068 1.00 10.00 H new ATOM 0 HB2 ARG A 56 10.546 -5.539 -4.060 1.00 10.00 H new ATOM 0 HB3 ARG A 56 10.162 -7.114 -4.726 1.00 10.00 H new ATOM 0 HG2 ARG A 56 10.136 -6.264 -6.973 1.00 10.00 H new ATOM 0 HG3 ARG A 56 10.158 -4.601 -6.421 1.00 10.00 H new ATOM 0 HD2 ARG A 56 12.424 -5.026 -5.390 1.00 10.00 H new ATOM 0 HD3 ARG A 56 12.400 -6.635 -6.086 1.00 10.00 H new ATOM 0 HE ARG A 56 12.397 -5.619 -8.330 1.00 10.00 H new ATOM 0 HH11 ARG A 56 13.214 -3.537 -5.585 1.00 10.00 H new ATOM 0 HH12 ARG A 56 14.017 -2.332 -6.597 1.00 10.00 H new ATOM 0 HH21 ARG A 56 13.418 -4.063 -9.612 1.00 10.00 H new ATOM 0 HH22 ARG A 56 14.132 -2.629 -8.868 1.00 10.00 H new ATOM 671 N GLN A 57 6.967 -7.662 -4.623 1.00 10.00 N ATOM 672 CA GLN A 57 6.146 -8.715 -5.211 1.00 10.00 C ATOM 673 C GLN A 57 4.681 -8.292 -5.324 1.00 10.00 C ATOM 674 O GLN A 57 3.878 -8.975 -5.961 1.00 10.00 O ATOM 675 CB GLN A 57 6.262 -9.995 -4.379 1.00 10.00 C ATOM 676 CG GLN A 57 5.974 -11.262 -5.167 1.00 10.00 C ATOM 677 CD GLN A 57 6.059 -12.509 -4.313 1.00 10.00 C ATOM 678 OE1 GLN A 57 6.796 -12.554 -3.329 1.00 10.00 O ATOM 679 NE2 GLN A 57 5.306 -13.532 -4.685 1.00 10.00 N ATOM 0 H GLN A 57 6.962 -7.642 -3.603 1.00 10.00 H new ATOM 0 HA GLN A 57 6.515 -8.903 -6.219 1.00 10.00 H new ATOM 0 HB2 GLN A 57 7.267 -10.057 -3.962 1.00 10.00 H new ATOM 0 HB3 GLN A 57 5.571 -9.935 -3.538 1.00 10.00 H new ATOM 0 HG2 GLN A 57 4.979 -11.194 -5.607 1.00 10.00 H new ATOM 0 HG3 GLN A 57 6.682 -11.342 -5.992 1.00 10.00 H new ATOM 0 HE21 GLN A 57 4.709 -13.453 -5.508 1.00 10.00 H new ATOM 0 HE22 GLN A 57 5.323 -14.399 -4.149 1.00 10.00 H new ATOM 688 N ILE A 58 4.328 -7.168 -4.715 1.00 10.00 N ATOM 689 CA ILE A 58 2.952 -6.687 -4.762 1.00 10.00 C ATOM 690 C ILE A 58 2.877 -5.290 -5.369 1.00 10.00 C ATOM 691 O ILE A 58 3.903 -4.635 -5.569 1.00 10.00 O ATOM 692 CB ILE A 58 2.293 -6.681 -3.365 1.00 10.00 C ATOM 693 CG1 ILE A 58 3.228 -6.054 -2.325 1.00 10.00 C ATOM 694 CG2 ILE A 58 1.906 -8.096 -2.960 1.00 10.00 C ATOM 695 CD1 ILE A 58 2.622 -5.965 -0.940 1.00 10.00 C ATOM 0 H ILE A 58 4.969 -6.576 -4.187 1.00 10.00 H new ATOM 0 HA ILE A 58 2.401 -7.382 -5.396 1.00 10.00 H new ATOM 0 HB ILE A 58 1.388 -6.075 -3.412 1.00 10.00 H new ATOM 0 HG12 ILE A 58 4.146 -6.640 -2.274 1.00 10.00 H new ATOM 0 HG13 ILE A 58 3.507 -5.053 -2.656 1.00 10.00 H new ATOM 0 HG21 ILE A 58 1.443 -8.078 -1.974 1.00 10.00 H new ATOM 0 HG22 ILE A 58 1.201 -8.502 -3.685 1.00 10.00 H new ATOM 0 HG23 ILE A 58 2.797 -8.723 -2.931 1.00 10.00 H new ATOM 0 HD11 ILE A 58 3.340 -5.511 -0.257 1.00 10.00 H new ATOM 0 HD12 ILE A 58 1.720 -5.354 -0.976 1.00 10.00 H new ATOM 0 HD13 ILE A 58 2.369 -6.965 -0.589 1.00 10.00 H new ATOM 707 N ARG A 59 1.663 -4.854 -5.684 1.00 10.00 N ATOM 708 CA ARG A 59 1.439 -3.539 -6.279 1.00 10.00 C ATOM 709 C ARG A 59 0.241 -2.850 -5.634 1.00 10.00 C ATOM 710 O ARG A 59 -0.807 -3.467 -5.446 1.00 10.00 O ATOM 711 CB ARG A 59 1.189 -3.661 -7.788 1.00 10.00 C ATOM 712 CG ARG A 59 2.320 -4.316 -8.565 1.00 10.00 C ATOM 713 CD ARG A 59 3.575 -3.462 -8.561 1.00 10.00 C ATOM 714 NE ARG A 59 4.620 -4.037 -9.404 1.00 10.00 N ATOM 715 CZ ARG A 59 5.577 -4.851 -8.965 1.00 10.00 C ATOM 716 NH1 ARG A 59 5.645 -5.183 -7.679 1.00 10.00 N ATOM 717 NH2 ARG A 59 6.470 -5.329 -9.821 1.00 10.00 N ATOM 0 H ARG A 59 0.812 -5.396 -5.536 1.00 10.00 H new ATOM 0 HA ARG A 59 2.336 -2.944 -6.106 1.00 10.00 H new ATOM 0 HB2 ARG A 59 0.276 -4.235 -7.947 1.00 10.00 H new ATOM 0 HB3 ARG A 59 1.014 -2.665 -8.196 1.00 10.00 H new ATOM 0 HG2 ARG A 59 2.542 -5.291 -8.131 1.00 10.00 H new ATOM 0 HG3 ARG A 59 2.002 -4.490 -9.593 1.00 10.00 H new ATOM 0 HD2 ARG A 59 3.334 -2.459 -8.913 1.00 10.00 H new ATOM 0 HD3 ARG A 59 3.944 -3.362 -7.540 1.00 10.00 H new ATOM 0 HE ARG A 59 4.616 -3.799 -10.396 1.00 10.00 H new ATOM 0 HH11 ARG A 59 4.960 -4.813 -7.020 1.00 10.00 H new ATOM 0 HH12 ARG A 59 6.382 -5.808 -7.352 1.00 10.00 H new ATOM 0 HH21 ARG A 59 6.420 -5.072 -10.807 1.00 10.00 H new ATOM 0 HH22 ARG A 59 7.207 -5.953 -9.494 1.00 10.00 H new ATOM 731 N PHE A 60 0.399 -1.578 -5.297 1.00 10.00 N ATOM 732 CA PHE A 60 -0.681 -0.808 -4.691 1.00 10.00 C ATOM 733 C PHE A 60 -1.229 0.189 -5.705 1.00 10.00 C ATOM 734 O PHE A 60 -0.467 0.887 -6.377 1.00 10.00 O ATOM 735 CB PHE A 60 -0.191 -0.074 -3.439 1.00 10.00 C ATOM 736 CG PHE A 60 0.032 -0.972 -2.253 1.00 10.00 C ATOM 737 CD1 PHE A 60 1.108 -1.847 -2.219 1.00 10.00 C ATOM 738 CD2 PHE A 60 -0.829 -0.934 -1.168 1.00 10.00 C ATOM 739 CE1 PHE A 60 1.318 -2.665 -1.126 1.00 10.00 C ATOM 740 CE2 PHE A 60 -0.625 -1.751 -0.073 1.00 10.00 C ATOM 741 CZ PHE A 60 0.450 -2.618 -0.053 1.00 10.00 C ATOM 0 H PHE A 60 1.265 -1.056 -5.433 1.00 10.00 H new ATOM 0 HA PHE A 60 -1.474 -1.493 -4.393 1.00 10.00 H new ATOM 0 HB2 PHE A 60 0.741 0.440 -3.673 1.00 10.00 H new ATOM 0 HB3 PHE A 60 -0.919 0.692 -3.171 1.00 10.00 H new ATOM 0 HD1 PHE A 60 1.789 -1.889 -3.056 1.00 10.00 H new ATOM 0 HD2 PHE A 60 -1.670 -0.257 -1.179 1.00 10.00 H new ATOM 0 HE1 PHE A 60 2.160 -3.341 -1.111 1.00 10.00 H new ATOM 0 HE2 PHE A 60 -1.305 -1.712 0.766 1.00 10.00 H new ATOM 0 HZ PHE A 60 0.612 -3.259 0.801 1.00 10.00 H new ATOM 751 N ARG A 61 -2.546 0.248 -5.824 1.00 10.00 N ATOM 752 CA ARG A 61 -3.178 1.147 -6.777 1.00 10.00 C ATOM 753 C ARG A 61 -4.214 2.046 -6.121 1.00 10.00 C ATOM 754 O ARG A 61 -4.936 1.631 -5.213 1.00 10.00 O ATOM 755 CB ARG A 61 -3.836 0.339 -7.893 1.00 10.00 C ATOM 756 CG ARG A 61 -2.928 0.091 -9.083 1.00 10.00 C ATOM 757 CD ARG A 61 -3.415 -1.089 -9.903 1.00 10.00 C ATOM 758 NE ARG A 61 -3.071 -0.958 -11.315 1.00 10.00 N ATOM 759 CZ ARG A 61 -3.955 -1.050 -12.309 1.00 10.00 C ATOM 760 NH1 ARG A 61 -5.245 -1.228 -12.048 1.00 10.00 N ATOM 761 NH2 ARG A 61 -3.549 -0.947 -13.566 1.00 10.00 N ATOM 0 H ARG A 61 -3.196 -0.314 -5.275 1.00 10.00 H new ATOM 0 HA ARG A 61 -2.397 1.788 -7.187 1.00 10.00 H new ATOM 0 HB2 ARG A 61 -4.163 -0.620 -7.491 1.00 10.00 H new ATOM 0 HB3 ARG A 61 -4.729 0.864 -8.232 1.00 10.00 H new ATOM 0 HG2 ARG A 61 -2.891 0.983 -9.709 1.00 10.00 H new ATOM 0 HG3 ARG A 61 -1.912 -0.097 -8.736 1.00 10.00 H new ATOM 0 HD2 ARG A 61 -2.980 -2.008 -9.509 1.00 10.00 H new ATOM 0 HD3 ARG A 61 -4.497 -1.179 -9.801 1.00 10.00 H new ATOM 0 HE ARG A 61 -2.095 -0.786 -11.556 1.00 10.00 H new ATOM 0 HH11 ARG A 61 -5.565 -1.295 -11.082 1.00 10.00 H new ATOM 0 HH12 ARG A 61 -5.915 -1.297 -12.814 1.00 10.00 H new ATOM 0 HH21 ARG A 61 -2.561 -0.798 -13.772 1.00 10.00 H new ATOM 0 HH22 ARG A 61 -4.224 -1.017 -14.327 1.00 10.00 H new ATOM 775 N PHE A 62 -4.272 3.283 -6.595 1.00 10.00 N ATOM 776 CA PHE A 62 -5.219 4.268 -6.102 1.00 10.00 C ATOM 777 C PHE A 62 -5.906 4.942 -7.282 1.00 10.00 C ATOM 778 O PHE A 62 -5.241 5.540 -8.132 1.00 10.00 O ATOM 779 CB PHE A 62 -4.511 5.318 -5.233 1.00 10.00 C ATOM 780 CG PHE A 62 -5.309 6.579 -5.026 1.00 10.00 C ATOM 781 CD1 PHE A 62 -6.415 6.590 -4.191 1.00 10.00 C ATOM 782 CD2 PHE A 62 -4.957 7.753 -5.675 1.00 10.00 C ATOM 783 CE1 PHE A 62 -7.150 7.743 -4.006 1.00 10.00 C ATOM 784 CE2 PHE A 62 -5.689 8.911 -5.493 1.00 10.00 C ATOM 785 CZ PHE A 62 -6.789 8.906 -4.657 1.00 10.00 C ATOM 0 H PHE A 62 -3.661 3.630 -7.334 1.00 10.00 H new ATOM 0 HA PHE A 62 -5.963 3.764 -5.485 1.00 10.00 H new ATOM 0 HB2 PHE A 62 -4.286 4.879 -4.261 1.00 10.00 H new ATOM 0 HB3 PHE A 62 -3.558 5.575 -5.695 1.00 10.00 H new ATOM 0 HD1 PHE A 62 -6.705 5.685 -3.679 1.00 10.00 H new ATOM 0 HD2 PHE A 62 -4.099 7.762 -6.331 1.00 10.00 H new ATOM 0 HE1 PHE A 62 -8.009 7.736 -3.351 1.00 10.00 H new ATOM 0 HE2 PHE A 62 -5.402 9.818 -6.003 1.00 10.00 H new ATOM 0 HZ PHE A 62 -7.364 9.809 -4.513 1.00 10.00 H new ATOM 795 N ASP A 63 -7.227 4.807 -7.347 1.00 10.00 N ATOM 796 CA ASP A 63 -8.029 5.408 -8.416 1.00 10.00 C ATOM 797 C ASP A 63 -7.613 4.886 -9.794 1.00 10.00 C ATOM 798 O ASP A 63 -7.849 5.530 -10.817 1.00 10.00 O ATOM 799 CB ASP A 63 -7.922 6.939 -8.364 1.00 10.00 C ATOM 800 CG ASP A 63 -9.032 7.629 -9.127 1.00 10.00 C ATOM 801 OD1 ASP A 63 -10.194 7.174 -9.040 1.00 10.00 O ATOM 802 OD2 ASP A 63 -8.750 8.633 -9.813 1.00 10.00 O ATOM 0 H ASP A 63 -7.773 4.281 -6.665 1.00 10.00 H new ATOM 0 HA ASP A 63 -9.068 5.120 -8.256 1.00 10.00 H new ATOM 0 HB2 ASP A 63 -7.944 7.265 -7.324 1.00 10.00 H new ATOM 0 HB3 ASP A 63 -6.960 7.246 -8.774 1.00 10.00 H new ATOM 807 N GLY A 64 -6.997 3.711 -9.815 1.00 10.00 N ATOM 808 CA GLY A 64 -6.565 3.116 -11.065 1.00 10.00 C ATOM 809 C GLY A 64 -5.106 3.393 -11.380 1.00 10.00 C ATOM 810 O GLY A 64 -4.542 2.804 -12.300 1.00 10.00 O ATOM 0 H GLY A 64 -6.788 3.157 -8.984 1.00 10.00 H new ATOM 0 HA2 GLY A 64 -6.724 2.038 -11.022 1.00 10.00 H new ATOM 0 HA3 GLY A 64 -7.185 3.498 -11.876 1.00 10.00 H new ATOM 814 N GLN A 65 -4.493 4.284 -10.616 1.00 10.00 N ATOM 815 CA GLN A 65 -3.096 4.640 -10.827 1.00 10.00 C ATOM 816 C GLN A 65 -2.208 4.023 -9.748 1.00 10.00 C ATOM 817 O GLN A 65 -2.583 3.986 -8.578 1.00 10.00 O ATOM 818 CB GLN A 65 -2.933 6.164 -10.814 1.00 10.00 C ATOM 819 CG GLN A 65 -3.554 6.863 -12.014 1.00 10.00 C ATOM 820 CD GLN A 65 -2.783 6.610 -13.292 1.00 10.00 C ATOM 821 OE1 GLN A 65 -3.070 5.670 -14.032 1.00 10.00 O ATOM 822 NE2 GLN A 65 -1.791 7.445 -13.557 1.00 10.00 N ATOM 0 H GLN A 65 -4.941 4.775 -9.842 1.00 10.00 H new ATOM 0 HA GLN A 65 -2.790 4.249 -11.797 1.00 10.00 H new ATOM 0 HB2 GLN A 65 -3.383 6.559 -9.903 1.00 10.00 H new ATOM 0 HB3 GLN A 65 -1.871 6.405 -10.776 1.00 10.00 H new ATOM 0 HG2 GLN A 65 -4.581 6.521 -12.139 1.00 10.00 H new ATOM 0 HG3 GLN A 65 -3.596 7.936 -11.825 1.00 10.00 H new ATOM 0 HE21 GLN A 65 -1.585 8.212 -12.917 1.00 10.00 H new ATOM 0 HE22 GLN A 65 -1.232 7.321 -14.401 1.00 10.00 H new ATOM 831 N PRO A 66 -1.033 3.505 -10.131 1.00 10.00 N ATOM 832 CA PRO A 66 -0.088 2.914 -9.178 1.00 10.00 C ATOM 833 C PRO A 66 0.501 3.973 -8.245 1.00 10.00 C ATOM 834 O PRO A 66 0.913 5.048 -8.691 1.00 10.00 O ATOM 835 CB PRO A 66 1.001 2.312 -10.075 1.00 10.00 C ATOM 836 CG PRO A 66 0.907 3.065 -11.358 1.00 10.00 C ATOM 837 CD PRO A 66 -0.538 3.442 -11.518 1.00 10.00 C ATOM 0 HA PRO A 66 -0.559 2.179 -8.525 1.00 10.00 H new ATOM 0 HB2 PRO A 66 1.988 2.422 -9.625 1.00 10.00 H new ATOM 0 HB3 PRO A 66 0.838 1.246 -10.231 1.00 10.00 H new ATOM 0 HG2 PRO A 66 1.540 3.952 -11.336 1.00 10.00 H new ATOM 0 HG3 PRO A 66 1.244 2.453 -12.194 1.00 10.00 H new ATOM 0 HD2 PRO A 66 -0.649 4.399 -12.028 1.00 10.00 H new ATOM 0 HD3 PRO A 66 -1.083 2.703 -12.105 1.00 10.00 H new ATOM 845 N ILE A 67 0.531 3.671 -6.955 1.00 10.00 N ATOM 846 CA ILE A 67 1.053 4.603 -5.966 1.00 10.00 C ATOM 847 C ILE A 67 2.577 4.546 -5.914 1.00 10.00 C ATOM 848 O ILE A 67 3.174 3.478 -6.071 1.00 10.00 O ATOM 849 CB ILE A 67 0.484 4.309 -4.561 1.00 10.00 C ATOM 850 CG1 ILE A 67 -1.038 4.172 -4.624 1.00 10.00 C ATOM 851 CG2 ILE A 67 0.875 5.408 -3.583 1.00 10.00 C ATOM 852 CD1 ILE A 67 -1.664 3.777 -3.305 1.00 10.00 C ATOM 0 H ILE A 67 0.200 2.787 -6.568 1.00 10.00 H new ATOM 0 HA ILE A 67 0.740 5.602 -6.271 1.00 10.00 H new ATOM 0 HB ILE A 67 0.907 3.368 -4.208 1.00 10.00 H new ATOM 0 HG12 ILE A 67 -1.467 5.119 -4.951 1.00 10.00 H new ATOM 0 HG13 ILE A 67 -1.297 3.428 -5.377 1.00 10.00 H new ATOM 0 HG21 ILE A 67 0.464 5.182 -2.599 1.00 10.00 H new ATOM 0 HG22 ILE A 67 1.961 5.468 -3.518 1.00 10.00 H new ATOM 0 HG23 ILE A 67 0.479 6.362 -3.931 1.00 10.00 H new ATOM 0 HD11 ILE A 67 -2.745 3.698 -3.424 1.00 10.00 H new ATOM 0 HD12 ILE A 67 -1.263 2.815 -2.986 1.00 10.00 H new ATOM 0 HD13 ILE A 67 -1.436 4.533 -2.553 1.00 10.00 H new ATOM 864 N ASN A 68 3.199 5.698 -5.710 1.00 10.00 N ATOM 865 CA ASN A 68 4.647 5.781 -5.626 1.00 10.00 C ATOM 866 C ASN A 68 5.074 5.832 -4.168 1.00 10.00 C ATOM 867 O ASN A 68 4.265 6.117 -3.285 1.00 10.00 O ATOM 868 CB ASN A 68 5.170 7.023 -6.357 1.00 10.00 C ATOM 869 CG ASN A 68 4.703 7.106 -7.795 1.00 10.00 C ATOM 870 OD1 ASN A 68 5.381 6.638 -8.711 1.00 10.00 O ATOM 871 ND2 ASN A 68 3.541 7.706 -8.000 1.00 10.00 N ATOM 0 H ASN A 68 2.719 6.591 -5.599 1.00 10.00 H new ATOM 0 HA ASN A 68 5.068 4.896 -6.103 1.00 10.00 H new ATOM 0 HB2 ASN A 68 4.844 7.916 -5.823 1.00 10.00 H new ATOM 0 HB3 ASN A 68 6.260 7.018 -6.335 1.00 10.00 H new ATOM 0 HD21 ASN A 68 3.173 7.795 -8.947 1.00 10.00 H new ATOM 0 HD22 ASN A 68 3.013 8.079 -7.211 1.00 10.00 H new ATOM 878 N GLU A 69 6.349 5.581 -3.917 1.00 10.00 N ATOM 879 CA GLU A 69 6.875 5.598 -2.558 1.00 10.00 C ATOM 880 C GLU A 69 7.118 7.026 -2.079 1.00 10.00 C ATOM 881 O GLU A 69 7.618 7.250 -0.980 1.00 10.00 O ATOM 882 CB GLU A 69 8.167 4.792 -2.484 1.00 10.00 C ATOM 883 CG GLU A 69 7.966 3.309 -2.746 1.00 10.00 C ATOM 884 CD GLU A 69 9.178 2.486 -2.379 1.00 10.00 C ATOM 885 OE1 GLU A 69 9.364 2.199 -1.176 1.00 10.00 O ATOM 886 OE2 GLU A 69 9.957 2.127 -3.285 1.00 10.00 O ATOM 0 H GLU A 69 7.040 5.363 -4.635 1.00 10.00 H new ATOM 0 HA GLU A 69 6.132 5.143 -1.903 1.00 10.00 H new ATOM 0 HB2 GLU A 69 8.877 5.189 -3.210 1.00 10.00 H new ATOM 0 HB3 GLU A 69 8.613 4.923 -1.498 1.00 10.00 H new ATOM 0 HG2 GLU A 69 7.106 2.956 -2.177 1.00 10.00 H new ATOM 0 HG3 GLU A 69 7.734 3.158 -3.800 1.00 10.00 H new ATOM 893 N THR A 70 6.761 7.984 -2.912 1.00 10.00 N ATOM 894 CA THR A 70 6.929 9.385 -2.586 1.00 10.00 C ATOM 895 C THR A 70 5.576 10.080 -2.506 1.00 10.00 C ATOM 896 O THR A 70 5.492 11.309 -2.495 1.00 10.00 O ATOM 897 CB THR A 70 7.797 10.075 -3.647 1.00 10.00 C ATOM 898 OG1 THR A 70 7.577 9.450 -4.920 1.00 10.00 O ATOM 899 CG2 THR A 70 9.268 9.990 -3.277 1.00 10.00 C ATOM 0 H THR A 70 6.348 7.814 -3.829 1.00 10.00 H new ATOM 0 HA THR A 70 7.422 9.454 -1.616 1.00 10.00 H new ATOM 0 HB THR A 70 7.518 11.127 -3.701 1.00 10.00 H new ATOM 0 HG1 THR A 70 8.129 9.890 -5.600 1.00 10.00 H new ATOM 0 HG21 THR A 70 9.865 10.485 -4.043 1.00 10.00 H new ATOM 0 HG22 THR A 70 9.431 10.480 -2.317 1.00 10.00 H new ATOM 0 HG23 THR A 70 9.565 8.944 -3.206 1.00 10.00 H new ATOM 907 N ASP A 71 4.515 9.287 -2.451 1.00 10.00 N ATOM 908 CA ASP A 71 3.166 9.827 -2.387 1.00 10.00 C ATOM 909 C ASP A 71 2.616 9.770 -0.970 1.00 10.00 C ATOM 910 O ASP A 71 2.915 8.851 -0.204 1.00 10.00 O ATOM 911 CB ASP A 71 2.227 9.065 -3.329 1.00 10.00 C ATOM 912 CG ASP A 71 2.394 9.460 -4.783 1.00 10.00 C ATOM 913 OD1 ASP A 71 2.423 10.675 -5.080 1.00 10.00 O ATOM 914 OD2 ASP A 71 2.497 8.559 -5.640 1.00 10.00 O ATOM 0 H ASP A 71 4.563 8.268 -2.449 1.00 10.00 H new ATOM 0 HA ASP A 71 3.220 10.869 -2.701 1.00 10.00 H new ATOM 0 HB2 ASP A 71 2.409 7.995 -3.226 1.00 10.00 H new ATOM 0 HB3 ASP A 71 1.195 9.244 -3.026 1.00 10.00 H new ATOM 919 N THR A 72 1.825 10.772 -0.629 1.00 10.00 N ATOM 920 CA THR A 72 1.194 10.861 0.676 1.00 10.00 C ATOM 921 C THR A 72 -0.311 10.996 0.482 1.00 10.00 C ATOM 922 O THR A 72 -0.761 11.310 -0.624 1.00 10.00 O ATOM 923 CB THR A 72 1.717 12.078 1.474 1.00 10.00 C ATOM 924 OG1 THR A 72 1.632 13.263 0.674 1.00 10.00 O ATOM 925 CG2 THR A 72 3.155 11.868 1.922 1.00 10.00 C ATOM 0 H THR A 72 1.602 11.549 -1.251 1.00 10.00 H new ATOM 0 HA THR A 72 1.432 9.960 1.240 1.00 10.00 H new ATOM 0 HB THR A 72 1.094 12.189 2.361 1.00 10.00 H new ATOM 0 HG1 THR A 72 1.964 14.029 1.188 1.00 10.00 H new ATOM 0 HG21 THR A 72 3.493 12.741 2.480 1.00 10.00 H new ATOM 0 HG22 THR A 72 3.212 10.985 2.559 1.00 10.00 H new ATOM 0 HG23 THR A 72 3.791 11.727 1.048 1.00 10.00 H new ATOM 933 N PRO A 73 -1.121 10.758 1.529 1.00 10.00 N ATOM 934 CA PRO A 73 -2.575 10.885 1.428 1.00 10.00 C ATOM 935 C PRO A 73 -2.978 12.293 0.998 1.00 10.00 C ATOM 936 O PRO A 73 -3.965 12.479 0.290 1.00 10.00 O ATOM 937 CB PRO A 73 -3.074 10.583 2.845 1.00 10.00 C ATOM 938 CG PRO A 73 -1.970 9.817 3.490 1.00 10.00 C ATOM 939 CD PRO A 73 -0.698 10.328 2.875 1.00 10.00 C ATOM 0 HA PRO A 73 -2.999 10.215 0.681 1.00 10.00 H new ATOM 0 HB2 PRO A 73 -3.288 11.501 3.392 1.00 10.00 H new ATOM 0 HB3 PRO A 73 -3.996 10.002 2.823 1.00 10.00 H new ATOM 0 HG2 PRO A 73 -1.969 9.967 4.570 1.00 10.00 H new ATOM 0 HG3 PRO A 73 -2.085 8.747 3.317 1.00 10.00 H new ATOM 0 HD2 PRO A 73 -0.278 11.155 3.448 1.00 10.00 H new ATOM 0 HD3 PRO A 73 0.066 9.552 2.828 1.00 10.00 H new ATOM 947 N ALA A 74 -2.192 13.281 1.418 1.00 10.00 N ATOM 948 CA ALA A 74 -2.455 14.671 1.066 1.00 10.00 C ATOM 949 C ALA A 74 -2.002 14.955 -0.363 1.00 10.00 C ATOM 950 O ALA A 74 -2.616 15.758 -1.068 1.00 10.00 O ATOM 951 CB ALA A 74 -1.761 15.611 2.040 1.00 10.00 C ATOM 0 H ALA A 74 -1.368 13.143 2.003 1.00 10.00 H new ATOM 0 HA ALA A 74 -3.529 14.843 1.129 1.00 10.00 H new ATOM 0 HB1 ALA A 74 -1.970 16.644 1.760 1.00 10.00 H new ATOM 0 HB2 ALA A 74 -2.130 15.427 3.049 1.00 10.00 H new ATOM 0 HB3 ALA A 74 -0.685 15.437 2.010 1.00 10.00 H new ATOM 957 N GLN A 75 -0.929 14.287 -0.784 1.00 10.00 N ATOM 958 CA GLN A 75 -0.394 14.456 -2.133 1.00 10.00 C ATOM 959 C GLN A 75 -1.395 13.949 -3.164 1.00 10.00 C ATOM 960 O GLN A 75 -1.697 14.634 -4.140 1.00 10.00 O ATOM 961 CB GLN A 75 0.929 13.703 -2.288 1.00 10.00 C ATOM 962 CG GLN A 75 1.677 14.038 -3.567 1.00 10.00 C ATOM 963 CD GLN A 75 2.263 15.434 -3.545 1.00 10.00 C ATOM 964 OE1 GLN A 75 2.653 15.939 -2.493 1.00 10.00 O ATOM 965 NE2 GLN A 75 2.321 16.069 -4.702 1.00 10.00 N ATOM 0 H GLN A 75 -0.412 13.622 -0.208 1.00 10.00 H new ATOM 0 HA GLN A 75 -0.215 15.519 -2.297 1.00 10.00 H new ATOM 0 HB2 GLN A 75 1.568 13.929 -1.434 1.00 10.00 H new ATOM 0 HB3 GLN A 75 0.732 12.631 -2.263 1.00 10.00 H new ATOM 0 HG2 GLN A 75 2.477 13.313 -3.717 1.00 10.00 H new ATOM 0 HG3 GLN A 75 1.000 13.945 -4.416 1.00 10.00 H new ATOM 0 HE21 GLN A 75 1.987 15.613 -5.551 1.00 10.00 H new ATOM 0 HE22 GLN A 75 2.700 17.015 -4.746 1.00 10.00 H new ATOM 974 N LEU A 76 -1.913 12.747 -2.933 1.00 10.00 N ATOM 975 CA LEU A 76 -2.892 12.146 -3.835 1.00 10.00 C ATOM 976 C LEU A 76 -4.285 12.692 -3.547 1.00 10.00 C ATOM 977 O LEU A 76 -5.250 12.350 -4.233 1.00 10.00 O ATOM 978 CB LEU A 76 -2.886 10.621 -3.698 1.00 10.00 C ATOM 979 CG LEU A 76 -1.682 9.913 -4.326 1.00 10.00 C ATOM 980 CD1 LEU A 76 -1.653 8.451 -3.913 1.00 10.00 C ATOM 981 CD2 LEU A 76 -1.718 10.032 -5.842 1.00 10.00 C ATOM 0 H LEU A 76 -1.672 12.169 -2.128 1.00 10.00 H new ATOM 0 HA LEU A 76 -2.618 12.404 -4.858 1.00 10.00 H new ATOM 0 HB2 LEU A 76 -2.924 10.368 -2.639 1.00 10.00 H new ATOM 0 HB3 LEU A 76 -3.796 10.228 -4.152 1.00 10.00 H new ATOM 0 HG LEU A 76 -0.775 10.397 -3.965 1.00 10.00 H new ATOM 0 HD11 LEU A 76 -0.792 7.962 -4.367 1.00 10.00 H new ATOM 0 HD12 LEU A 76 -1.580 8.381 -2.828 1.00 10.00 H new ATOM 0 HD13 LEU A 76 -2.567 7.960 -4.247 1.00 10.00 H new ATOM 0 HD21 LEU A 76 -0.854 9.522 -6.268 1.00 10.00 H new ATOM 0 HD22 LEU A 76 -2.632 9.575 -6.221 1.00 10.00 H new ATOM 0 HD23 LEU A 76 -1.694 11.084 -6.125 1.00 10.00 H new ATOM 993 N GLU A 77 -4.366 13.543 -2.525 1.00 10.00 N ATOM 994 CA GLU A 77 -5.618 14.174 -2.114 1.00 10.00 C ATOM 995 C GLU A 77 -6.696 13.132 -1.843 1.00 10.00 C ATOM 996 O GLU A 77 -7.814 13.214 -2.355 1.00 10.00 O ATOM 997 CB GLU A 77 -6.076 15.180 -3.169 1.00 10.00 C ATOM 998 CG GLU A 77 -4.950 16.075 -3.663 1.00 10.00 C ATOM 999 CD GLU A 77 -5.444 17.291 -4.409 1.00 10.00 C ATOM 1000 OE1 GLU A 77 -5.132 18.422 -3.977 1.00 10.00 O ATOM 1001 OE2 GLU A 77 -6.138 17.129 -5.432 1.00 10.00 O ATOM 0 H GLU A 77 -3.563 13.814 -1.958 1.00 10.00 H new ATOM 0 HA GLU A 77 -5.442 14.711 -1.182 1.00 10.00 H new ATOM 0 HB2 GLU A 77 -6.503 14.642 -4.015 1.00 10.00 H new ATOM 0 HB3 GLU A 77 -6.870 15.800 -2.752 1.00 10.00 H new ATOM 0 HG2 GLU A 77 -4.350 16.397 -2.812 1.00 10.00 H new ATOM 0 HG3 GLU A 77 -4.294 15.498 -4.315 1.00 10.00 H new ATOM 1008 N MET A 78 -6.340 12.153 -1.029 1.00 10.00 N ATOM 1009 CA MET A 78 -7.249 11.082 -0.664 1.00 10.00 C ATOM 1010 C MET A 78 -8.119 11.529 0.498 1.00 10.00 C ATOM 1011 O MET A 78 -7.708 12.372 1.297 1.00 10.00 O ATOM 1012 CB MET A 78 -6.468 9.826 -0.276 1.00 10.00 C ATOM 1013 CG MET A 78 -5.399 9.442 -1.285 1.00 10.00 C ATOM 1014 SD MET A 78 -4.304 8.140 -0.687 1.00 10.00 S ATOM 1015 CE MET A 78 -5.407 6.731 -0.725 1.00 10.00 C ATOM 0 H MET A 78 -5.416 12.079 -0.604 1.00 10.00 H new ATOM 0 HA MET A 78 -7.879 10.846 -1.521 1.00 10.00 H new ATOM 0 HB2 MET A 78 -6.000 9.985 0.695 1.00 10.00 H new ATOM 0 HB3 MET A 78 -7.164 8.995 -0.162 1.00 10.00 H new ATOM 0 HG2 MET A 78 -5.878 9.112 -2.207 1.00 10.00 H new ATOM 0 HG3 MET A 78 -4.807 10.323 -1.532 1.00 10.00 H new ATOM 0 HE1 MET A 78 -5.202 6.085 0.129 1.00 10.00 H new ATOM 0 HE2 MET A 78 -6.440 7.076 -0.679 1.00 10.00 H new ATOM 0 HE3 MET A 78 -5.252 6.172 -1.648 1.00 10.00 H new ATOM 1025 N GLU A 79 -9.311 10.975 0.590 1.00 10.00 N ATOM 1026 CA GLU A 79 -10.222 11.329 1.660 1.00 10.00 C ATOM 1027 C GLU A 79 -10.486 10.133 2.557 1.00 10.00 C ATOM 1028 O GLU A 79 -9.995 9.031 2.301 1.00 10.00 O ATOM 1029 CB GLU A 79 -11.533 11.868 1.091 1.00 10.00 C ATOM 1030 CG GLU A 79 -11.554 13.380 0.971 1.00 10.00 C ATOM 1031 CD GLU A 79 -11.202 14.060 2.274 1.00 10.00 C ATOM 1032 OE1 GLU A 79 -11.928 13.855 3.271 1.00 10.00 O ATOM 1033 OE2 GLU A 79 -10.197 14.798 2.311 1.00 10.00 O ATOM 0 H GLU A 79 -9.671 10.279 -0.062 1.00 10.00 H new ATOM 0 HA GLU A 79 -9.757 12.112 2.259 1.00 10.00 H new ATOM 0 HB2 GLU A 79 -11.703 11.429 0.108 1.00 10.00 H new ATOM 0 HB3 GLU A 79 -12.357 11.549 1.729 1.00 10.00 H new ATOM 0 HG2 GLU A 79 -10.851 13.691 0.199 1.00 10.00 H new ATOM 0 HG3 GLU A 79 -12.544 13.704 0.650 1.00 10.00 H new ATOM 1040 N ASP A 80 -11.253 10.358 3.609 1.00 10.00 N ATOM 1041 CA ASP A 80 -11.585 9.299 4.547 1.00 10.00 C ATOM 1042 C ASP A 80 -12.449 8.246 3.870 1.00 10.00 C ATOM 1043 O ASP A 80 -13.317 8.574 3.061 1.00 10.00 O ATOM 1044 CB ASP A 80 -12.307 9.861 5.773 1.00 10.00 C ATOM 1045 CG ASP A 80 -11.345 10.251 6.877 1.00 10.00 C ATOM 1046 OD1 ASP A 80 -10.945 11.435 6.932 1.00 10.00 O ATOM 1047 OD2 ASP A 80 -10.980 9.374 7.694 1.00 10.00 O ATOM 0 H ASP A 80 -11.659 11.266 3.836 1.00 10.00 H new ATOM 0 HA ASP A 80 -10.655 8.836 4.878 1.00 10.00 H new ATOM 0 HB2 ASP A 80 -12.893 10.732 5.480 1.00 10.00 H new ATOM 0 HB3 ASP A 80 -13.009 9.118 6.151 1.00 10.00 H new ATOM 1052 N GLU A 81 -12.165 6.988 4.193 1.00 10.00 N ATOM 1053 CA GLU A 81 -12.880 5.830 3.656 1.00 10.00 C ATOM 1054 C GLU A 81 -12.407 5.468 2.249 1.00 10.00 C ATOM 1055 O GLU A 81 -13.025 4.635 1.578 1.00 10.00 O ATOM 1056 CB GLU A 81 -14.402 6.032 3.667 1.00 10.00 C ATOM 1057 CG GLU A 81 -15.016 5.995 5.056 1.00 10.00 C ATOM 1058 CD GLU A 81 -16.478 5.610 5.027 1.00 10.00 C ATOM 1059 OE1 GLU A 81 -17.340 6.513 5.068 1.00 10.00 O ATOM 1060 OE2 GLU A 81 -16.772 4.398 4.956 1.00 10.00 O ATOM 0 H GLU A 81 -11.421 6.738 4.845 1.00 10.00 H new ATOM 0 HA GLU A 81 -12.646 4.997 4.319 1.00 10.00 H new ATOM 0 HB2 GLU A 81 -14.635 6.990 3.202 1.00 10.00 H new ATOM 0 HB3 GLU A 81 -14.866 5.259 3.054 1.00 10.00 H new ATOM 0 HG2 GLU A 81 -14.468 5.284 5.674 1.00 10.00 H new ATOM 0 HG3 GLU A 81 -14.909 6.974 5.524 1.00 10.00 H new ATOM 1067 N ASP A 82 -11.320 6.084 1.795 1.00 10.00 N ATOM 1068 CA ASP A 82 -10.773 5.777 0.474 1.00 10.00 C ATOM 1069 C ASP A 82 -10.153 4.386 0.510 1.00 10.00 C ATOM 1070 O ASP A 82 -9.516 4.015 1.497 1.00 10.00 O ATOM 1071 CB ASP A 82 -9.726 6.811 0.049 1.00 10.00 C ATOM 1072 CG ASP A 82 -9.781 7.122 -1.438 1.00 10.00 C ATOM 1073 OD1 ASP A 82 -9.886 6.178 -2.253 1.00 10.00 O ATOM 1074 OD2 ASP A 82 -9.730 8.318 -1.799 1.00 10.00 O ATOM 0 H ASP A 82 -10.803 6.793 2.315 1.00 10.00 H new ATOM 0 HA ASP A 82 -11.580 5.809 -0.258 1.00 10.00 H new ATOM 0 HB2 ASP A 82 -9.878 7.730 0.614 1.00 10.00 H new ATOM 0 HB3 ASP A 82 -8.732 6.442 0.303 1.00 10.00 H new ATOM 1079 N THR A 83 -10.345 3.616 -0.547 1.00 10.00 N ATOM 1080 CA THR A 83 -9.825 2.258 -0.593 1.00 10.00 C ATOM 1081 C THR A 83 -8.666 2.111 -1.578 1.00 10.00 C ATOM 1082 O THR A 83 -8.702 2.633 -2.692 1.00 10.00 O ATOM 1083 CB THR A 83 -10.942 1.261 -0.955 1.00 10.00 C ATOM 1084 OG1 THR A 83 -12.102 1.531 -0.154 1.00 10.00 O ATOM 1085 CG2 THR A 83 -10.491 -0.176 -0.730 1.00 10.00 C ATOM 0 H THR A 83 -10.855 3.905 -1.382 1.00 10.00 H new ATOM 0 HA THR A 83 -9.444 2.035 0.404 1.00 10.00 H new ATOM 0 HB THR A 83 -11.181 1.383 -2.011 1.00 10.00 H new ATOM 0 HG1 THR A 83 -12.814 0.898 -0.385 1.00 10.00 H new ATOM 0 HG21 THR A 83 -11.300 -0.857 -0.994 1.00 10.00 H new ATOM 0 HG22 THR A 83 -9.622 -0.386 -1.353 1.00 10.00 H new ATOM 0 HG23 THR A 83 -10.228 -0.315 0.319 1.00 10.00 H new ATOM 1093 N ILE A 84 -7.637 1.401 -1.139 1.00 10.00 N ATOM 1094 CA ILE A 84 -6.460 1.147 -1.952 1.00 10.00 C ATOM 1095 C ILE A 84 -6.453 -0.316 -2.385 1.00 10.00 C ATOM 1096 O ILE A 84 -6.626 -1.212 -1.557 1.00 10.00 O ATOM 1097 CB ILE A 84 -5.163 1.458 -1.170 1.00 10.00 C ATOM 1098 CG1 ILE A 84 -5.209 2.881 -0.602 1.00 10.00 C ATOM 1099 CG2 ILE A 84 -3.944 1.280 -2.063 1.00 10.00 C ATOM 1100 CD1 ILE A 84 -4.106 3.181 0.392 1.00 10.00 C ATOM 0 H ILE A 84 -7.596 0.985 -0.208 1.00 10.00 H new ATOM 0 HA ILE A 84 -6.497 1.798 -2.825 1.00 10.00 H new ATOM 0 HB ILE A 84 -5.085 0.756 -0.340 1.00 10.00 H new ATOM 0 HG12 ILE A 84 -5.146 3.593 -1.425 1.00 10.00 H new ATOM 0 HG13 ILE A 84 -6.173 3.038 -0.118 1.00 10.00 H new ATOM 0 HG21 ILE A 84 -3.041 1.503 -1.495 1.00 10.00 H new ATOM 0 HG22 ILE A 84 -3.902 0.251 -2.421 1.00 10.00 H new ATOM 0 HG23 ILE A 84 -4.014 1.958 -2.914 1.00 10.00 H new ATOM 0 HD11 ILE A 84 -4.206 4.206 0.748 1.00 10.00 H new ATOM 0 HD12 ILE A 84 -4.180 2.495 1.236 1.00 10.00 H new ATOM 0 HD13 ILE A 84 -3.137 3.058 -0.092 1.00 10.00 H new ATOM 1112 N ASP A 85 -6.268 -0.556 -3.678 1.00 10.00 N ATOM 1113 CA ASP A 85 -6.254 -1.918 -4.200 1.00 10.00 C ATOM 1114 C ASP A 85 -4.843 -2.494 -4.164 1.00 10.00 C ATOM 1115 O ASP A 85 -3.873 -1.806 -4.490 1.00 10.00 O ATOM 1116 CB ASP A 85 -6.801 -1.958 -5.629 1.00 10.00 C ATOM 1117 CG ASP A 85 -7.849 -3.037 -5.811 1.00 10.00 C ATOM 1118 OD1 ASP A 85 -7.624 -4.177 -5.358 1.00 10.00 O ATOM 1119 OD2 ASP A 85 -8.913 -2.749 -6.406 1.00 10.00 O ATOM 0 H ASP A 85 -6.126 0.170 -4.381 1.00 10.00 H new ATOM 0 HA ASP A 85 -6.897 -2.528 -3.565 1.00 10.00 H new ATOM 0 HB2 ASP A 85 -7.233 -0.989 -5.878 1.00 10.00 H new ATOM 0 HB3 ASP A 85 -5.980 -2.130 -6.326 1.00 10.00 H new ATOM 1124 N VAL A 86 -4.735 -3.754 -3.761 1.00 10.00 N ATOM 1125 CA VAL A 86 -3.443 -4.424 -3.671 1.00 10.00 C ATOM 1126 C VAL A 86 -3.409 -5.654 -4.570 1.00 10.00 C ATOM 1127 O VAL A 86 -4.149 -6.615 -4.353 1.00 10.00 O ATOM 1128 CB VAL A 86 -3.120 -4.852 -2.223 1.00 10.00 C ATOM 1129 CG1 VAL A 86 -1.689 -5.364 -2.117 1.00 10.00 C ATOM 1130 CG2 VAL A 86 -3.351 -3.701 -1.257 1.00 10.00 C ATOM 0 H VAL A 86 -5.529 -4.334 -3.490 1.00 10.00 H new ATOM 0 HA VAL A 86 -2.691 -3.706 -4.000 1.00 10.00 H new ATOM 0 HB VAL A 86 -3.793 -5.665 -1.952 1.00 10.00 H new ATOM 0 HG11 VAL A 86 -1.484 -5.660 -1.088 1.00 10.00 H new ATOM 0 HG12 VAL A 86 -1.561 -6.224 -2.774 1.00 10.00 H new ATOM 0 HG13 VAL A 86 -0.997 -4.575 -2.413 1.00 10.00 H new ATOM 0 HG21 VAL A 86 -3.117 -4.025 -0.243 1.00 10.00 H new ATOM 0 HG22 VAL A 86 -2.708 -2.864 -1.528 1.00 10.00 H new ATOM 0 HG23 VAL A 86 -4.394 -3.388 -1.307 1.00 10.00 H new ATOM 1140 N PHE A 87 -2.553 -5.619 -5.576 1.00 10.00 N ATOM 1141 CA PHE A 87 -2.423 -6.730 -6.509 1.00 10.00 C ATOM 1142 C PHE A 87 -1.064 -7.399 -6.346 1.00 10.00 C ATOM 1143 O PHE A 87 -0.184 -6.869 -5.667 1.00 10.00 O ATOM 1144 CB PHE A 87 -2.608 -6.243 -7.949 1.00 10.00 C ATOM 1145 CG PHE A 87 -4.021 -5.837 -8.268 1.00 10.00 C ATOM 1146 CD1 PHE A 87 -5.010 -6.791 -8.431 1.00 10.00 C ATOM 1147 CD2 PHE A 87 -4.356 -4.499 -8.406 1.00 10.00 C ATOM 1148 CE1 PHE A 87 -6.310 -6.421 -8.724 1.00 10.00 C ATOM 1149 CE2 PHE A 87 -5.654 -4.122 -8.698 1.00 10.00 C ATOM 1150 CZ PHE A 87 -6.630 -5.084 -8.859 1.00 10.00 C ATOM 0 H PHE A 87 -1.935 -4.831 -5.770 1.00 10.00 H new ATOM 0 HA PHE A 87 -3.201 -7.462 -6.289 1.00 10.00 H new ATOM 0 HB2 PHE A 87 -1.946 -5.395 -8.125 1.00 10.00 H new ATOM 0 HB3 PHE A 87 -2.302 -7.034 -8.634 1.00 10.00 H new ATOM 0 HD1 PHE A 87 -4.764 -7.837 -8.328 1.00 10.00 H new ATOM 0 HD2 PHE A 87 -3.595 -3.743 -8.284 1.00 10.00 H new ATOM 0 HE1 PHE A 87 -7.073 -7.175 -8.847 1.00 10.00 H new ATOM 0 HE2 PHE A 87 -5.903 -3.076 -8.800 1.00 10.00 H new ATOM 0 HZ PHE A 87 -7.644 -4.792 -9.090 1.00 10.00 H new ATOM 1160 N GLN A 88 -0.898 -8.558 -6.966 1.00 10.00 N ATOM 1161 CA GLN A 88 0.356 -9.295 -6.886 1.00 10.00 C ATOM 1162 C GLN A 88 1.046 -9.324 -8.246 1.00 10.00 C ATOM 1163 O GLN A 88 0.386 -9.327 -9.284 1.00 10.00 O ATOM 1164 CB GLN A 88 0.107 -10.725 -6.394 1.00 10.00 C ATOM 1165 CG GLN A 88 -0.194 -10.813 -4.904 1.00 10.00 C ATOM 1166 CD GLN A 88 -0.556 -12.217 -4.459 1.00 10.00 C ATOM 1167 OE1 GLN A 88 -0.119 -13.206 -5.050 1.00 10.00 O ATOM 1168 NE2 GLN A 88 -1.349 -12.318 -3.403 1.00 10.00 N ATOM 0 H GLN A 88 -1.617 -9.010 -7.531 1.00 10.00 H new ATOM 0 HA GLN A 88 1.006 -8.787 -6.174 1.00 10.00 H new ATOM 0 HB2 GLN A 88 -0.727 -11.152 -6.951 1.00 10.00 H new ATOM 0 HB3 GLN A 88 0.983 -11.334 -6.616 1.00 10.00 H new ATOM 0 HG2 GLN A 88 0.675 -10.471 -4.342 1.00 10.00 H new ATOM 0 HG3 GLN A 88 -1.015 -10.138 -4.663 1.00 10.00 H new ATOM 0 HE21 GLN A 88 -1.691 -11.476 -2.940 1.00 10.00 H new ATOM 0 HE22 GLN A 88 -1.618 -13.238 -3.053 1.00 10.00 H new ATOM 1177 N GLN A 89 2.369 -9.336 -8.233 1.00 10.00 N ATOM 1178 CA GLN A 89 3.146 -9.369 -9.462 1.00 10.00 C ATOM 1179 C GLN A 89 3.229 -10.795 -9.997 1.00 10.00 C ATOM 1180 O GLN A 89 3.425 -11.743 -9.235 1.00 10.00 O ATOM 1181 CB GLN A 89 4.552 -8.806 -9.218 1.00 10.00 C ATOM 1182 CG GLN A 89 5.476 -8.920 -10.421 1.00 10.00 C ATOM 1183 CD GLN A 89 4.982 -8.132 -11.618 1.00 10.00 C ATOM 1184 OE1 GLN A 89 4.396 -7.060 -11.475 1.00 10.00 O ATOM 1185 NE2 GLN A 89 5.191 -8.674 -12.809 1.00 10.00 N ATOM 0 H GLN A 89 2.930 -9.323 -7.381 1.00 10.00 H new ATOM 0 HA GLN A 89 2.648 -8.748 -10.207 1.00 10.00 H new ATOM 0 HB2 GLN A 89 4.469 -7.757 -8.933 1.00 10.00 H new ATOM 0 HB3 GLN A 89 5.002 -9.330 -8.375 1.00 10.00 H new ATOM 0 HG2 GLN A 89 6.470 -8.568 -10.145 1.00 10.00 H new ATOM 0 HG3 GLN A 89 5.576 -9.969 -10.699 1.00 10.00 H new ATOM 0 HE21 GLN A 89 5.681 -9.565 -12.885 1.00 10.00 H new ATOM 0 HE22 GLN A 89 4.861 -8.200 -13.650 1.00 10.00 H new ATOM 1194 N GLN A 90 3.072 -10.939 -11.305 1.00 10.00 N ATOM 1195 CA GLN A 90 3.128 -12.245 -11.944 1.00 10.00 C ATOM 1196 C GLN A 90 4.573 -12.715 -12.068 1.00 10.00 C ATOM 1197 O GLN A 90 5.477 -11.910 -12.298 1.00 10.00 O ATOM 1198 CB GLN A 90 2.474 -12.201 -13.331 1.00 10.00 C ATOM 1199 CG GLN A 90 1.014 -11.757 -13.320 1.00 10.00 C ATOM 1200 CD GLN A 90 0.855 -10.253 -13.190 1.00 10.00 C ATOM 1201 OE1 GLN A 90 1.704 -9.482 -13.644 1.00 10.00 O ATOM 1202 NE2 GLN A 90 -0.227 -9.827 -12.561 1.00 10.00 N ATOM 0 H GLN A 90 2.904 -10.164 -11.946 1.00 10.00 H new ATOM 0 HA GLN A 90 2.577 -12.950 -11.321 1.00 10.00 H new ATOM 0 HB2 GLN A 90 3.043 -11.524 -13.968 1.00 10.00 H new ATOM 0 HB3 GLN A 90 2.538 -13.191 -13.782 1.00 10.00 H new ATOM 0 HG2 GLN A 90 0.531 -12.090 -14.239 1.00 10.00 H new ATOM 0 HG3 GLN A 90 0.497 -12.245 -12.493 1.00 10.00 H new ATOM 0 HE21 GLN A 90 -0.905 -10.498 -12.201 1.00 10.00 H new ATOM 0 HE22 GLN A 90 -0.384 -8.827 -12.436 1.00 10.00 H new ATOM 1211 N THR A 91 4.779 -14.015 -11.906 1.00 10.00 N ATOM 1212 CA THR A 91 6.105 -14.606 -11.990 1.00 10.00 C ATOM 1213 C THR A 91 6.632 -14.598 -13.426 1.00 10.00 C ATOM 1214 O THR A 91 7.760 -14.170 -13.684 1.00 10.00 O ATOM 1215 CB THR A 91 6.081 -16.052 -11.463 1.00 10.00 C ATOM 1216 OG1 THR A 91 4.858 -16.284 -10.747 1.00 10.00 O ATOM 1217 CG2 THR A 91 7.269 -16.320 -10.551 1.00 10.00 C ATOM 0 H THR A 91 4.035 -14.686 -11.714 1.00 10.00 H new ATOM 0 HA THR A 91 6.772 -14.002 -11.374 1.00 10.00 H new ATOM 0 HB THR A 91 6.143 -16.730 -12.314 1.00 10.00 H new ATOM 0 HG1 THR A 91 4.844 -17.206 -10.414 1.00 10.00 H new ATOM 0 HG21 THR A 91 7.228 -17.349 -10.193 1.00 10.00 H new ATOM 0 HG22 THR A 91 8.195 -16.166 -11.105 1.00 10.00 H new ATOM 0 HG23 THR A 91 7.236 -15.638 -9.701 1.00 10.00 H new ATOM 1225 N GLY A 92 5.807 -15.064 -14.355 1.00 10.00 N ATOM 1226 CA GLY A 92 6.200 -15.108 -15.747 1.00 10.00 C ATOM 1227 C GLY A 92 5.065 -15.576 -16.631 1.00 10.00 C ATOM 1228 O GLY A 92 3.896 -15.367 -16.251 1.00 10.00 O ATOM 0 H GLY A 92 4.868 -15.414 -14.166 1.00 10.00 H new ATOM 0 HA2 GLY A 92 6.525 -14.118 -16.065 1.00 10.00 H new ATOM 0 HA3 GLY A 92 7.053 -15.777 -15.864 1.00 10.00 H new TER 1232 GLY A 92 ATOM 1233 N ASN B 357 -14.332 -11.436 6.700 1.00 10.00 N ATOM 1234 CA ASN B 357 -13.806 -10.057 6.631 1.00 10.00 C ATOM 1235 C ASN B 357 -13.218 -9.640 7.964 1.00 10.00 C ATOM 1236 O ASN B 357 -13.844 -9.813 9.008 1.00 10.00 O ATOM 1237 CB ASN B 357 -14.907 -9.069 6.226 1.00 10.00 C ATOM 1238 CG ASN B 357 -16.186 -9.232 7.034 1.00 10.00 C ATOM 1239 OD1 ASN B 357 -17.051 -10.032 6.681 1.00 10.00 O ATOM 1240 ND2 ASN B 357 -16.324 -8.474 8.114 1.00 10.00 N ATOM 0 HA ASN B 357 -13.022 -10.041 5.874 1.00 10.00 H new ATOM 0 HB2 ASN B 357 -14.536 -8.051 6.347 1.00 10.00 H new ATOM 0 HB3 ASN B 357 -15.134 -9.202 5.168 1.00 10.00 H new ATOM 0 HD21 ASN B 357 -17.169 -8.544 8.682 1.00 10.00 H new ATOM 0 HD22 ASN B 357 -15.586 -7.821 8.377 1.00 10.00 H new ATOM 1247 N ASN B 358 -12.007 -9.116 7.932 1.00 10.00 N ATOM 1248 CA ASN B 358 -11.353 -8.676 9.154 1.00 10.00 C ATOM 1249 C ASN B 358 -10.991 -7.196 9.083 1.00 10.00 C ATOM 1250 O ASN B 358 -10.358 -6.760 8.126 1.00 10.00 O ATOM 1251 CB ASN B 358 -10.099 -9.526 9.431 1.00 10.00 C ATOM 1252 CG ASN B 358 -9.132 -9.569 8.256 1.00 10.00 C ATOM 1253 OD1 ASN B 358 -8.276 -8.701 8.103 1.00 10.00 O ATOM 1254 ND2 ASN B 358 -9.260 -10.588 7.425 1.00 10.00 N ATOM 0 H ASN B 358 -11.459 -8.985 7.082 1.00 10.00 H new ATOM 0 HA ASN B 358 -12.054 -8.811 9.978 1.00 10.00 H new ATOM 0 HB2 ASN B 358 -9.583 -9.126 10.304 1.00 10.00 H new ATOM 0 HB3 ASN B 358 -10.405 -10.542 9.679 1.00 10.00 H new ATOM 0 HD21 ASN B 358 -8.636 -10.674 6.623 1.00 10.00 H new ATOM 0 HD22 ASN B 358 -9.983 -11.289 7.585 1.00 10.00 H new ATOM 1261 N ARG B 359 -11.408 -6.415 10.080 1.00 10.00 N ATOM 1262 CA ARG B 359 -11.063 -5.001 10.099 1.00 10.00 C ATOM 1263 C ARG B 359 -10.295 -4.657 11.375 1.00 10.00 C ATOM 1264 O ARG B 359 -10.795 -4.842 12.488 1.00 10.00 O ATOM 1265 CB ARG B 359 -12.332 -4.144 10.003 1.00 10.00 C ATOM 1266 CG ARG B 359 -12.081 -2.643 10.132 1.00 10.00 C ATOM 1267 CD ARG B 359 -13.317 -1.840 9.762 1.00 10.00 C ATOM 1268 NE ARG B 359 -13.113 -1.053 8.546 1.00 10.00 N ATOM 1269 CZ ARG B 359 -13.968 -1.008 7.525 1.00 10.00 C ATOM 1270 NH1 ARG B 359 -15.124 -1.659 7.576 1.00 10.00 N ATOM 1271 NH2 ARG B 359 -13.662 -0.291 6.451 1.00 10.00 N ATOM 0 H ARG B 359 -11.973 -6.732 10.868 1.00 10.00 H new ATOM 0 HA ARG B 359 -10.427 -4.788 9.240 1.00 10.00 H new ATOM 0 HB2 ARG B 359 -12.818 -4.340 9.047 1.00 10.00 H new ATOM 0 HB3 ARG B 359 -13.027 -4.454 10.784 1.00 10.00 H new ATOM 0 HG2 ARG B 359 -11.786 -2.409 11.155 1.00 10.00 H new ATOM 0 HG3 ARG B 359 -11.251 -2.355 9.487 1.00 10.00 H new ATOM 0 HD2 ARG B 359 -14.160 -2.516 9.619 1.00 10.00 H new ATOM 0 HD3 ARG B 359 -13.578 -1.175 10.585 1.00 10.00 H new ATOM 0 HE ARG B 359 -12.258 -0.501 8.475 1.00 10.00 H new ATOM 0 HH11 ARG B 359 -15.367 -2.202 8.404 1.00 10.00 H new ATOM 0 HH12 ARG B 359 -15.769 -1.616 6.787 1.00 10.00 H new ATOM 0 HH21 ARG B 359 -12.779 0.219 6.413 1.00 10.00 H new ATOM 0 HH22 ARG B 359 -14.309 -0.250 5.664 1.00 10.00 H new ATOM 1285 N ASP B 360 -9.079 -4.173 11.190 1.00 10.00 N ATOM 1286 CA ASP B 360 -8.200 -3.749 12.278 1.00 10.00 C ATOM 1287 C ASP B 360 -7.661 -2.357 11.972 1.00 10.00 C ATOM 1288 O ASP B 360 -7.380 -2.062 10.811 1.00 10.00 O ATOM 1289 CB ASP B 360 -7.081 -4.764 12.549 1.00 10.00 C ATOM 1290 CG ASP B 360 -5.829 -4.508 11.749 1.00 10.00 C ATOM 1291 OD1 ASP B 360 -5.776 -4.939 10.582 1.00 10.00 O ATOM 1292 OD2 ASP B 360 -4.883 -3.903 12.294 1.00 10.00 O ATOM 0 H ASP B 360 -8.663 -4.060 10.266 1.00 10.00 H new ATOM 0 HA ASP B 360 -8.778 -3.704 13.201 1.00 10.00 H new ATOM 0 HB2 ASP B 360 -6.834 -4.746 13.611 1.00 10.00 H new ATOM 0 HB3 ASP B 360 -7.448 -5.766 12.324 1.00 10.00 H new ATOM 1297 N PRO B 361 -7.530 -1.460 12.959 1.00 10.00 N ATOM 1298 CA PRO B 361 -7.043 -0.113 12.702 1.00 10.00 C ATOM 1299 C PRO B 361 -5.601 0.109 13.177 1.00 10.00 C ATOM 1300 O PRO B 361 -5.235 -0.182 14.319 1.00 10.00 O ATOM 1301 CB PRO B 361 -8.008 0.709 13.559 1.00 10.00 C ATOM 1302 CG PRO B 361 -8.427 -0.203 14.687 1.00 10.00 C ATOM 1303 CD PRO B 361 -7.955 -1.603 14.348 1.00 10.00 C ATOM 0 HA PRO B 361 -7.017 0.134 11.641 1.00 10.00 H new ATOM 0 HB2 PRO B 361 -7.524 1.608 13.941 1.00 10.00 H new ATOM 0 HB3 PRO B 361 -8.870 1.034 12.977 1.00 10.00 H new ATOM 0 HG2 PRO B 361 -7.992 0.130 15.629 1.00 10.00 H new ATOM 0 HG3 PRO B 361 -9.510 -0.184 14.812 1.00 10.00 H new ATOM 0 HD2 PRO B 361 -7.137 -1.924 14.993 1.00 10.00 H new ATOM 0 HD3 PRO B 361 -8.752 -2.338 14.456 1.00 10.00 H new ATOM 1311 N ILE B 362 -4.785 0.625 12.262 1.00 10.00 N ATOM 1312 CA ILE B 362 -3.368 0.868 12.514 1.00 10.00 C ATOM 1313 C ILE B 362 -3.036 2.344 12.362 1.00 10.00 C ATOM 1314 O ILE B 362 -3.450 2.981 11.399 1.00 10.00 O ATOM 1315 CB ILE B 362 -2.466 0.061 11.543 1.00 10.00 C ATOM 1316 CG1 ILE B 362 -3.020 -1.347 11.306 1.00 10.00 C ATOM 1317 CG2 ILE B 362 -1.041 -0.022 12.069 1.00 10.00 C ATOM 1318 CD1 ILE B 362 -3.813 -1.472 10.023 1.00 10.00 C ATOM 0 H ILE B 362 -5.088 0.887 11.324 1.00 10.00 H new ATOM 0 HA ILE B 362 -3.173 0.545 13.537 1.00 10.00 H new ATOM 0 HB ILE B 362 -2.459 0.590 10.590 1.00 10.00 H new ATOM 0 HG12 ILE B 362 -2.193 -2.056 11.284 1.00 10.00 H new ATOM 0 HG13 ILE B 362 -3.656 -1.626 12.146 1.00 10.00 H new ATOM 0 HG21 ILE B 362 -0.428 -0.592 11.371 1.00 10.00 H new ATOM 0 HG22 ILE B 362 -0.632 0.983 12.173 1.00 10.00 H new ATOM 0 HG23 ILE B 362 -1.040 -0.516 13.040 1.00 10.00 H new ATOM 0 HD11 ILE B 362 -4.176 -2.494 9.918 1.00 10.00 H new ATOM 0 HD12 ILE B 362 -4.661 -0.787 10.051 1.00 10.00 H new ATOM 0 HD13 ILE B 362 -3.174 -1.225 9.175 1.00 10.00 H new ATOM 1330 N VAL B 363 -2.288 2.884 13.314 1.00 10.00 N ATOM 1331 CA VAL B 363 -1.907 4.285 13.258 1.00 10.00 C ATOM 1332 C VAL B 363 -0.396 4.396 13.107 1.00 10.00 C ATOM 1333 O VAL B 363 0.359 3.786 13.862 1.00 10.00 O ATOM 1334 CB VAL B 363 -2.331 5.036 14.540 1.00 10.00 C ATOM 1335 CG1 VAL B 363 -2.082 6.530 14.403 1.00 10.00 C ATOM 1336 CG2 VAL B 363 -3.788 4.755 14.879 1.00 10.00 C ATOM 0 H VAL B 363 -1.937 2.377 14.127 1.00 10.00 H new ATOM 0 HA VAL B 363 -2.413 4.735 12.404 1.00 10.00 H new ATOM 0 HB VAL B 363 -1.718 4.668 15.363 1.00 10.00 H new ATOM 0 HG11 VAL B 363 -2.389 7.035 15.319 1.00 10.00 H new ATOM 0 HG12 VAL B 363 -1.021 6.708 14.229 1.00 10.00 H new ATOM 0 HG13 VAL B 363 -2.658 6.919 13.563 1.00 10.00 H new ATOM 0 HG21 VAL B 363 -4.061 5.295 15.785 1.00 10.00 H new ATOM 0 HG22 VAL B 363 -4.423 5.083 14.056 1.00 10.00 H new ATOM 0 HG23 VAL B 363 -3.925 3.685 15.039 1.00 10.00 H new ATOM 1346 N ILE B 364 0.027 5.156 12.111 1.00 10.00 N ATOM 1347 CA ILE B 364 1.445 5.359 11.850 1.00 10.00 C ATOM 1348 C ILE B 364 1.789 6.840 11.931 1.00 10.00 C ATOM 1349 O ILE B 364 1.125 7.680 11.320 1.00 10.00 O ATOM 1350 CB ILE B 364 1.871 4.813 10.471 1.00 10.00 C ATOM 1351 CG1 ILE B 364 1.515 3.330 10.341 1.00 10.00 C ATOM 1352 CG2 ILE B 364 3.368 5.012 10.264 1.00 10.00 C ATOM 1353 CD1 ILE B 364 1.680 2.782 8.938 1.00 10.00 C ATOM 0 H ILE B 364 -0.593 5.645 11.466 1.00 10.00 H new ATOM 0 HA ILE B 364 1.990 4.805 12.614 1.00 10.00 H new ATOM 0 HB ILE B 364 1.331 5.366 9.703 1.00 10.00 H new ATOM 0 HG12 ILE B 364 2.142 2.754 11.022 1.00 10.00 H new ATOM 0 HG13 ILE B 364 0.483 3.185 10.659 1.00 10.00 H new ATOM 0 HG21 ILE B 364 3.655 4.622 9.287 1.00 10.00 H new ATOM 0 HG22 ILE B 364 3.604 6.075 10.314 1.00 10.00 H new ATOM 0 HG23 ILE B 364 3.917 4.481 11.042 1.00 10.00 H new ATOM 0 HD11 ILE B 364 1.409 1.726 8.926 1.00 10.00 H new ATOM 0 HD12 ILE B 364 1.032 3.331 8.254 1.00 10.00 H new ATOM 0 HD13 ILE B 364 2.718 2.894 8.623 1.00 10.00 H new ATOM 1365 N SER B 365 2.827 7.141 12.683 1.00 10.00 N ATOM 1366 CA SER B 365 3.279 8.508 12.851 1.00 10.00 C ATOM 1367 C SER B 365 4.724 8.655 12.384 1.00 10.00 C ATOM 1368 O SER B 365 5.577 7.828 12.705 1.00 10.00 O ATOM 1369 CB SER B 365 3.128 8.935 14.308 1.00 10.00 C ATOM 1370 OG SER B 365 1.756 9.031 14.662 1.00 10.00 O ATOM 0 H SER B 365 3.379 6.451 13.192 1.00 10.00 H new ATOM 0 HA SER B 365 2.660 9.162 12.236 1.00 10.00 H new ATOM 0 HB2 SER B 365 3.627 8.215 14.957 1.00 10.00 H new ATOM 0 HB3 SER B 365 3.617 9.897 14.463 1.00 10.00 H new ATOM 0 HG SER B 365 1.679 9.304 15.600 1.00 10.00 H new ATOM 1376 N ASP B 366 4.975 9.688 11.591 1.00 10.00 N ATOM 1377 CA ASP B 366 6.312 9.950 11.079 1.00 10.00 C ATOM 1378 C ASP B 366 6.806 11.293 11.599 1.00 10.00 C ATOM 1379 O ASP B 366 6.085 12.295 11.555 1.00 10.00 O ATOM 1380 CB ASP B 366 6.300 9.934 9.549 1.00 10.00 C ATOM 1381 CG ASP B 366 7.693 9.838 8.966 1.00 10.00 C ATOM 1382 OD1 ASP B 366 8.435 8.913 9.353 1.00 10.00 O ATOM 1383 OD2 ASP B 366 8.054 10.677 8.115 1.00 10.00 O ATOM 0 H ASP B 366 4.269 10.359 11.288 1.00 10.00 H new ATOM 0 HA ASP B 366 6.991 9.170 11.425 1.00 10.00 H new ATOM 0 HB2 ASP B 366 5.704 9.090 9.201 1.00 10.00 H new ATOM 0 HB3 ASP B 366 5.816 10.839 9.182 1.00 10.00 H new ATOM 1388 N SER B 367 8.021 11.301 12.128 1.00 10.00 N ATOM 1389 CA SER B 367 8.610 12.506 12.695 1.00 10.00 C ATOM 1390 C SER B 367 9.182 13.418 11.609 1.00 10.00 C ATOM 1391 O SER B 367 9.782 12.943 10.646 1.00 10.00 O ATOM 1392 CB SER B 367 9.713 12.118 13.676 1.00 10.00 C ATOM 1393 OG SER B 367 9.515 10.798 14.164 1.00 10.00 O ATOM 0 H SER B 367 8.623 10.479 12.176 1.00 10.00 H new ATOM 0 HA SER B 367 7.825 13.056 13.213 1.00 10.00 H new ATOM 0 HB2 SER B 367 10.683 12.187 13.184 1.00 10.00 H new ATOM 0 HB3 SER B 367 9.728 12.820 14.510 1.00 10.00 H new ATOM 0 HG SER B 367 10.234 10.569 14.790 1.00 10.00 H new ATOM 1399 N PRO B 368 8.994 14.738 11.753 1.00 10.00 N ATOM 1400 CA PRO B 368 9.501 15.720 10.796 1.00 10.00 C ATOM 1401 C PRO B 368 11.019 15.872 10.880 1.00 10.00 C ATOM 1402 O PRO B 368 11.538 16.163 11.980 1.00 10.00 O ATOM 1403 CB PRO B 368 8.802 17.019 11.208 1.00 10.00 C ATOM 1404 CG PRO B 368 8.478 16.844 12.648 1.00 10.00 C ATOM 1405 CD PRO B 368 8.262 15.372 12.863 1.00 10.00 C ATOM 0 HA PRO B 368 9.300 15.429 9.765 1.00 10.00 H new ATOM 0 HB2 PRO B 368 9.449 17.882 11.052 1.00 10.00 H new ATOM 0 HB3 PRO B 368 7.901 17.186 10.618 1.00 10.00 H new ATOM 0 HG2 PRO B 368 9.290 17.212 13.275 1.00 10.00 H new ATOM 0 HG3 PRO B 368 7.586 17.410 12.916 1.00 10.00 H new ATOM 0 HD2 PRO B 368 8.647 15.049 13.830 1.00 10.00 H new ATOM 0 HD3 PRO B 368 7.203 15.117 12.840 1.00 10.00 H new TER 1413 PRO B 368