USER MOD reduce.3.24.130724 H: found=0, std=0, add=704, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 705 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 36 ASN : amide:sc= 0.828 K(o=2.1,f=-5.7!) USER MOD Set 1.2: A 126 SER OG : rot 140:sc= 1.29 USER MOD Single : A 43 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 159:sc= 0.627 (180deg=0.362) USER MOD Single : A 45 SER OG : rot 128:sc= 1.57 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 ASN : amide:sc= -3.03! C(o=-3!,f=-10!) USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ 174:sc= 0.0373 (180deg=0.0227) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 SER OG : rot -98:sc= -1.19! USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 ASN : amide:sc= -16.6! C(o=-17!,f=-20!) USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot -30:sc= -1.3 USER MOD Single : A 111 THR OG1 : rot 180:sc= 0.228 USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 THR OG1 : rot 180:sc= 0.0322 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 THR OG1 : rot 39:sc= 0.0147 USER MOD Single : A 125 THR OG1 : rot 64:sc= -0.358 USER MOD ----------------------------------------------------------------- ATOM 12 N ASN A 36 -1.106 -16.813 -5.815 1.00 0.00 N ATOM 13 CA ASN A 36 -1.715 -15.495 -5.459 1.00 0.00 C ATOM 14 C ASN A 36 -1.025 -14.366 -6.230 1.00 0.00 C ATOM 15 O ASN A 36 -1.374 -13.211 -6.098 1.00 0.00 O ATOM 16 CB ASN A 36 -1.455 -15.341 -3.963 1.00 0.00 C ATOM 17 CG ASN A 36 -2.732 -15.656 -3.184 1.00 0.00 C ATOM 18 OD1 ASN A 36 -3.794 -15.784 -3.760 1.00 0.00 O ATOM 19 ND2 ASN A 36 -2.673 -15.786 -1.887 1.00 0.00 N ATOM 0 HA ASN A 36 -2.776 -15.450 -5.705 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -0.653 -16.011 -3.652 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -1.125 -14.326 -3.744 1.00 0.00 H new ATOM 0 HD21 ASN A 36 -3.519 -15.995 -1.356 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -1.781 -15.678 -1.404 1.00 0.00 H new ATOM 26 N ALA A 37 -0.036 -14.702 -7.015 1.00 0.00 N ATOM 27 CA ALA A 37 0.716 -13.681 -7.795 1.00 0.00 C ATOM 28 C ALA A 37 -0.176 -12.500 -8.202 1.00 0.00 C ATOM 29 O ALA A 37 -1.330 -12.664 -8.551 1.00 0.00 O ATOM 30 CB ALA A 37 1.208 -14.433 -9.029 1.00 0.00 C ATOM 0 H ALA A 37 0.287 -15.660 -7.150 1.00 0.00 H new ATOM 0 HA ALA A 37 1.527 -13.247 -7.211 1.00 0.00 H new ATOM 0 HB1 ALA A 37 1.776 -13.755 -9.666 1.00 0.00 H new ATOM 0 HB2 ALA A 37 1.846 -15.261 -8.720 1.00 0.00 H new ATOM 0 HB3 ALA A 37 0.353 -14.821 -9.583 1.00 0.00 H new ATOM 36 N VAL A 38 0.361 -11.309 -8.158 1.00 0.00 N ATOM 37 CA VAL A 38 -0.432 -10.103 -8.540 1.00 0.00 C ATOM 38 C VAL A 38 0.458 -9.122 -9.310 1.00 0.00 C ATOM 39 O VAL A 38 1.644 -9.340 -9.464 1.00 0.00 O ATOM 40 CB VAL A 38 -0.871 -9.483 -7.215 1.00 0.00 C ATOM 41 CG1 VAL A 38 -1.848 -10.422 -6.509 1.00 0.00 C ATOM 42 CG2 VAL A 38 0.359 -9.268 -6.331 1.00 0.00 C ATOM 0 H VAL A 38 1.321 -11.119 -7.872 1.00 0.00 H new ATOM 0 HA VAL A 38 -1.280 -10.348 -9.179 1.00 0.00 H new ATOM 0 HB VAL A 38 -1.362 -8.528 -7.402 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -2.160 -9.978 -5.564 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -2.721 -10.581 -7.141 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -1.360 -11.378 -6.318 1.00 0.00 H new ATOM 0 HG21 VAL A 38 0.053 -8.825 -5.383 1.00 0.00 H new ATOM 0 HG22 VAL A 38 0.845 -10.226 -6.144 1.00 0.00 H new ATOM 0 HG23 VAL A 38 1.057 -8.599 -6.835 1.00 0.00 H new ATOM 52 N VAL A 39 -0.094 -8.040 -9.790 1.00 0.00 N ATOM 53 CA VAL A 39 0.742 -7.058 -10.539 1.00 0.00 C ATOM 54 C VAL A 39 0.417 -5.628 -10.120 1.00 0.00 C ATOM 55 O VAL A 39 -0.725 -5.218 -10.128 1.00 0.00 O ATOM 56 CB VAL A 39 0.388 -7.248 -12.018 1.00 0.00 C ATOM 57 CG1 VAL A 39 -0.980 -6.616 -12.314 1.00 0.00 C ATOM 58 CG2 VAL A 39 1.447 -6.555 -12.881 1.00 0.00 C ATOM 0 H VAL A 39 -1.080 -7.795 -9.697 1.00 0.00 H new ATOM 0 HA VAL A 39 1.801 -7.222 -10.341 1.00 0.00 H new ATOM 0 HB VAL A 39 0.354 -8.314 -12.243 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -1.225 -6.755 -13.367 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -1.742 -7.093 -11.698 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -0.945 -5.550 -12.087 1.00 0.00 H new ATOM 0 HG21 VAL A 39 1.201 -6.687 -13.935 1.00 0.00 H new ATOM 0 HG22 VAL A 39 1.470 -5.491 -12.644 1.00 0.00 H new ATOM 0 HG23 VAL A 39 2.424 -6.993 -12.679 1.00 0.00 H new ATOM 68 N LEU A 40 1.411 -4.849 -9.811 1.00 0.00 N ATOM 69 CA LEU A 40 1.148 -3.438 -9.464 1.00 0.00 C ATOM 70 C LEU A 40 1.418 -2.633 -10.729 1.00 0.00 C ATOM 71 O LEU A 40 2.092 -3.105 -11.621 1.00 0.00 O ATOM 72 CB LEU A 40 2.147 -3.087 -8.357 1.00 0.00 C ATOM 73 CG LEU A 40 2.273 -1.568 -8.250 1.00 0.00 C ATOM 74 CD1 LEU A 40 1.019 -0.996 -7.583 1.00 0.00 C ATOM 75 CD2 LEU A 40 3.502 -1.215 -7.412 1.00 0.00 C ATOM 0 H LEU A 40 2.391 -5.131 -9.785 1.00 0.00 H new ATOM 0 HA LEU A 40 0.133 -3.239 -9.119 1.00 0.00 H new ATOM 0 HB2 LEU A 40 1.814 -3.503 -7.406 1.00 0.00 H new ATOM 0 HB3 LEU A 40 3.119 -3.529 -8.576 1.00 0.00 H new ATOM 0 HG LEU A 40 2.380 -1.142 -9.248 1.00 0.00 H new ATOM 0 HD11 LEU A 40 1.109 0.088 -7.507 1.00 0.00 H new ATOM 0 HD12 LEU A 40 0.143 -1.246 -8.181 1.00 0.00 H new ATOM 0 HD13 LEU A 40 0.911 -1.422 -6.586 1.00 0.00 H new ATOM 0 HD21 LEU A 40 3.592 -0.131 -7.336 1.00 0.00 H new ATOM 0 HD22 LEU A 40 3.397 -1.641 -6.414 1.00 0.00 H new ATOM 0 HD23 LEU A 40 4.395 -1.620 -7.887 1.00 0.00 H new ATOM 87 N VAL A 41 0.917 -1.443 -10.833 1.00 0.00 N ATOM 88 CA VAL A 41 1.158 -0.655 -12.064 1.00 0.00 C ATOM 89 C VAL A 41 0.779 0.798 -11.836 1.00 0.00 C ATOM 90 O VAL A 41 -0.369 1.132 -11.624 1.00 0.00 O ATOM 91 CB VAL A 41 0.254 -1.285 -13.131 1.00 0.00 C ATOM 92 CG1 VAL A 41 -0.068 -0.262 -14.213 1.00 0.00 C ATOM 93 CG2 VAL A 41 0.957 -2.491 -13.757 1.00 0.00 C ATOM 0 H VAL A 41 0.352 -0.981 -10.121 1.00 0.00 H new ATOM 0 HA VAL A 41 2.206 -0.670 -12.363 1.00 0.00 H new ATOM 0 HB VAL A 41 -0.674 -1.611 -12.661 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -0.710 -0.719 -14.966 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -0.581 0.590 -13.767 1.00 0.00 H new ATOM 0 HG13 VAL A 41 0.857 0.076 -14.681 1.00 0.00 H new ATOM 0 HG21 VAL A 41 0.311 -2.936 -14.514 1.00 0.00 H new ATOM 0 HG22 VAL A 41 1.890 -2.169 -14.219 1.00 0.00 H new ATOM 0 HG23 VAL A 41 1.171 -3.229 -12.984 1.00 0.00 H new ATOM 103 N LEU A 42 1.732 1.662 -11.914 1.00 0.00 N ATOM 104 CA LEU A 42 1.447 3.090 -11.741 1.00 0.00 C ATOM 105 C LEU A 42 2.186 3.873 -12.825 1.00 0.00 C ATOM 106 O LEU A 42 2.760 3.302 -13.731 1.00 0.00 O ATOM 107 CB LEU A 42 1.969 3.462 -10.351 1.00 0.00 C ATOM 108 CG LEU A 42 0.836 3.377 -9.328 1.00 0.00 C ATOM 109 CD1 LEU A 42 -0.353 4.202 -9.820 1.00 0.00 C ATOM 110 CD2 LEU A 42 0.413 1.919 -9.149 1.00 0.00 C ATOM 0 H LEU A 42 2.710 1.434 -12.093 1.00 0.00 H new ATOM 0 HA LEU A 42 0.384 3.318 -11.825 1.00 0.00 H new ATOM 0 HB2 LEU A 42 2.779 2.791 -10.066 1.00 0.00 H new ATOM 0 HB3 LEU A 42 2.382 4.471 -10.366 1.00 0.00 H new ATOM 0 HG LEU A 42 1.179 3.770 -8.371 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -1.163 4.143 -9.092 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -0.049 5.242 -9.942 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -0.696 3.810 -10.777 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -0.395 1.861 -8.419 1.00 0.00 H new ATOM 0 HD22 LEU A 42 0.069 1.520 -10.103 1.00 0.00 H new ATOM 0 HD23 LEU A 42 1.263 1.334 -8.797 1.00 0.00 H new ATOM 122 N MET A 43 2.190 5.167 -12.738 1.00 0.00 N ATOM 123 CA MET A 43 2.909 5.972 -13.770 1.00 0.00 C ATOM 124 C MET A 43 4.231 6.492 -13.195 1.00 0.00 C ATOM 125 O MET A 43 4.429 6.529 -11.996 1.00 0.00 O ATOM 126 CB MET A 43 1.971 7.134 -14.100 1.00 0.00 C ATOM 127 CG MET A 43 1.844 8.050 -12.883 1.00 0.00 C ATOM 128 SD MET A 43 0.557 9.284 -13.188 1.00 0.00 S ATOM 129 CE MET A 43 1.608 10.500 -14.017 1.00 0.00 C ATOM 0 H MET A 43 1.731 5.706 -12.004 1.00 0.00 H new ATOM 0 HA MET A 43 3.151 5.388 -14.658 1.00 0.00 H new ATOM 0 HB2 MET A 43 2.356 7.695 -14.952 1.00 0.00 H new ATOM 0 HB3 MET A 43 0.990 6.753 -14.386 1.00 0.00 H new ATOM 0 HG2 MET A 43 1.598 7.464 -11.998 1.00 0.00 H new ATOM 0 HG3 MET A 43 2.796 8.543 -12.685 1.00 0.00 H new ATOM 0 HE1 MET A 43 1.009 11.366 -14.300 1.00 0.00 H new ATOM 0 HE2 MET A 43 2.403 10.814 -13.341 1.00 0.00 H new ATOM 0 HE3 MET A 43 2.046 10.054 -14.910 1.00 0.00 H new ATOM 139 N LYS A 44 5.138 6.885 -14.043 1.00 0.00 N ATOM 140 CA LYS A 44 6.455 7.394 -13.557 1.00 0.00 C ATOM 141 C LYS A 44 6.277 8.366 -12.382 1.00 0.00 C ATOM 142 O LYS A 44 6.035 9.542 -12.572 1.00 0.00 O ATOM 143 CB LYS A 44 7.060 8.122 -14.757 1.00 0.00 C ATOM 144 CG LYS A 44 8.149 7.252 -15.390 1.00 0.00 C ATOM 145 CD LYS A 44 9.524 7.729 -14.917 1.00 0.00 C ATOM 146 CE LYS A 44 10.326 6.537 -14.392 1.00 0.00 C ATOM 147 NZ LYS A 44 11.100 6.047 -15.568 1.00 0.00 N ATOM 0 H LYS A 44 5.026 6.877 -15.057 1.00 0.00 H new ATOM 0 HA LYS A 44 7.089 6.585 -13.194 1.00 0.00 H new ATOM 0 HB2 LYS A 44 6.284 8.342 -15.490 1.00 0.00 H new ATOM 0 HB3 LYS A 44 7.481 9.077 -14.442 1.00 0.00 H new ATOM 0 HG2 LYS A 44 8.000 6.208 -15.115 1.00 0.00 H new ATOM 0 HG3 LYS A 44 8.087 7.307 -16.477 1.00 0.00 H new ATOM 0 HD2 LYS A 44 10.058 8.206 -15.739 1.00 0.00 H new ATOM 0 HD3 LYS A 44 9.411 8.478 -14.133 1.00 0.00 H new ATOM 0 HE2 LYS A 44 10.989 6.834 -13.579 1.00 0.00 H new ATOM 0 HE3 LYS A 44 9.669 5.761 -14.000 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 11.915 5.490 -15.240 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 10.489 5.450 -16.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 11.437 6.858 -16.124 1.00 0.00 H new ATOM 161 N SER A 45 6.412 7.890 -11.172 1.00 0.00 N ATOM 162 CA SER A 45 6.268 8.794 -9.992 1.00 0.00 C ATOM 163 C SER A 45 7.580 9.550 -9.738 1.00 0.00 C ATOM 164 O SER A 45 7.748 10.186 -8.716 1.00 0.00 O ATOM 165 CB SER A 45 5.938 7.877 -8.816 1.00 0.00 C ATOM 166 OG SER A 45 4.551 7.571 -8.836 1.00 0.00 O ATOM 0 H SER A 45 6.616 6.916 -10.950 1.00 0.00 H new ATOM 0 HA SER A 45 5.494 9.546 -10.145 1.00 0.00 H new ATOM 0 HB2 SER A 45 6.525 6.961 -8.878 1.00 0.00 H new ATOM 0 HB3 SER A 45 6.202 8.362 -7.876 1.00 0.00 H new ATOM 0 HG SER A 45 4.430 6.600 -8.789 1.00 0.00 H new ATOM 172 N ASP A 46 8.501 9.495 -10.673 1.00 0.00 N ATOM 173 CA ASP A 46 9.808 10.222 -10.528 1.00 0.00 C ATOM 174 C ASP A 46 10.790 9.484 -9.604 1.00 0.00 C ATOM 175 O ASP A 46 11.868 9.104 -10.017 1.00 0.00 O ATOM 176 CB ASP A 46 9.451 11.595 -9.944 1.00 0.00 C ATOM 177 CG ASP A 46 10.535 12.611 -10.312 1.00 0.00 C ATOM 178 OD1 ASP A 46 11.115 12.471 -11.375 1.00 0.00 O ATOM 179 OD2 ASP A 46 10.762 13.516 -9.523 1.00 0.00 O ATOM 0 H ASP A 46 8.402 8.971 -11.542 1.00 0.00 H new ATOM 0 HA ASP A 46 10.313 10.297 -11.491 1.00 0.00 H new ATOM 0 HB2 ASP A 46 8.485 11.924 -10.328 1.00 0.00 H new ATOM 0 HB3 ASP A 46 9.356 11.526 -8.860 1.00 0.00 H new ATOM 184 N GLU A 47 10.455 9.312 -8.353 1.00 0.00 N ATOM 185 CA GLU A 47 11.409 8.638 -7.413 1.00 0.00 C ATOM 186 C GLU A 47 11.156 7.132 -7.314 1.00 0.00 C ATOM 187 O GLU A 47 11.474 6.526 -6.317 1.00 0.00 O ATOM 188 CB GLU A 47 11.152 9.295 -6.055 1.00 0.00 C ATOM 189 CG GLU A 47 10.984 10.802 -6.243 1.00 0.00 C ATOM 190 CD GLU A 47 11.781 11.548 -5.172 1.00 0.00 C ATOM 191 OE1 GLU A 47 12.304 10.892 -4.286 1.00 0.00 O ATOM 192 OE2 GLU A 47 11.858 12.764 -5.256 1.00 0.00 O ATOM 0 H GLU A 47 9.570 9.605 -7.940 1.00 0.00 H new ATOM 0 HA GLU A 47 12.437 8.750 -7.758 1.00 0.00 H new ATOM 0 HB2 GLU A 47 10.257 8.873 -5.598 1.00 0.00 H new ATOM 0 HB3 GLU A 47 11.982 9.092 -5.378 1.00 0.00 H new ATOM 0 HG2 GLU A 47 11.327 11.095 -7.235 1.00 0.00 H new ATOM 0 HG3 GLU A 47 9.930 11.071 -6.178 1.00 0.00 H new ATOM 199 N ILE A 48 10.605 6.518 -8.325 1.00 0.00 N ATOM 200 CA ILE A 48 10.347 5.059 -8.257 1.00 0.00 C ATOM 201 C ILE A 48 11.633 4.287 -8.117 1.00 0.00 C ATOM 202 O ILE A 48 11.964 3.802 -7.054 1.00 0.00 O ATOM 203 CB ILE A 48 9.639 4.694 -9.532 1.00 0.00 C ATOM 204 CG1 ILE A 48 10.054 5.572 -10.713 1.00 0.00 C ATOM 205 CG2 ILE A 48 8.163 4.841 -9.256 1.00 0.00 C ATOM 206 CD1 ILE A 48 8.995 6.640 -10.923 1.00 0.00 C ATOM 0 H ILE A 48 10.323 6.968 -9.196 1.00 0.00 H new ATOM 0 HA ILE A 48 9.741 4.810 -7.386 1.00 0.00 H new ATOM 0 HB ILE A 48 9.902 3.676 -9.820 1.00 0.00 H new ATOM 0 HG12 ILE A 48 11.022 6.033 -10.519 1.00 0.00 H new ATOM 0 HG13 ILE A 48 10.164 4.967 -11.613 1.00 0.00 H new ATOM 0 HG21 ILE A 48 7.598 4.587 -10.153 1.00 0.00 H new ATOM 0 HG22 ILE A 48 7.876 4.172 -8.445 1.00 0.00 H new ATOM 0 HG23 ILE A 48 7.947 5.871 -8.971 1.00 0.00 H new ATOM 0 HD11 ILE A 48 9.279 7.274 -11.763 1.00 0.00 H new ATOM 0 HD12 ILE A 48 8.037 6.166 -11.134 1.00 0.00 H new ATOM 0 HD13 ILE A 48 8.908 7.248 -10.023 1.00 0.00 H new ATOM 218 N ASP A 49 12.365 4.172 -9.174 1.00 0.00 N ATOM 219 CA ASP A 49 13.662 3.439 -9.095 1.00 0.00 C ATOM 220 C ASP A 49 14.315 3.756 -7.745 1.00 0.00 C ATOM 221 O ASP A 49 14.960 2.928 -7.138 1.00 0.00 O ATOM 222 CB ASP A 49 14.502 3.982 -10.253 1.00 0.00 C ATOM 223 CG ASP A 49 15.529 2.931 -10.682 1.00 0.00 C ATOM 224 OD1 ASP A 49 16.524 2.785 -9.990 1.00 0.00 O ATOM 225 OD2 ASP A 49 15.306 2.296 -11.698 1.00 0.00 O ATOM 0 H ASP A 49 12.131 4.549 -10.092 1.00 0.00 H new ATOM 0 HA ASP A 49 13.553 2.357 -9.168 1.00 0.00 H new ATOM 0 HB2 ASP A 49 13.857 4.239 -11.094 1.00 0.00 H new ATOM 0 HB3 ASP A 49 15.009 4.898 -9.949 1.00 0.00 H new ATOM 230 N ALA A 50 14.086 4.948 -7.255 1.00 0.00 N ATOM 231 CA ALA A 50 14.626 5.332 -5.926 1.00 0.00 C ATOM 232 C ALA A 50 13.781 4.680 -4.837 1.00 0.00 C ATOM 233 O ALA A 50 14.285 3.952 -4.004 1.00 0.00 O ATOM 234 CB ALA A 50 14.510 6.857 -5.865 1.00 0.00 C ATOM 0 H ALA A 50 13.544 5.673 -7.726 1.00 0.00 H new ATOM 0 HA ALA A 50 15.657 5.010 -5.780 1.00 0.00 H new ATOM 0 HB1 ALA A 50 14.891 7.213 -4.908 1.00 0.00 H new ATOM 0 HB2 ALA A 50 15.091 7.299 -6.674 1.00 0.00 H new ATOM 0 HB3 ALA A 50 13.464 7.147 -5.969 1.00 0.00 H new ATOM 240 N ILE A 51 12.495 4.913 -4.837 1.00 0.00 N ATOM 241 CA ILE A 51 11.651 4.289 -3.821 1.00 0.00 C ATOM 242 C ILE A 51 11.528 2.795 -4.096 1.00 0.00 C ATOM 243 O ILE A 51 11.811 2.010 -3.243 1.00 0.00 O ATOM 244 CB ILE A 51 10.322 5.002 -3.929 1.00 0.00 C ATOM 245 CG1 ILE A 51 9.763 4.882 -5.336 1.00 0.00 C ATOM 246 CG2 ILE A 51 10.490 6.475 -3.550 1.00 0.00 C ATOM 247 CD1 ILE A 51 8.989 6.151 -5.739 1.00 0.00 C ATOM 0 H ILE A 51 12.008 5.511 -5.504 1.00 0.00 H new ATOM 0 HA ILE A 51 12.057 4.376 -2.813 1.00 0.00 H new ATOM 0 HB ILE A 51 9.618 4.535 -3.240 1.00 0.00 H new ATOM 0 HG12 ILE A 51 10.577 4.711 -6.040 1.00 0.00 H new ATOM 0 HG13 ILE A 51 9.103 4.016 -5.395 1.00 0.00 H new ATOM 0 HG21 ILE A 51 9.529 6.983 -3.630 1.00 0.00 H new ATOM 0 HG22 ILE A 51 10.855 6.548 -2.525 1.00 0.00 H new ATOM 0 HG23 ILE A 51 11.206 6.945 -4.224 1.00 0.00 H new ATOM 0 HD11 ILE A 51 8.601 6.035 -6.751 1.00 0.00 H new ATOM 0 HD12 ILE A 51 8.160 6.306 -5.048 1.00 0.00 H new ATOM 0 HD13 ILE A 51 9.657 7.011 -5.703 1.00 0.00 H new ATOM 259 N ILE A 52 11.161 2.370 -5.277 1.00 0.00 N ATOM 260 CA ILE A 52 11.095 0.898 -5.509 1.00 0.00 C ATOM 261 C ILE A 52 12.387 0.280 -4.997 1.00 0.00 C ATOM 262 O ILE A 52 12.411 -0.776 -4.405 1.00 0.00 O ATOM 263 CB ILE A 52 10.996 0.723 -7.008 1.00 0.00 C ATOM 264 CG1 ILE A 52 9.718 1.393 -7.524 1.00 0.00 C ATOM 265 CG2 ILE A 52 10.975 -0.773 -7.331 1.00 0.00 C ATOM 266 CD1 ILE A 52 8.489 0.733 -6.893 1.00 0.00 C ATOM 0 H ILE A 52 10.911 2.960 -6.071 1.00 0.00 H new ATOM 0 HA ILE A 52 10.254 0.426 -5.002 1.00 0.00 H new ATOM 0 HB ILE A 52 11.854 1.188 -7.494 1.00 0.00 H new ATOM 0 HG12 ILE A 52 9.733 2.456 -7.285 1.00 0.00 H new ATOM 0 HG13 ILE A 52 9.668 1.311 -8.610 1.00 0.00 H new ATOM 0 HG21 ILE A 52 10.904 -0.911 -8.410 1.00 0.00 H new ATOM 0 HG22 ILE A 52 11.891 -1.237 -6.965 1.00 0.00 H new ATOM 0 HG23 ILE A 52 10.115 -1.237 -6.848 1.00 0.00 H new ATOM 0 HD11 ILE A 52 7.585 1.216 -7.265 1.00 0.00 H new ATOM 0 HD12 ILE A 52 8.470 -0.325 -7.155 1.00 0.00 H new ATOM 0 HD13 ILE A 52 8.536 0.838 -5.809 1.00 0.00 H new ATOM 278 N GLU A 53 13.471 0.954 -5.209 1.00 0.00 N ATOM 279 CA GLU A 53 14.763 0.430 -4.727 1.00 0.00 C ATOM 280 C GLU A 53 14.762 0.334 -3.198 1.00 0.00 C ATOM 281 O GLU A 53 14.910 -0.733 -2.635 1.00 0.00 O ATOM 282 CB GLU A 53 15.786 1.454 -5.209 1.00 0.00 C ATOM 283 CG GLU A 53 17.117 1.266 -4.474 1.00 0.00 C ATOM 284 CD GLU A 53 17.922 2.565 -4.538 1.00 0.00 C ATOM 285 OE1 GLU A 53 17.319 3.619 -4.423 1.00 0.00 O ATOM 286 OE2 GLU A 53 19.128 2.484 -4.702 1.00 0.00 O ATOM 0 H GLU A 53 13.517 1.848 -5.697 1.00 0.00 H new ATOM 0 HA GLU A 53 14.977 -0.573 -5.097 1.00 0.00 H new ATOM 0 HB2 GLU A 53 15.938 1.348 -6.283 1.00 0.00 H new ATOM 0 HB3 GLU A 53 15.409 2.462 -5.039 1.00 0.00 H new ATOM 0 HG2 GLU A 53 16.935 0.989 -3.436 1.00 0.00 H new ATOM 0 HG3 GLU A 53 17.683 0.452 -4.927 1.00 0.00 H new ATOM 293 N ASP A 54 14.600 1.443 -2.524 1.00 0.00 N ATOM 294 CA ASP A 54 14.618 1.424 -1.024 1.00 0.00 C ATOM 295 C ASP A 54 13.272 0.988 -0.457 1.00 0.00 C ATOM 296 O ASP A 54 13.131 0.720 0.719 1.00 0.00 O ATOM 297 CB ASP A 54 14.909 2.865 -0.636 1.00 0.00 C ATOM 298 CG ASP A 54 14.949 2.996 0.888 1.00 0.00 C ATOM 299 OD1 ASP A 54 15.679 2.239 1.508 1.00 0.00 O ATOM 300 OD2 ASP A 54 14.254 3.852 1.408 1.00 0.00 O ATOM 0 H ASP A 54 14.456 2.362 -2.943 1.00 0.00 H new ATOM 0 HA ASP A 54 15.353 0.720 -0.635 1.00 0.00 H new ATOM 0 HB2 ASP A 54 15.862 3.180 -1.062 1.00 0.00 H new ATOM 0 HB3 ASP A 54 14.143 3.523 -1.046 1.00 0.00 H new ATOM 305 N ILE A 55 12.285 0.940 -1.284 1.00 0.00 N ATOM 306 CA ILE A 55 10.929 0.551 -0.824 1.00 0.00 C ATOM 307 C ILE A 55 10.595 -0.864 -1.291 1.00 0.00 C ATOM 308 O ILE A 55 9.864 -1.591 -0.649 1.00 0.00 O ATOM 309 CB ILE A 55 10.007 1.587 -1.479 1.00 0.00 C ATOM 310 CG1 ILE A 55 8.809 1.858 -0.591 1.00 0.00 C ATOM 311 CG2 ILE A 55 9.497 1.066 -2.806 1.00 0.00 C ATOM 312 CD1 ILE A 55 9.262 2.535 0.703 1.00 0.00 C ATOM 0 H ILE A 55 12.355 1.156 -2.278 1.00 0.00 H new ATOM 0 HA ILE A 55 10.831 0.540 0.262 1.00 0.00 H new ATOM 0 HB ILE A 55 10.580 2.502 -1.628 1.00 0.00 H new ATOM 0 HG12 ILE A 55 8.095 2.494 -1.114 1.00 0.00 H new ATOM 0 HG13 ILE A 55 8.296 0.924 -0.362 1.00 0.00 H new ATOM 0 HG21 ILE A 55 8.843 1.810 -3.262 1.00 0.00 H new ATOM 0 HG22 ILE A 55 10.340 0.869 -3.468 1.00 0.00 H new ATOM 0 HG23 ILE A 55 8.940 0.143 -2.645 1.00 0.00 H new ATOM 0 HD11 ILE A 55 8.396 2.727 1.336 1.00 0.00 H new ATOM 0 HD12 ILE A 55 9.959 1.883 1.230 1.00 0.00 H new ATOM 0 HD13 ILE A 55 9.755 3.478 0.467 1.00 0.00 H new ATOM 324 N VAL A 56 11.090 -1.232 -2.434 1.00 0.00 N ATOM 325 CA VAL A 56 10.764 -2.568 -2.983 1.00 0.00 C ATOM 326 C VAL A 56 12.007 -3.462 -3.148 1.00 0.00 C ATOM 327 O VAL A 56 11.973 -4.624 -2.802 1.00 0.00 O ATOM 328 CB VAL A 56 10.099 -2.239 -4.320 1.00 0.00 C ATOM 329 CG1 VAL A 56 10.293 -3.381 -5.309 1.00 0.00 C ATOM 330 CG2 VAL A 56 8.604 -2.014 -4.082 1.00 0.00 C ATOM 0 H VAL A 56 11.708 -0.663 -3.012 1.00 0.00 H new ATOM 0 HA VAL A 56 10.122 -3.150 -2.321 1.00 0.00 H new ATOM 0 HB VAL A 56 10.554 -1.341 -4.738 1.00 0.00 H new ATOM 0 HG11 VAL A 56 9.813 -3.129 -6.255 1.00 0.00 H new ATOM 0 HG12 VAL A 56 11.358 -3.542 -5.474 1.00 0.00 H new ATOM 0 HG13 VAL A 56 9.847 -4.290 -4.907 1.00 0.00 H new ATOM 0 HG21 VAL A 56 8.116 -1.778 -5.028 1.00 0.00 H new ATOM 0 HG22 VAL A 56 8.162 -2.918 -3.661 1.00 0.00 H new ATOM 0 HG23 VAL A 56 8.467 -1.186 -3.387 1.00 0.00 H new ATOM 340 N LEU A 57 13.098 -2.968 -3.678 1.00 0.00 N ATOM 341 CA LEU A 57 14.279 -3.873 -3.837 1.00 0.00 C ATOM 342 C LEU A 57 14.535 -4.597 -2.513 1.00 0.00 C ATOM 343 O LEU A 57 14.796 -5.783 -2.478 1.00 0.00 O ATOM 344 CB LEU A 57 15.441 -2.952 -4.253 1.00 0.00 C ATOM 345 CG LEU A 57 16.659 -3.109 -3.331 1.00 0.00 C ATOM 346 CD1 LEU A 57 17.461 -4.340 -3.754 1.00 0.00 C ATOM 347 CD2 LEU A 57 17.538 -1.862 -3.444 1.00 0.00 C ATOM 0 H LEU A 57 13.223 -2.008 -3.999 1.00 0.00 H new ATOM 0 HA LEU A 57 14.137 -4.652 -4.586 1.00 0.00 H new ATOM 0 HB2 LEU A 57 15.732 -3.177 -5.279 1.00 0.00 H new ATOM 0 HB3 LEU A 57 15.105 -1.915 -4.237 1.00 0.00 H new ATOM 0 HG LEU A 57 16.327 -3.231 -2.300 1.00 0.00 H new ATOM 0 HD11 LEU A 57 18.326 -4.453 -3.100 1.00 0.00 H new ATOM 0 HD12 LEU A 57 16.832 -5.227 -3.680 1.00 0.00 H new ATOM 0 HD13 LEU A 57 17.798 -4.219 -4.784 1.00 0.00 H new ATOM 0 HD21 LEU A 57 18.405 -1.967 -2.791 1.00 0.00 H new ATOM 0 HD22 LEU A 57 17.872 -1.745 -4.475 1.00 0.00 H new ATOM 0 HD23 LEU A 57 16.964 -0.984 -3.146 1.00 0.00 H new ATOM 359 N LYS A 58 14.449 -3.886 -1.428 1.00 0.00 N ATOM 360 CA LYS A 58 14.668 -4.511 -0.094 1.00 0.00 C ATOM 361 C LYS A 58 13.362 -5.138 0.397 1.00 0.00 C ATOM 362 O LYS A 58 13.337 -6.243 0.901 1.00 0.00 O ATOM 363 CB LYS A 58 15.080 -3.354 0.818 1.00 0.00 C ATOM 364 CG LYS A 58 16.564 -3.474 1.174 1.00 0.00 C ATOM 365 CD LYS A 58 16.922 -2.408 2.213 1.00 0.00 C ATOM 366 CE LYS A 58 18.219 -2.796 2.929 1.00 0.00 C ATOM 367 NZ LYS A 58 18.193 -2.030 4.207 1.00 0.00 N ATOM 0 H LYS A 58 14.234 -2.889 -1.406 1.00 0.00 H new ATOM 0 HA LYS A 58 15.421 -5.299 -0.116 1.00 0.00 H new ATOM 0 HB2 LYS A 58 14.892 -2.403 0.320 1.00 0.00 H new ATOM 0 HB3 LYS A 58 14.477 -3.363 1.726 1.00 0.00 H new ATOM 0 HG2 LYS A 58 16.776 -4.468 1.568 1.00 0.00 H new ATOM 0 HG3 LYS A 58 17.176 -3.348 0.281 1.00 0.00 H new ATOM 0 HD2 LYS A 58 17.040 -1.439 1.728 1.00 0.00 H new ATOM 0 HD3 LYS A 58 16.113 -2.306 2.936 1.00 0.00 H new ATOM 0 HE2 LYS A 58 18.264 -3.870 3.112 1.00 0.00 H new ATOM 0 HE3 LYS A 58 19.093 -2.538 2.331 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 19.050 -2.242 4.756 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 18.157 -1.011 4.001 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 17.353 -2.301 4.757 1.00 0.00 H new ATOM 381 N GLY A 59 12.274 -4.432 0.250 1.00 0.00 N ATOM 382 CA GLY A 59 10.962 -4.974 0.702 1.00 0.00 C ATOM 383 C GLY A 59 10.592 -6.195 -0.142 1.00 0.00 C ATOM 384 O GLY A 59 10.268 -7.244 0.379 1.00 0.00 O ATOM 0 H GLY A 59 12.238 -3.501 -0.165 1.00 0.00 H new ATOM 0 HA2 GLY A 59 11.015 -5.250 1.755 1.00 0.00 H new ATOM 0 HA3 GLY A 59 10.191 -4.209 0.611 1.00 0.00 H new ATOM 388 N GLY A 60 10.633 -6.071 -1.440 1.00 0.00 N ATOM 389 CA GLY A 60 10.279 -7.232 -2.307 1.00 0.00 C ATOM 390 C GLY A 60 11.360 -8.313 -2.193 1.00 0.00 C ATOM 391 O GLY A 60 11.212 -9.408 -2.695 1.00 0.00 O ATOM 0 H GLY A 60 10.895 -5.220 -1.937 1.00 0.00 H new ATOM 0 HA2 GLY A 60 9.312 -7.638 -2.010 1.00 0.00 H new ATOM 0 HA3 GLY A 60 10.183 -6.908 -3.343 1.00 0.00 H new ATOM 395 N LYS A 61 12.446 -8.013 -1.540 1.00 0.00 N ATOM 396 CA LYS A 61 13.536 -9.023 -1.397 1.00 0.00 C ATOM 397 C LYS A 61 13.597 -9.566 0.039 1.00 0.00 C ATOM 398 O LYS A 61 14.316 -10.502 0.325 1.00 0.00 O ATOM 399 CB LYS A 61 14.817 -8.261 -1.742 1.00 0.00 C ATOM 400 CG LYS A 61 16.020 -9.204 -1.674 1.00 0.00 C ATOM 401 CD LYS A 61 16.060 -10.078 -2.929 1.00 0.00 C ATOM 402 CE LYS A 61 16.470 -11.501 -2.543 1.00 0.00 C ATOM 403 NZ LYS A 61 17.959 -11.483 -2.530 1.00 0.00 N ATOM 0 H LYS A 61 12.629 -7.112 -1.098 1.00 0.00 H new ATOM 0 HA LYS A 61 13.381 -9.887 -2.043 1.00 0.00 H new ATOM 0 HB2 LYS A 61 14.737 -7.832 -2.741 1.00 0.00 H new ATOM 0 HB3 LYS A 61 14.955 -7.432 -1.048 1.00 0.00 H new ATOM 0 HG2 LYS A 61 16.942 -8.628 -1.590 1.00 0.00 H new ATOM 0 HG3 LYS A 61 15.954 -9.830 -0.784 1.00 0.00 H new ATOM 0 HD2 LYS A 61 15.082 -10.087 -3.411 1.00 0.00 H new ATOM 0 HD3 LYS A 61 16.767 -9.667 -3.650 1.00 0.00 H new ATOM 0 HE2 LYS A 61 16.070 -11.776 -1.567 1.00 0.00 H new ATOM 0 HE3 LYS A 61 16.090 -12.229 -3.260 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 18.315 -12.426 -2.273 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 18.311 -11.225 -3.474 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 18.292 -10.786 -1.834 1.00 0.00 H new ATOM 417 N ALA A 62 12.863 -8.980 0.950 1.00 0.00 N ATOM 418 CA ALA A 62 12.902 -9.454 2.352 1.00 0.00 C ATOM 419 C ALA A 62 11.932 -10.615 2.556 1.00 0.00 C ATOM 420 O ALA A 62 12.316 -11.768 2.569 1.00 0.00 O ATOM 421 CB ALA A 62 12.481 -8.249 3.195 1.00 0.00 C ATOM 0 H ALA A 62 12.239 -8.192 0.776 1.00 0.00 H new ATOM 0 HA ALA A 62 13.891 -9.821 2.629 1.00 0.00 H new ATOM 0 HB1 ALA A 62 12.486 -8.523 4.250 1.00 0.00 H new ATOM 0 HB2 ALA A 62 13.179 -7.428 3.030 1.00 0.00 H new ATOM 0 HB3 ALA A 62 11.478 -7.936 2.906 1.00 0.00 H new ATOM 427 N LYS A 63 10.674 -10.316 2.695 1.00 0.00 N ATOM 428 CA LYS A 63 9.662 -11.394 2.878 1.00 0.00 C ATOM 429 C LYS A 63 9.221 -11.847 1.498 1.00 0.00 C ATOM 430 O LYS A 63 8.853 -12.982 1.272 1.00 0.00 O ATOM 431 CB LYS A 63 8.498 -10.743 3.628 1.00 0.00 C ATOM 432 CG LYS A 63 9.034 -9.839 4.739 1.00 0.00 C ATOM 433 CD LYS A 63 7.926 -8.900 5.206 1.00 0.00 C ATOM 434 CE LYS A 63 7.865 -7.694 4.267 1.00 0.00 C ATOM 435 NZ LYS A 63 6.931 -6.737 4.926 1.00 0.00 N ATOM 0 H LYS A 63 10.299 -9.367 2.690 1.00 0.00 H new ATOM 0 HA LYS A 63 10.039 -12.257 3.427 1.00 0.00 H new ATOM 0 HB2 LYS A 63 7.889 -10.161 2.936 1.00 0.00 H new ATOM 0 HB3 LYS A 63 7.852 -11.512 4.053 1.00 0.00 H new ATOM 0 HG2 LYS A 63 9.391 -10.442 5.574 1.00 0.00 H new ATOM 0 HG3 LYS A 63 9.885 -9.263 4.376 1.00 0.00 H new ATOM 0 HD2 LYS A 63 6.969 -9.421 5.212 1.00 0.00 H new ATOM 0 HD3 LYS A 63 8.117 -8.572 6.228 1.00 0.00 H new ATOM 0 HE2 LYS A 63 8.851 -7.251 4.129 1.00 0.00 H new ATOM 0 HE3 LYS A 63 7.504 -7.981 3.279 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 6.838 -5.883 4.340 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 5.998 -7.183 5.038 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 7.304 -6.476 5.861 1.00 0.00 H new ATOM 449 N ASN A 64 9.276 -10.938 0.576 1.00 0.00 N ATOM 450 CA ASN A 64 8.886 -11.241 -0.826 1.00 0.00 C ATOM 451 C ASN A 64 9.909 -12.187 -1.465 1.00 0.00 C ATOM 452 O ASN A 64 11.092 -11.904 -1.488 1.00 0.00 O ATOM 453 CB ASN A 64 8.910 -9.875 -1.511 1.00 0.00 C ATOM 454 CG ASN A 64 7.511 -9.253 -1.465 1.00 0.00 C ATOM 455 OD1 ASN A 64 6.722 -9.429 -2.372 1.00 0.00 O ATOM 456 ND2 ASN A 64 7.169 -8.527 -0.437 1.00 0.00 N ATOM 0 H ASN A 64 9.580 -9.978 0.735 1.00 0.00 H new ATOM 0 HA ASN A 64 7.917 -11.734 -0.906 1.00 0.00 H new ATOM 0 HB2 ASN A 64 9.627 -9.221 -1.015 1.00 0.00 H new ATOM 0 HB3 ASN A 64 9.238 -9.981 -2.545 1.00 0.00 H new ATOM 0 HD21 ASN A 64 6.240 -8.108 -0.395 1.00 0.00 H new ATOM 0 HD22 ASN A 64 7.830 -8.378 0.325 1.00 0.00 H new ATOM 463 N PRO A 65 9.410 -13.283 -1.965 1.00 0.00 N ATOM 464 CA PRO A 65 10.266 -14.304 -2.621 1.00 0.00 C ATOM 465 C PRO A 65 10.949 -13.721 -3.860 1.00 0.00 C ATOM 466 O PRO A 65 12.124 -13.933 -4.091 1.00 0.00 O ATOM 467 CB PRO A 65 9.259 -15.389 -3.001 1.00 0.00 C ATOM 468 CG PRO A 65 7.965 -14.670 -3.093 1.00 0.00 C ATOM 469 CD PRO A 65 8.005 -13.688 -1.981 1.00 0.00 C ATOM 0 HA PRO A 65 11.075 -14.671 -1.989 1.00 0.00 H new ATOM 0 HB2 PRO A 65 9.521 -15.861 -3.948 1.00 0.00 H new ATOM 0 HB3 PRO A 65 9.223 -16.179 -2.251 1.00 0.00 H new ATOM 0 HG2 PRO A 65 7.855 -14.173 -4.057 1.00 0.00 H new ATOM 0 HG3 PRO A 65 7.123 -15.354 -2.988 1.00 0.00 H new ATOM 0 HD2 PRO A 65 7.341 -12.843 -2.162 1.00 0.00 H new ATOM 0 HD3 PRO A 65 7.701 -14.135 -1.034 1.00 0.00 H new ATOM 477 N SER A 66 10.229 -12.973 -4.650 1.00 0.00 N ATOM 478 CA SER A 66 10.834 -12.364 -5.861 1.00 0.00 C ATOM 479 C SER A 66 9.792 -11.566 -6.601 1.00 0.00 C ATOM 480 O SER A 66 8.834 -12.075 -7.149 1.00 0.00 O ATOM 481 CB SER A 66 11.366 -13.521 -6.705 1.00 0.00 C ATOM 482 OG SER A 66 12.562 -13.116 -7.359 1.00 0.00 O ATOM 0 H SER A 66 9.242 -12.758 -4.505 1.00 0.00 H new ATOM 0 HA SER A 66 11.643 -11.676 -5.616 1.00 0.00 H new ATOM 0 HB2 SER A 66 11.559 -14.388 -6.073 1.00 0.00 H new ATOM 0 HB3 SER A 66 10.620 -13.822 -7.440 1.00 0.00 H new ATOM 0 HG SER A 66 12.906 -13.857 -7.900 1.00 0.00 H new ATOM 488 N ILE A 67 9.976 -10.298 -6.548 1.00 0.00 N ATOM 489 CA ILE A 67 9.046 -9.353 -7.149 1.00 0.00 C ATOM 490 C ILE A 67 9.631 -8.771 -8.435 1.00 0.00 C ATOM 491 O ILE A 67 10.829 -8.635 -8.580 1.00 0.00 O ATOM 492 CB ILE A 67 8.936 -8.313 -6.043 1.00 0.00 C ATOM 493 CG1 ILE A 67 7.942 -8.795 -4.976 1.00 0.00 C ATOM 494 CG2 ILE A 67 8.469 -6.961 -6.601 1.00 0.00 C ATOM 495 CD1 ILE A 67 8.152 -10.291 -4.709 1.00 0.00 C ATOM 0 H ILE A 67 10.775 -9.862 -6.088 1.00 0.00 H new ATOM 0 HA ILE A 67 8.086 -9.773 -7.450 1.00 0.00 H new ATOM 0 HB ILE A 67 9.923 -8.182 -5.599 1.00 0.00 H new ATOM 0 HG12 ILE A 67 8.080 -8.229 -4.055 1.00 0.00 H new ATOM 0 HG13 ILE A 67 6.920 -8.616 -5.310 1.00 0.00 H new ATOM 0 HG21 ILE A 67 8.399 -6.237 -5.789 1.00 0.00 H new ATOM 0 HG22 ILE A 67 9.185 -6.607 -7.343 1.00 0.00 H new ATOM 0 HG23 ILE A 67 7.491 -7.078 -7.068 1.00 0.00 H new ATOM 0 HD11 ILE A 67 7.445 -10.628 -3.951 1.00 0.00 H new ATOM 0 HD12 ILE A 67 7.991 -10.851 -5.630 1.00 0.00 H new ATOM 0 HD13 ILE A 67 9.169 -10.458 -4.355 1.00 0.00 H new ATOM 507 N VAL A 68 8.793 -8.422 -9.367 1.00 0.00 N ATOM 508 CA VAL A 68 9.307 -7.842 -10.642 1.00 0.00 C ATOM 509 C VAL A 68 9.094 -6.320 -10.651 1.00 0.00 C ATOM 510 O VAL A 68 8.013 -5.835 -10.382 1.00 0.00 O ATOM 511 CB VAL A 68 8.511 -8.551 -11.760 1.00 0.00 C ATOM 512 CG1 VAL A 68 7.480 -7.606 -12.395 1.00 0.00 C ATOM 513 CG2 VAL A 68 9.481 -9.028 -12.844 1.00 0.00 C ATOM 0 H VAL A 68 7.779 -8.511 -9.305 1.00 0.00 H new ATOM 0 HA VAL A 68 10.378 -7.995 -10.776 1.00 0.00 H new ATOM 0 HB VAL A 68 7.982 -9.396 -11.319 1.00 0.00 H new ATOM 0 HG11 VAL A 68 6.936 -8.134 -13.178 1.00 0.00 H new ATOM 0 HG12 VAL A 68 6.779 -7.267 -11.632 1.00 0.00 H new ATOM 0 HG13 VAL A 68 7.992 -6.746 -12.826 1.00 0.00 H new ATOM 0 HG21 VAL A 68 8.924 -9.529 -13.636 1.00 0.00 H new ATOM 0 HG22 VAL A 68 10.012 -8.172 -13.260 1.00 0.00 H new ATOM 0 HG23 VAL A 68 10.199 -9.723 -12.409 1.00 0.00 H new ATOM 523 N VAL A 69 10.112 -5.568 -10.963 1.00 0.00 N ATOM 524 CA VAL A 69 9.957 -4.086 -10.994 1.00 0.00 C ATOM 525 C VAL A 69 10.121 -3.575 -12.428 1.00 0.00 C ATOM 526 O VAL A 69 11.219 -3.440 -12.930 1.00 0.00 O ATOM 527 CB VAL A 69 11.064 -3.542 -10.093 1.00 0.00 C ATOM 528 CG1 VAL A 69 11.159 -2.025 -10.263 1.00 0.00 C ATOM 529 CG2 VAL A 69 10.737 -3.866 -8.632 1.00 0.00 C ATOM 0 H VAL A 69 11.043 -5.914 -11.197 1.00 0.00 H new ATOM 0 HA VAL A 69 8.973 -3.766 -10.651 1.00 0.00 H new ATOM 0 HB VAL A 69 12.014 -4.002 -10.367 1.00 0.00 H new ATOM 0 HG11 VAL A 69 11.949 -1.636 -9.620 1.00 0.00 H new ATOM 0 HG12 VAL A 69 11.387 -1.789 -11.302 1.00 0.00 H new ATOM 0 HG13 VAL A 69 10.209 -1.568 -9.988 1.00 0.00 H new ATOM 0 HG21 VAL A 69 11.526 -3.478 -7.988 1.00 0.00 H new ATOM 0 HG22 VAL A 69 9.788 -3.404 -8.361 1.00 0.00 H new ATOM 0 HG23 VAL A 69 10.664 -4.946 -8.506 1.00 0.00 H new ATOM 539 N GLU A 70 9.033 -3.303 -13.092 1.00 0.00 N ATOM 540 CA GLU A 70 9.111 -2.811 -14.500 1.00 0.00 C ATOM 541 C GLU A 70 9.192 -1.281 -14.535 1.00 0.00 C ATOM 542 O GLU A 70 8.213 -0.608 -14.791 1.00 0.00 O ATOM 543 CB GLU A 70 7.811 -3.276 -15.166 1.00 0.00 C ATOM 544 CG GLU A 70 7.436 -4.680 -14.688 1.00 0.00 C ATOM 545 CD GLU A 70 8.637 -5.616 -14.850 1.00 0.00 C ATOM 546 OE1 GLU A 70 9.658 -5.350 -14.238 1.00 0.00 O ATOM 547 OE2 GLU A 70 8.515 -6.584 -15.582 1.00 0.00 O ATOM 0 H GLU A 70 8.088 -3.400 -12.721 1.00 0.00 H new ATOM 0 HA GLU A 70 9.997 -3.193 -15.007 1.00 0.00 H new ATOM 0 HB2 GLU A 70 7.006 -2.579 -14.932 1.00 0.00 H new ATOM 0 HB3 GLU A 70 7.930 -3.274 -16.250 1.00 0.00 H new ATOM 0 HG2 GLU A 70 7.125 -4.649 -13.644 1.00 0.00 H new ATOM 0 HG3 GLU A 70 6.589 -5.056 -15.262 1.00 0.00 H new ATOM 554 N ASP A 71 10.348 -0.725 -14.298 1.00 0.00 N ATOM 555 CA ASP A 71 10.471 0.761 -14.341 1.00 0.00 C ATOM 556 C ASP A 71 10.597 1.219 -15.797 1.00 0.00 C ATOM 557 O ASP A 71 11.681 1.298 -16.340 1.00 0.00 O ATOM 558 CB ASP A 71 11.749 1.081 -13.564 1.00 0.00 C ATOM 559 CG ASP A 71 11.465 1.017 -12.062 1.00 0.00 C ATOM 560 OD1 ASP A 71 10.327 0.765 -11.705 1.00 0.00 O ATOM 561 OD2 ASP A 71 12.392 1.221 -11.296 1.00 0.00 O ATOM 0 H ASP A 71 11.207 -1.230 -14.078 1.00 0.00 H new ATOM 0 HA ASP A 71 9.606 1.266 -13.912 1.00 0.00 H new ATOM 0 HB2 ASP A 71 12.534 0.372 -13.827 1.00 0.00 H new ATOM 0 HB3 ASP A 71 12.112 2.073 -13.834 1.00 0.00 H new ATOM 566 N LYS A 72 9.498 1.513 -16.437 1.00 0.00 N ATOM 567 CA LYS A 72 9.563 1.953 -17.860 1.00 0.00 C ATOM 568 C LYS A 72 9.708 3.473 -17.944 1.00 0.00 C ATOM 569 O LYS A 72 9.314 4.197 -17.052 1.00 0.00 O ATOM 570 CB LYS A 72 8.236 1.505 -18.475 1.00 0.00 C ATOM 571 CG LYS A 72 8.512 0.554 -19.642 1.00 0.00 C ATOM 572 CD LYS A 72 7.456 0.756 -20.731 1.00 0.00 C ATOM 573 CE LYS A 72 6.788 -0.584 -21.052 1.00 0.00 C ATOM 574 NZ LYS A 72 5.497 -0.556 -20.310 1.00 0.00 N ATOM 0 H LYS A 72 8.561 1.468 -16.038 1.00 0.00 H new ATOM 0 HA LYS A 72 10.420 1.527 -18.382 1.00 0.00 H new ATOM 0 HB2 LYS A 72 7.624 1.007 -17.723 1.00 0.00 H new ATOM 0 HB3 LYS A 72 7.673 2.371 -18.823 1.00 0.00 H new ATOM 0 HG2 LYS A 72 9.507 0.739 -20.047 1.00 0.00 H new ATOM 0 HG3 LYS A 72 8.497 -0.479 -19.294 1.00 0.00 H new ATOM 0 HD2 LYS A 72 6.709 1.476 -20.398 1.00 0.00 H new ATOM 0 HD3 LYS A 72 7.918 1.168 -21.628 1.00 0.00 H new ATOM 0 HE2 LYS A 72 6.625 -0.698 -22.124 1.00 0.00 H new ATOM 0 HE3 LYS A 72 7.409 -1.421 -20.733 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 4.935 -1.395 -20.559 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 5.684 -0.556 -19.287 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 4.969 0.303 -20.565 1.00 0.00 H new ATOM 588 N ALA A 73 10.274 3.959 -19.013 1.00 0.00 N ATOM 589 CA ALA A 73 10.450 5.430 -19.162 1.00 0.00 C ATOM 590 C ALA A 73 9.093 6.141 -19.121 1.00 0.00 C ATOM 591 O ALA A 73 9.022 7.347 -19.001 1.00 0.00 O ATOM 592 CB ALA A 73 11.109 5.609 -20.529 1.00 0.00 C ATOM 0 H ALA A 73 10.623 3.400 -19.791 1.00 0.00 H new ATOM 0 HA ALA A 73 11.050 5.856 -18.358 1.00 0.00 H new ATOM 0 HB1 ALA A 73 11.274 6.670 -20.717 1.00 0.00 H new ATOM 0 HB2 ALA A 73 12.065 5.085 -20.544 1.00 0.00 H new ATOM 0 HB3 ALA A 73 10.459 5.200 -21.303 1.00 0.00 H new ATOM 598 N GLY A 74 8.014 5.409 -19.224 1.00 0.00 N ATOM 599 CA GLY A 74 6.675 6.065 -19.192 1.00 0.00 C ATOM 600 C GLY A 74 5.651 5.151 -18.538 1.00 0.00 C ATOM 601 O GLY A 74 4.460 5.269 -18.749 1.00 0.00 O ATOM 0 H GLY A 74 8.002 4.394 -19.328 1.00 0.00 H new ATOM 0 HA2 GLY A 74 6.737 7.004 -18.642 1.00 0.00 H new ATOM 0 HA3 GLY A 74 6.358 6.309 -20.206 1.00 0.00 H new ATOM 605 N PHE A 75 6.113 4.247 -17.744 1.00 0.00 N ATOM 606 CA PHE A 75 5.191 3.308 -17.049 1.00 0.00 C ATOM 607 C PHE A 75 5.897 2.681 -15.845 1.00 0.00 C ATOM 608 O PHE A 75 6.785 1.863 -15.984 1.00 0.00 O ATOM 609 CB PHE A 75 4.851 2.241 -18.090 1.00 0.00 C ATOM 610 CG PHE A 75 3.680 2.700 -18.924 1.00 0.00 C ATOM 611 CD1 PHE A 75 2.528 3.199 -18.303 1.00 0.00 C ATOM 612 CD2 PHE A 75 3.745 2.626 -20.321 1.00 0.00 C ATOM 613 CE1 PHE A 75 1.443 3.624 -19.078 1.00 0.00 C ATOM 614 CE2 PHE A 75 2.660 3.052 -21.097 1.00 0.00 C ATOM 615 CZ PHE A 75 1.509 3.550 -20.474 1.00 0.00 C ATOM 0 H PHE A 75 7.102 4.109 -17.538 1.00 0.00 H new ATOM 0 HA PHE A 75 4.297 3.805 -16.673 1.00 0.00 H new ATOM 0 HB2 PHE A 75 5.714 2.054 -18.729 1.00 0.00 H new ATOM 0 HB3 PHE A 75 4.611 1.300 -17.595 1.00 0.00 H new ATOM 0 HD1 PHE A 75 2.477 3.256 -17.226 1.00 0.00 H new ATOM 0 HD2 PHE A 75 4.633 2.240 -20.800 1.00 0.00 H new ATOM 0 HE1 PHE A 75 0.555 4.009 -18.599 1.00 0.00 H new ATOM 0 HE2 PHE A 75 2.711 2.997 -22.174 1.00 0.00 H new ATOM 0 HZ PHE A 75 0.671 3.877 -21.072 1.00 0.00 H new ATOM 625 N TRP A 76 5.504 3.065 -14.669 1.00 0.00 N ATOM 626 CA TRP A 76 6.132 2.511 -13.438 1.00 0.00 C ATOM 627 C TRP A 76 5.371 1.255 -13.000 1.00 0.00 C ATOM 628 O TRP A 76 4.550 1.291 -12.105 1.00 0.00 O ATOM 629 CB TRP A 76 5.979 3.649 -12.432 1.00 0.00 C ATOM 630 CG TRP A 76 6.264 3.179 -11.065 1.00 0.00 C ATOM 631 CD1 TRP A 76 7.257 2.346 -10.725 1.00 0.00 C ATOM 632 CD2 TRP A 76 5.601 3.561 -9.834 1.00 0.00 C ATOM 633 NE1 TRP A 76 7.228 2.156 -9.370 1.00 0.00 N ATOM 634 CE2 TRP A 76 6.215 2.878 -8.768 1.00 0.00 C ATOM 635 CE3 TRP A 76 4.528 4.412 -9.552 1.00 0.00 C ATOM 636 CZ2 TRP A 76 5.778 3.037 -7.453 1.00 0.00 C ATOM 637 CZ3 TRP A 76 4.082 4.582 -8.235 1.00 0.00 C ATOM 638 CH2 TRP A 76 4.704 3.891 -7.184 1.00 0.00 C ATOM 0 H TRP A 76 4.765 3.748 -14.503 1.00 0.00 H new ATOM 0 HA TRP A 76 7.172 2.207 -13.558 1.00 0.00 H new ATOM 0 HB2 TRP A 76 6.657 4.463 -12.691 1.00 0.00 H new ATOM 0 HB3 TRP A 76 4.966 4.050 -12.480 1.00 0.00 H new ATOM 0 HD1 TRP A 76 7.964 1.898 -11.408 1.00 0.00 H new ATOM 0 HE1 TRP A 76 7.877 1.553 -8.864 1.00 0.00 H new ATOM 0 HE3 TRP A 76 4.039 4.942 -10.356 1.00 0.00 H new ATOM 0 HZ2 TRP A 76 6.265 2.505 -6.649 1.00 0.00 H new ATOM 0 HZ3 TRP A 76 3.257 5.247 -8.028 1.00 0.00 H new ATOM 0 HH2 TRP A 76 4.354 4.018 -6.170 1.00 0.00 H new ATOM 649 N TRP A 77 5.614 0.150 -13.663 1.00 0.00 N ATOM 650 CA TRP A 77 4.879 -1.111 -13.331 1.00 0.00 C ATOM 651 C TRP A 77 5.731 -2.086 -12.513 1.00 0.00 C ATOM 652 O TRP A 77 6.866 -2.350 -12.835 1.00 0.00 O ATOM 653 CB TRP A 77 4.566 -1.735 -14.694 1.00 0.00 C ATOM 654 CG TRP A 77 3.447 -0.990 -15.344 1.00 0.00 C ATOM 655 CD1 TRP A 77 3.254 0.345 -15.262 1.00 0.00 C ATOM 656 CD2 TRP A 77 2.368 -1.509 -16.175 1.00 0.00 C ATOM 657 NE1 TRP A 77 2.121 0.677 -15.975 1.00 0.00 N ATOM 658 CE2 TRP A 77 1.541 -0.429 -16.559 1.00 0.00 C ATOM 659 CE3 TRP A 77 2.027 -2.798 -16.625 1.00 0.00 C ATOM 660 CZ2 TRP A 77 0.414 -0.618 -17.360 1.00 0.00 C ATOM 661 CZ3 TRP A 77 0.893 -2.993 -17.432 1.00 0.00 C ATOM 662 CH2 TRP A 77 0.088 -1.903 -17.798 1.00 0.00 C ATOM 0 H TRP A 77 6.291 0.067 -14.421 1.00 0.00 H new ATOM 0 HA TRP A 77 3.997 -0.900 -12.726 1.00 0.00 H new ATOM 0 HB2 TRP A 77 5.451 -1.707 -15.329 1.00 0.00 H new ATOM 0 HB3 TRP A 77 4.295 -2.783 -14.571 1.00 0.00 H new ATOM 0 HD1 TRP A 77 3.884 1.039 -14.726 1.00 0.00 H new ATOM 0 HE1 TRP A 77 1.756 1.626 -16.060 1.00 0.00 H new ATOM 0 HE3 TRP A 77 2.641 -3.643 -16.348 1.00 0.00 H new ATOM 0 HZ2 TRP A 77 -0.202 0.224 -17.639 1.00 0.00 H new ATOM 0 HZ3 TRP A 77 0.640 -3.986 -17.772 1.00 0.00 H new ATOM 0 HH2 TRP A 77 -0.783 -2.058 -18.418 1.00 0.00 H new ATOM 673 N ILE A 78 5.167 -2.652 -11.477 1.00 0.00 N ATOM 674 CA ILE A 78 5.912 -3.647 -10.657 1.00 0.00 C ATOM 675 C ILE A 78 4.960 -4.796 -10.304 1.00 0.00 C ATOM 676 O ILE A 78 3.765 -4.611 -10.232 1.00 0.00 O ATOM 677 CB ILE A 78 6.353 -2.886 -9.405 1.00 0.00 C ATOM 678 CG1 ILE A 78 7.630 -2.106 -9.718 1.00 0.00 C ATOM 679 CG2 ILE A 78 6.628 -3.871 -8.266 1.00 0.00 C ATOM 680 CD1 ILE A 78 7.380 -0.613 -9.518 1.00 0.00 C ATOM 0 H ILE A 78 4.215 -2.464 -11.164 1.00 0.00 H new ATOM 0 HA ILE A 78 6.772 -4.077 -11.171 1.00 0.00 H new ATOM 0 HB ILE A 78 5.562 -2.200 -9.102 1.00 0.00 H new ATOM 0 HG12 ILE A 78 8.440 -2.439 -9.069 1.00 0.00 H new ATOM 0 HG13 ILE A 78 7.943 -2.298 -10.744 1.00 0.00 H new ATOM 0 HG21 ILE A 78 6.941 -3.322 -7.378 1.00 0.00 H new ATOM 0 HG22 ILE A 78 5.721 -4.433 -8.044 1.00 0.00 H new ATOM 0 HG23 ILE A 78 7.418 -4.560 -8.564 1.00 0.00 H new ATOM 0 HD11 ILE A 78 8.291 -0.058 -9.742 1.00 0.00 H new ATOM 0 HD12 ILE A 78 6.583 -0.285 -10.185 1.00 0.00 H new ATOM 0 HD13 ILE A 78 7.087 -0.428 -8.484 1.00 0.00 H new ATOM 692 N LYS A 79 5.467 -5.978 -10.092 1.00 0.00 N ATOM 693 CA LYS A 79 4.564 -7.115 -9.753 1.00 0.00 C ATOM 694 C LYS A 79 5.051 -7.810 -8.477 1.00 0.00 C ATOM 695 O LYS A 79 6.223 -7.790 -8.157 1.00 0.00 O ATOM 696 CB LYS A 79 4.614 -8.040 -10.984 1.00 0.00 C ATOM 697 CG LYS A 79 5.334 -9.349 -10.650 1.00 0.00 C ATOM 698 CD LYS A 79 5.332 -10.266 -11.875 1.00 0.00 C ATOM 699 CE LYS A 79 6.298 -11.429 -11.640 1.00 0.00 C ATOM 700 NZ LYS A 79 5.569 -12.637 -12.118 1.00 0.00 N ATOM 0 H LYS A 79 6.460 -6.206 -10.138 1.00 0.00 H new ATOM 0 HA LYS A 79 3.540 -6.803 -9.546 1.00 0.00 H new ATOM 0 HB2 LYS A 79 3.601 -8.253 -11.326 1.00 0.00 H new ATOM 0 HB3 LYS A 79 5.127 -7.536 -11.803 1.00 0.00 H new ATOM 0 HG2 LYS A 79 6.358 -9.143 -10.340 1.00 0.00 H new ATOM 0 HG3 LYS A 79 4.841 -9.843 -9.813 1.00 0.00 H new ATOM 0 HD2 LYS A 79 4.327 -10.645 -12.058 1.00 0.00 H new ATOM 0 HD3 LYS A 79 5.628 -9.707 -12.762 1.00 0.00 H new ATOM 0 HE2 LYS A 79 7.229 -11.286 -12.189 1.00 0.00 H new ATOM 0 HE3 LYS A 79 6.560 -11.518 -10.586 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 6.168 -13.477 -11.989 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 4.691 -12.751 -11.573 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 5.339 -12.527 -13.126 1.00 0.00 H new ATOM 714 N ALA A 80 4.159 -8.423 -7.747 1.00 0.00 N ATOM 715 CA ALA A 80 4.577 -9.110 -6.494 1.00 0.00 C ATOM 716 C ALA A 80 3.844 -10.448 -6.342 1.00 0.00 C ATOM 717 O ALA A 80 3.027 -10.814 -7.162 1.00 0.00 O ATOM 718 CB ALA A 80 4.176 -8.153 -5.372 1.00 0.00 C ATOM 0 H ALA A 80 3.164 -8.477 -7.963 1.00 0.00 H new ATOM 0 HA ALA A 80 5.644 -9.334 -6.485 1.00 0.00 H new ATOM 0 HB1 ALA A 80 4.450 -8.585 -4.410 1.00 0.00 H new ATOM 0 HB2 ALA A 80 4.693 -7.202 -5.503 1.00 0.00 H new ATOM 0 HB3 ALA A 80 3.099 -7.988 -5.402 1.00 0.00 H new ATOM 724 N ASP A 81 4.129 -11.175 -5.295 1.00 0.00 N ATOM 725 CA ASP A 81 3.447 -12.486 -5.089 1.00 0.00 C ATOM 726 C ASP A 81 2.728 -12.499 -3.740 1.00 0.00 C ATOM 727 O ASP A 81 2.875 -13.410 -2.949 1.00 0.00 O ATOM 728 CB ASP A 81 4.566 -13.526 -5.120 1.00 0.00 C ATOM 729 CG ASP A 81 4.827 -13.948 -6.566 1.00 0.00 C ATOM 730 OD1 ASP A 81 4.008 -13.628 -7.412 1.00 0.00 O ATOM 731 OD2 ASP A 81 5.840 -14.584 -6.804 1.00 0.00 O ATOM 0 H ASP A 81 4.804 -10.918 -4.574 1.00 0.00 H new ATOM 0 HA ASP A 81 2.692 -12.685 -5.849 1.00 0.00 H new ATOM 0 HB2 ASP A 81 5.474 -13.113 -4.681 1.00 0.00 H new ATOM 0 HB3 ASP A 81 4.288 -14.393 -4.521 1.00 0.00 H new ATOM 736 N GLY A 82 1.945 -11.493 -3.480 1.00 0.00 N ATOM 737 CA GLY A 82 1.206 -11.424 -2.204 1.00 0.00 C ATOM 738 C GLY A 82 0.199 -10.275 -2.268 1.00 0.00 C ATOM 739 O GLY A 82 -0.600 -10.188 -3.179 1.00 0.00 O ATOM 0 H GLY A 82 1.787 -10.707 -4.110 1.00 0.00 H new ATOM 0 HA2 GLY A 82 0.690 -12.366 -2.017 1.00 0.00 H new ATOM 0 HA3 GLY A 82 1.899 -11.271 -1.377 1.00 0.00 H new ATOM 743 N ALA A 83 0.232 -9.388 -1.314 1.00 0.00 N ATOM 744 CA ALA A 83 -0.719 -8.242 -1.330 1.00 0.00 C ATOM 745 C ALA A 83 -0.021 -6.993 -1.870 1.00 0.00 C ATOM 746 O ALA A 83 1.147 -6.769 -1.625 1.00 0.00 O ATOM 747 CB ALA A 83 -1.127 -8.042 0.128 1.00 0.00 C ATOM 0 H ALA A 83 0.876 -9.407 -0.524 1.00 0.00 H new ATOM 0 HA ALA A 83 -1.582 -8.428 -1.969 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -1.830 -7.212 0.199 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -1.600 -8.950 0.501 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -0.243 -7.821 0.726 1.00 0.00 H new ATOM 753 N ILE A 84 -0.724 -6.178 -2.606 1.00 0.00 N ATOM 754 CA ILE A 84 -0.089 -4.949 -3.158 1.00 0.00 C ATOM 755 C ILE A 84 -0.907 -3.716 -2.767 1.00 0.00 C ATOM 756 O ILE A 84 -2.053 -3.821 -2.380 1.00 0.00 O ATOM 757 CB ILE A 84 -0.095 -5.154 -4.672 1.00 0.00 C ATOM 758 CG1 ILE A 84 0.622 -3.990 -5.345 1.00 0.00 C ATOM 759 CG2 ILE A 84 -1.536 -5.228 -5.178 1.00 0.00 C ATOM 760 CD1 ILE A 84 2.129 -4.210 -5.239 1.00 0.00 C ATOM 0 H ILE A 84 -1.706 -6.309 -2.848 1.00 0.00 H new ATOM 0 HA ILE A 84 0.919 -4.788 -2.777 1.00 0.00 H new ATOM 0 HB ILE A 84 0.418 -6.085 -4.911 1.00 0.00 H new ATOM 0 HG12 ILE A 84 0.324 -3.918 -6.391 1.00 0.00 H new ATOM 0 HG13 ILE A 84 0.344 -3.050 -4.869 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -1.535 -5.374 -6.258 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -2.047 -6.063 -4.699 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -2.054 -4.300 -4.938 1.00 0.00 H new ATOM 0 HD11 ILE A 84 2.652 -3.382 -5.718 1.00 0.00 H new ATOM 0 HD12 ILE A 84 2.416 -4.262 -4.189 1.00 0.00 H new ATOM 0 HD13 ILE A 84 2.396 -5.143 -5.735 1.00 0.00 H new ATOM 772 N GLU A 85 -0.325 -2.547 -2.849 1.00 0.00 N ATOM 773 CA GLU A 85 -1.069 -1.333 -2.470 1.00 0.00 C ATOM 774 C GLU A 85 -0.979 -0.252 -3.552 1.00 0.00 C ATOM 775 O GLU A 85 -0.164 -0.312 -4.452 1.00 0.00 O ATOM 776 CB GLU A 85 -0.419 -0.855 -1.172 1.00 0.00 C ATOM 777 CG GLU A 85 -1.476 -0.793 -0.070 1.00 0.00 C ATOM 778 CD GLU A 85 -1.895 0.660 0.156 1.00 0.00 C ATOM 779 OE1 GLU A 85 -1.335 1.526 -0.494 1.00 0.00 O ATOM 780 OE2 GLU A 85 -2.771 0.882 0.977 1.00 0.00 O ATOM 0 H GLU A 85 0.633 -2.392 -3.163 1.00 0.00 H new ATOM 0 HA GLU A 85 -2.132 -1.542 -2.347 1.00 0.00 H new ATOM 0 HB2 GLU A 85 0.384 -1.533 -0.883 1.00 0.00 H new ATOM 0 HB3 GLU A 85 0.030 0.128 -1.317 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -2.342 -1.393 -0.349 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -1.079 -1.216 0.853 1.00 0.00 H new ATOM 787 N ILE A 86 -1.835 0.730 -3.463 1.00 0.00 N ATOM 788 CA ILE A 86 -1.862 1.819 -4.443 1.00 0.00 C ATOM 789 C ILE A 86 -2.106 3.149 -3.713 1.00 0.00 C ATOM 790 O ILE A 86 -2.344 3.171 -2.520 1.00 0.00 O ATOM 791 CB ILE A 86 -3.027 1.444 -5.325 1.00 0.00 C ATOM 792 CG1 ILE A 86 -2.507 0.556 -6.447 1.00 0.00 C ATOM 793 CG2 ILE A 86 -3.702 2.711 -5.879 1.00 0.00 C ATOM 794 CD1 ILE A 86 -2.523 1.344 -7.728 1.00 0.00 C ATOM 0 H ILE A 86 -2.532 0.812 -2.723 1.00 0.00 H new ATOM 0 HA ILE A 86 -0.939 1.947 -5.009 1.00 0.00 H new ATOM 0 HB ILE A 86 -3.779 0.900 -4.754 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -1.495 0.217 -6.224 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -3.128 -0.335 -6.543 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -4.541 2.428 -6.514 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -4.063 3.322 -5.052 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -2.981 3.281 -6.464 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -2.153 0.722 -8.543 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -3.543 1.661 -7.948 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -1.885 2.222 -7.623 1.00 0.00 H new ATOM 806 N ASP A 87 -2.065 4.253 -4.408 1.00 0.00 N ATOM 807 CA ASP A 87 -2.311 5.557 -3.722 1.00 0.00 C ATOM 808 C ASP A 87 -2.947 6.565 -4.664 1.00 0.00 C ATOM 809 O ASP A 87 -3.061 6.346 -5.854 1.00 0.00 O ATOM 810 CB ASP A 87 -0.940 6.078 -3.330 1.00 0.00 C ATOM 811 CG ASP A 87 -0.353 5.213 -2.215 1.00 0.00 C ATOM 812 OD1 ASP A 87 -1.113 4.784 -1.362 1.00 0.00 O ATOM 813 OD2 ASP A 87 0.847 4.994 -2.231 1.00 0.00 O ATOM 0 H ASP A 87 -1.875 4.311 -5.408 1.00 0.00 H new ATOM 0 HA ASP A 87 -2.982 5.419 -2.874 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -0.277 6.070 -4.195 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -1.016 7.113 -2.997 1.00 0.00 H new ATOM 818 N ALA A 88 -3.327 7.691 -4.136 1.00 0.00 N ATOM 819 CA ALA A 88 -3.915 8.746 -4.994 1.00 0.00 C ATOM 820 C ALA A 88 -3.621 10.122 -4.396 1.00 0.00 C ATOM 821 O ALA A 88 -3.173 11.029 -5.063 1.00 0.00 O ATOM 822 CB ALA A 88 -5.421 8.489 -5.004 1.00 0.00 C ATOM 0 H ALA A 88 -3.255 7.925 -3.146 1.00 0.00 H new ATOM 0 HA ALA A 88 -3.500 8.725 -6.002 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -5.914 9.238 -5.623 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -5.618 7.497 -5.409 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -5.807 8.549 -3.986 1.00 0.00 H new ATOM 828 N ALA A 89 -3.874 10.274 -3.137 1.00 0.00 N ATOM 829 CA ALA A 89 -3.621 11.577 -2.470 1.00 0.00 C ATOM 830 C ALA A 89 -2.299 12.179 -2.947 1.00 0.00 C ATOM 831 O ALA A 89 -2.219 13.347 -3.271 1.00 0.00 O ATOM 832 CB ALA A 89 -3.565 11.224 -0.998 1.00 0.00 C ATOM 0 H ALA A 89 -4.250 9.545 -2.530 1.00 0.00 H new ATOM 0 HA ALA A 89 -4.384 12.324 -2.690 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -3.381 12.126 -0.414 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -4.514 10.782 -0.693 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -2.760 10.509 -0.826 1.00 0.00 H new ATOM 838 N GLU A 90 -1.266 11.390 -3.012 1.00 0.00 N ATOM 839 CA GLU A 90 0.042 11.927 -3.493 1.00 0.00 C ATOM 840 C GLU A 90 -0.194 12.674 -4.805 1.00 0.00 C ATOM 841 O GLU A 90 0.371 13.722 -5.065 1.00 0.00 O ATOM 842 CB GLU A 90 0.918 10.691 -3.719 1.00 0.00 C ATOM 843 CG GLU A 90 2.300 11.123 -4.211 1.00 0.00 C ATOM 844 CD GLU A 90 3.380 10.446 -3.364 1.00 0.00 C ATOM 845 OE1 GLU A 90 3.517 10.816 -2.210 1.00 0.00 O ATOM 846 OE2 GLU A 90 4.051 9.569 -3.883 1.00 0.00 O ATOM 0 H GLU A 90 -1.266 10.403 -2.756 1.00 0.00 H new ATOM 0 HA GLU A 90 0.510 12.620 -2.794 1.00 0.00 H new ATOM 0 HB2 GLU A 90 1.012 10.125 -2.792 1.00 0.00 H new ATOM 0 HB3 GLU A 90 0.451 10.031 -4.450 1.00 0.00 H new ATOM 0 HG2 GLU A 90 2.424 10.854 -5.260 1.00 0.00 H new ATOM 0 HG3 GLU A 90 2.398 12.207 -4.146 1.00 0.00 H new ATOM 853 N ALA A 91 -1.053 12.149 -5.622 1.00 0.00 N ATOM 854 CA ALA A 91 -1.372 12.818 -6.908 1.00 0.00 C ATOM 855 C ALA A 91 -2.015 14.172 -6.623 1.00 0.00 C ATOM 856 O ALA A 91 -1.708 15.163 -7.249 1.00 0.00 O ATOM 857 CB ALA A 91 -2.372 11.873 -7.581 1.00 0.00 C ATOM 0 H ALA A 91 -1.554 11.276 -5.454 1.00 0.00 H new ATOM 0 HA ALA A 91 -0.498 13.001 -7.532 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -2.669 12.285 -8.546 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -1.908 10.898 -7.730 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -3.252 11.763 -6.947 1.00 0.00 H new ATOM 863 N GLY A 92 -2.903 14.219 -5.675 1.00 0.00 N ATOM 864 CA GLY A 92 -3.580 15.506 -5.345 1.00 0.00 C ATOM 865 C GLY A 92 -2.548 16.503 -4.849 1.00 0.00 C ATOM 866 O GLY A 92 -2.290 17.508 -5.475 1.00 0.00 O ATOM 0 H GLY A 92 -3.193 13.420 -5.110 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -4.088 15.899 -6.225 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -4.342 15.344 -4.583 1.00 0.00 H new ATOM 870 N GLU A 93 -1.954 16.223 -3.726 1.00 0.00 N ATOM 871 CA GLU A 93 -0.920 17.147 -3.170 1.00 0.00 C ATOM 872 C GLU A 93 -0.083 17.704 -4.320 1.00 0.00 C ATOM 873 O GLU A 93 0.366 18.832 -4.288 1.00 0.00 O ATOM 874 CB GLU A 93 -0.073 16.296 -2.221 1.00 0.00 C ATOM 875 CG GLU A 93 0.570 15.141 -2.987 1.00 0.00 C ATOM 876 CD GLU A 93 1.800 14.645 -2.224 1.00 0.00 C ATOM 877 OE1 GLU A 93 1.620 13.962 -1.229 1.00 0.00 O ATOM 878 OE2 GLU A 93 2.900 14.957 -2.648 1.00 0.00 O ATOM 0 H GLU A 93 -2.138 15.392 -3.164 1.00 0.00 H new ATOM 0 HA GLU A 93 -1.350 17.997 -2.640 1.00 0.00 H new ATOM 0 HB2 GLU A 93 0.699 16.911 -1.759 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -0.695 15.907 -1.415 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -0.146 14.329 -3.110 1.00 0.00 H new ATOM 0 HG3 GLU A 93 0.856 15.468 -3.987 1.00 0.00 H new ATOM 885 N LEU A 94 0.090 16.929 -5.357 1.00 0.00 N ATOM 886 CA LEU A 94 0.850 17.429 -6.531 1.00 0.00 C ATOM 887 C LEU A 94 -0.027 18.434 -7.281 1.00 0.00 C ATOM 888 O LEU A 94 0.210 19.625 -7.243 1.00 0.00 O ATOM 889 CB LEU A 94 1.128 16.199 -7.394 1.00 0.00 C ATOM 890 CG LEU A 94 2.219 16.485 -8.448 1.00 0.00 C ATOM 891 CD1 LEU A 94 1.685 16.105 -9.828 1.00 0.00 C ATOM 892 CD2 LEU A 94 2.624 17.970 -8.469 1.00 0.00 C ATOM 0 H LEU A 94 -0.262 15.975 -5.439 1.00 0.00 H new ATOM 0 HA LEU A 94 1.780 17.928 -6.259 1.00 0.00 H new ATOM 0 HB2 LEU A 94 1.442 15.371 -6.759 1.00 0.00 H new ATOM 0 HB3 LEU A 94 0.210 15.888 -7.893 1.00 0.00 H new ATOM 0 HG LEU A 94 3.099 15.896 -8.188 1.00 0.00 H new ATOM 0 HD11 LEU A 94 2.448 16.303 -10.581 1.00 0.00 H new ATOM 0 HD12 LEU A 94 1.430 15.045 -9.840 1.00 0.00 H new ATOM 0 HD13 LEU A 94 0.796 16.695 -10.049 1.00 0.00 H new ATOM 0 HD21 LEU A 94 3.394 18.127 -9.225 1.00 0.00 H new ATOM 0 HD22 LEU A 94 1.753 18.581 -8.706 1.00 0.00 H new ATOM 0 HD23 LEU A 94 3.012 18.255 -7.491 1.00 0.00 H new ATOM 904 N LEU A 95 -1.062 17.972 -7.943 1.00 0.00 N ATOM 905 CA LEU A 95 -1.958 18.932 -8.661 1.00 0.00 C ATOM 906 C LEU A 95 -3.022 19.432 -7.691 1.00 0.00 C ATOM 907 O LEU A 95 -3.188 20.616 -7.475 1.00 0.00 O ATOM 908 CB LEU A 95 -2.634 18.159 -9.799 1.00 0.00 C ATOM 909 CG LEU A 95 -1.774 16.981 -10.243 1.00 0.00 C ATOM 910 CD1 LEU A 95 -2.339 15.702 -9.629 1.00 0.00 C ATOM 911 CD2 LEU A 95 -1.812 16.889 -11.765 1.00 0.00 C ATOM 0 H LEU A 95 -1.322 16.988 -8.017 1.00 0.00 H new ATOM 0 HA LEU A 95 -1.396 19.782 -9.049 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -3.609 17.799 -9.470 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -2.808 18.826 -10.643 1.00 0.00 H new ATOM 0 HG LEU A 95 -0.743 17.116 -9.916 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -1.733 14.851 -9.939 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -2.323 15.782 -8.542 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -3.365 15.559 -9.967 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -1.200 16.049 -12.094 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -2.840 16.740 -12.095 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -1.423 17.812 -12.195 1.00 0.00 H new ATOM 923 N GLY A 96 -3.734 18.520 -7.096 1.00 0.00 N ATOM 924 CA GLY A 96 -4.794 18.902 -6.116 1.00 0.00 C ATOM 925 C GLY A 96 -6.120 19.138 -6.843 1.00 0.00 C ATOM 926 O GLY A 96 -6.767 20.150 -6.656 1.00 0.00 O ATOM 0 H GLY A 96 -3.629 17.517 -7.246 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -4.913 18.115 -5.372 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -4.498 19.804 -5.581 1.00 0.00 H new ATOM 930 N LYS A 97 -6.529 18.215 -7.671 1.00 0.00 N ATOM 931 CA LYS A 97 -7.826 18.399 -8.412 1.00 0.00 C ATOM 932 C LYS A 97 -8.487 17.009 -8.725 1.00 0.00 C ATOM 933 O LYS A 97 -8.921 16.361 -7.792 1.00 0.00 O ATOM 934 CB LYS A 97 -7.440 19.225 -9.647 1.00 0.00 C ATOM 935 CG LYS A 97 -6.774 20.536 -9.227 1.00 0.00 C ATOM 936 CD LYS A 97 -6.574 21.408 -10.468 1.00 0.00 C ATOM 937 CE LYS A 97 -7.172 22.795 -10.229 1.00 0.00 C ATOM 938 NZ LYS A 97 -7.339 23.380 -11.589 1.00 0.00 N ATOM 0 H LYS A 97 -6.032 17.347 -7.870 1.00 0.00 H new ATOM 0 HA LYS A 97 -8.596 18.921 -7.843 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -6.761 18.651 -10.278 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -8.328 19.436 -10.243 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -7.393 21.056 -8.496 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -5.816 20.336 -8.748 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -5.512 21.494 -10.695 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -7.048 20.942 -11.332 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -8.127 22.729 -9.707 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -6.514 23.408 -9.613 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -7.745 24.334 -11.509 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -6.413 23.436 -12.059 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -7.976 22.778 -12.150 1.00 0.00 H new ATOM 952 N PRO A 98 -8.558 16.547 -9.982 1.00 0.00 N ATOM 953 CA PRO A 98 -9.177 15.213 -10.245 1.00 0.00 C ATOM 954 C PRO A 98 -8.132 14.119 -10.068 1.00 0.00 C ATOM 955 O PRO A 98 -8.331 12.993 -10.468 1.00 0.00 O ATOM 956 CB PRO A 98 -9.572 15.279 -11.703 1.00 0.00 C ATOM 957 CG PRO A 98 -8.631 16.258 -12.322 1.00 0.00 C ATOM 958 CD PRO A 98 -8.115 17.165 -11.241 1.00 0.00 C ATOM 0 HA PRO A 98 -10.011 14.996 -9.577 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -9.490 14.301 -12.177 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -10.607 15.603 -11.816 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -7.805 15.737 -12.806 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -9.139 16.837 -13.093 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -7.029 17.247 -11.280 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -8.515 18.173 -11.348 1.00 0.00 H new ATOM 966 N PHE A 99 -7.025 14.469 -9.490 1.00 0.00 N ATOM 967 CA PHE A 99 -5.924 13.503 -9.256 1.00 0.00 C ATOM 968 C PHE A 99 -6.454 12.244 -8.596 1.00 0.00 C ATOM 969 O PHE A 99 -7.562 11.829 -8.812 1.00 0.00 O ATOM 970 CB PHE A 99 -5.008 14.228 -8.262 1.00 0.00 C ATOM 971 CG PHE A 99 -5.690 14.306 -6.893 1.00 0.00 C ATOM 972 CD1 PHE A 99 -6.672 15.270 -6.669 1.00 0.00 C ATOM 973 CD2 PHE A 99 -5.349 13.421 -5.852 1.00 0.00 C ATOM 974 CE1 PHE A 99 -7.311 15.357 -5.428 1.00 0.00 C ATOM 975 CE2 PHE A 99 -5.987 13.512 -4.610 1.00 0.00 C ATOM 976 CZ PHE A 99 -6.967 14.480 -4.398 1.00 0.00 C ATOM 0 H PHE A 99 -6.831 15.414 -9.160 1.00 0.00 H new ATOM 0 HA PHE A 99 -5.429 13.209 -10.182 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -4.058 13.700 -8.176 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -4.783 15.231 -8.625 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -6.941 15.955 -7.460 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -4.591 12.668 -6.013 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -8.073 16.105 -5.266 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -5.720 12.832 -3.815 1.00 0.00 H new ATOM 0 HZ PHE A 99 -7.459 14.551 -3.439 1.00 0.00 H new ATOM 986 N SER A 100 -5.642 11.680 -7.762 1.00 0.00 N ATOM 987 CA SER A 100 -6.011 10.467 -6.988 1.00 0.00 C ATOM 988 C SER A 100 -6.952 9.570 -7.780 1.00 0.00 C ATOM 989 O SER A 100 -6.575 8.557 -8.321 1.00 0.00 O ATOM 990 CB SER A 100 -6.752 11.001 -5.766 1.00 0.00 C ATOM 991 OG SER A 100 -7.521 12.137 -6.138 1.00 0.00 O ATOM 0 H SER A 100 -4.699 12.021 -7.575 1.00 0.00 H new ATOM 0 HA SER A 100 -5.131 9.873 -6.741 1.00 0.00 H new ATOM 0 HB2 SER A 100 -7.401 10.228 -5.354 1.00 0.00 H new ATOM 0 HB3 SER A 100 -6.041 11.270 -4.985 1.00 0.00 H new ATOM 0 HG SER A 100 -7.028 12.954 -5.913 1.00 0.00 H new ATOM 997 N VAL A 101 -8.188 9.958 -7.822 1.00 0.00 N ATOM 998 CA VAL A 101 -9.221 9.192 -8.545 1.00 0.00 C ATOM 999 C VAL A 101 -8.990 9.175 -10.051 1.00 0.00 C ATOM 1000 O VAL A 101 -8.741 8.146 -10.640 1.00 0.00 O ATOM 1001 CB VAL A 101 -10.468 9.924 -8.223 1.00 0.00 C ATOM 1002 CG1 VAL A 101 -11.643 9.151 -8.802 1.00 0.00 C ATOM 1003 CG2 VAL A 101 -10.584 10.043 -6.701 1.00 0.00 C ATOM 0 H VAL A 101 -8.533 10.804 -7.368 1.00 0.00 H new ATOM 0 HA VAL A 101 -9.231 8.143 -8.251 1.00 0.00 H new ATOM 0 HB VAL A 101 -10.461 10.926 -8.652 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -12.571 9.675 -8.575 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -11.528 9.069 -9.883 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -11.673 8.153 -8.364 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -11.498 10.580 -6.447 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -10.614 9.047 -6.259 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -9.723 10.587 -6.312 1.00 0.00 H new ATOM 1013 N TYR A 102 -9.059 10.292 -10.701 1.00 0.00 N ATOM 1014 CA TYR A 102 -8.817 10.250 -12.161 1.00 0.00 C ATOM 1015 C TYR A 102 -7.410 9.707 -12.355 1.00 0.00 C ATOM 1016 O TYR A 102 -7.138 8.885 -13.221 1.00 0.00 O ATOM 1017 CB TYR A 102 -8.928 11.696 -12.646 1.00 0.00 C ATOM 1018 CG TYR A 102 -9.123 11.706 -14.144 1.00 0.00 C ATOM 1019 CD1 TYR A 102 -10.240 11.078 -14.707 1.00 0.00 C ATOM 1020 CD2 TYR A 102 -8.187 12.340 -14.969 1.00 0.00 C ATOM 1021 CE1 TYR A 102 -10.420 11.084 -16.096 1.00 0.00 C ATOM 1022 CE2 TYR A 102 -8.366 12.346 -16.357 1.00 0.00 C ATOM 1023 CZ TYR A 102 -9.483 11.720 -16.921 1.00 0.00 C ATOM 1024 OH TYR A 102 -9.659 11.727 -18.289 1.00 0.00 O ATOM 0 H TYR A 102 -9.266 11.208 -10.302 1.00 0.00 H new ATOM 0 HA TYR A 102 -9.518 9.623 -12.712 1.00 0.00 H new ATOM 0 HB2 TYR A 102 -9.765 12.193 -12.155 1.00 0.00 H new ATOM 0 HB3 TYR A 102 -8.028 12.251 -12.381 1.00 0.00 H new ATOM 0 HD1 TYR A 102 -10.963 10.589 -14.071 1.00 0.00 H new ATOM 0 HD2 TYR A 102 -7.326 12.825 -14.534 1.00 0.00 H new ATOM 0 HE1 TYR A 102 -11.281 10.598 -16.531 1.00 0.00 H new ATOM 0 HE2 TYR A 102 -7.642 12.834 -16.993 1.00 0.00 H new ATOM 0 HH TYR A 102 -8.919 12.211 -18.712 1.00 0.00 H new ATOM 1034 N ASP A 103 -6.521 10.140 -11.506 1.00 0.00 N ATOM 1035 CA ASP A 103 -5.123 9.661 -11.582 1.00 0.00 C ATOM 1036 C ASP A 103 -5.075 8.161 -11.318 1.00 0.00 C ATOM 1037 O ASP A 103 -4.337 7.445 -11.963 1.00 0.00 O ATOM 1038 CB ASP A 103 -4.378 10.427 -10.490 1.00 0.00 C ATOM 1039 CG ASP A 103 -3.123 11.076 -11.079 1.00 0.00 C ATOM 1040 OD1 ASP A 103 -3.226 11.656 -12.148 1.00 0.00 O ATOM 1041 OD2 ASP A 103 -2.082 10.983 -10.451 1.00 0.00 O ATOM 0 H ASP A 103 -6.709 10.809 -10.760 1.00 0.00 H new ATOM 0 HA ASP A 103 -4.678 9.827 -12.563 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -5.027 11.191 -10.061 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -4.103 9.751 -9.681 1.00 0.00 H new ATOM 1046 N LEU A 104 -5.861 7.657 -10.397 1.00 0.00 N ATOM 1047 CA LEU A 104 -5.806 6.189 -10.160 1.00 0.00 C ATOM 1048 C LEU A 104 -6.700 5.485 -11.171 1.00 0.00 C ATOM 1049 O LEU A 104 -6.362 4.451 -11.692 1.00 0.00 O ATOM 1050 CB LEU A 104 -6.287 5.961 -8.721 1.00 0.00 C ATOM 1051 CG LEU A 104 -7.796 6.193 -8.619 1.00 0.00 C ATOM 1052 CD1 LEU A 104 -8.557 4.978 -9.159 1.00 0.00 C ATOM 1053 CD2 LEU A 104 -8.180 6.414 -7.158 1.00 0.00 C ATOM 0 H LEU A 104 -6.517 8.182 -9.818 1.00 0.00 H new ATOM 0 HA LEU A 104 -4.801 5.786 -10.283 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -6.047 4.945 -8.407 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -5.762 6.636 -8.044 1.00 0.00 H new ATOM 0 HG LEU A 104 -8.057 7.071 -9.209 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -9.629 5.156 -9.081 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -8.291 4.817 -10.204 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -8.292 4.095 -8.577 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -9.255 6.579 -7.085 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -7.908 5.535 -6.573 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -7.652 7.285 -6.771 1.00 0.00 H new ATOM 1065 N LEU A 105 -7.830 6.045 -11.477 1.00 0.00 N ATOM 1066 CA LEU A 105 -8.719 5.389 -12.470 1.00 0.00 C ATOM 1067 C LEU A 105 -7.914 5.029 -13.721 1.00 0.00 C ATOM 1068 O LEU A 105 -8.287 4.157 -14.481 1.00 0.00 O ATOM 1069 CB LEU A 105 -9.796 6.423 -12.792 1.00 0.00 C ATOM 1070 CG LEU A 105 -10.774 6.533 -11.618 1.00 0.00 C ATOM 1071 CD1 LEU A 105 -11.705 7.726 -11.840 1.00 0.00 C ATOM 1072 CD2 LEU A 105 -11.607 5.255 -11.524 1.00 0.00 C ATOM 0 H LEU A 105 -8.176 6.922 -11.087 1.00 0.00 H new ATOM 0 HA LEU A 105 -9.158 4.465 -12.094 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -9.337 7.392 -12.987 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -10.331 6.136 -13.697 1.00 0.00 H new ATOM 0 HG LEU A 105 -10.214 6.672 -10.694 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -12.401 7.805 -11.005 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -11.115 8.640 -11.908 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -12.263 7.585 -12.765 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -12.302 5.335 -10.688 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -12.166 5.116 -12.449 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -10.947 4.401 -11.367 1.00 0.00 H new ATOM 1084 N ILE A 106 -6.809 5.691 -13.938 1.00 0.00 N ATOM 1085 CA ILE A 106 -5.981 5.383 -15.134 1.00 0.00 C ATOM 1086 C ILE A 106 -4.695 4.652 -14.714 1.00 0.00 C ATOM 1087 O ILE A 106 -4.192 3.808 -15.429 1.00 0.00 O ATOM 1088 CB ILE A 106 -5.702 6.745 -15.766 1.00 0.00 C ATOM 1089 CG1 ILE A 106 -6.632 6.934 -16.968 1.00 0.00 C ATOM 1090 CG2 ILE A 106 -4.248 6.842 -16.233 1.00 0.00 C ATOM 1091 CD1 ILE A 106 -6.395 5.810 -17.978 1.00 0.00 C ATOM 0 H ILE A 106 -6.446 6.431 -13.337 1.00 0.00 H new ATOM 0 HA ILE A 106 -6.474 4.717 -15.842 1.00 0.00 H new ATOM 0 HB ILE A 106 -5.878 7.521 -15.021 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -7.672 6.930 -16.641 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -6.448 7.902 -17.435 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -4.074 7.821 -16.680 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -3.582 6.708 -15.380 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -4.051 6.066 -16.972 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -7.057 5.944 -18.834 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -5.358 5.835 -18.314 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -6.601 4.849 -17.507 1.00 0.00 H new ATOM 1103 N ASN A 107 -4.161 4.963 -13.563 1.00 0.00 N ATOM 1104 CA ASN A 107 -2.915 4.274 -13.115 1.00 0.00 C ATOM 1105 C ASN A 107 -3.264 3.117 -12.181 1.00 0.00 C ATOM 1106 O ASN A 107 -2.401 2.388 -11.734 1.00 0.00 O ATOM 1107 CB ASN A 107 -2.089 5.347 -12.381 1.00 0.00 C ATOM 1108 CG ASN A 107 -2.575 5.533 -10.931 1.00 0.00 C ATOM 1109 OD1 ASN A 107 -2.857 4.581 -10.231 1.00 0.00 O ATOM 1110 ND2 ASN A 107 -2.669 6.737 -10.441 1.00 0.00 N ATOM 0 H ASN A 107 -4.531 5.660 -12.917 1.00 0.00 H new ATOM 0 HA ASN A 107 -2.357 3.850 -13.950 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -1.037 5.062 -12.380 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -2.162 6.294 -12.916 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -2.977 6.873 -9.478 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -2.435 7.543 -11.020 1.00 0.00 H new ATOM 1117 N VAL A 108 -4.520 2.953 -11.865 1.00 0.00 N ATOM 1118 CA VAL A 108 -4.909 1.853 -10.940 1.00 0.00 C ATOM 1119 C VAL A 108 -5.051 0.533 -11.696 1.00 0.00 C ATOM 1120 O VAL A 108 -5.219 -0.511 -11.097 1.00 0.00 O ATOM 1121 CB VAL A 108 -6.255 2.268 -10.346 1.00 0.00 C ATOM 1122 CG1 VAL A 108 -7.347 2.144 -11.414 1.00 0.00 C ATOM 1123 CG2 VAL A 108 -6.593 1.350 -9.174 1.00 0.00 C ATOM 0 H VAL A 108 -5.289 3.530 -12.206 1.00 0.00 H new ATOM 0 HA VAL A 108 -4.154 1.698 -10.169 1.00 0.00 H new ATOM 0 HB VAL A 108 -6.197 3.301 -10.002 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -8.306 2.440 -10.990 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -7.107 2.793 -12.257 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -7.405 1.111 -11.757 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -7.552 1.643 -8.747 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -6.651 0.319 -9.524 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -5.817 1.432 -8.412 1.00 0.00 H new ATOM 1133 N SER A 109 -4.978 0.563 -13.001 1.00 0.00 N ATOM 1134 CA SER A 109 -5.101 -0.718 -13.776 1.00 0.00 C ATOM 1135 C SER A 109 -4.311 -1.829 -13.087 1.00 0.00 C ATOM 1136 O SER A 109 -4.583 -3.001 -13.257 1.00 0.00 O ATOM 1137 CB SER A 109 -4.513 -0.429 -15.159 1.00 0.00 C ATOM 1138 OG SER A 109 -4.883 -1.470 -16.054 1.00 0.00 O ATOM 0 H SER A 109 -4.841 1.404 -13.562 1.00 0.00 H new ATOM 0 HA SER A 109 -6.137 -1.049 -13.843 1.00 0.00 H new ATOM 0 HB2 SER A 109 -4.877 0.530 -15.528 1.00 0.00 H new ATOM 0 HB3 SER A 109 -3.427 -0.356 -15.097 1.00 0.00 H new ATOM 0 HG SER A 109 -4.509 -1.287 -16.941 1.00 0.00 H new ATOM 1144 N SER A 110 -3.345 -1.468 -12.298 1.00 0.00 N ATOM 1145 CA SER A 110 -2.534 -2.479 -11.574 1.00 0.00 C ATOM 1146 C SER A 110 -3.394 -3.459 -10.770 1.00 0.00 C ATOM 1147 O SER A 110 -2.875 -4.370 -10.160 1.00 0.00 O ATOM 1148 CB SER A 110 -1.719 -1.651 -10.598 1.00 0.00 C ATOM 1149 OG SER A 110 -2.583 -1.116 -9.605 1.00 0.00 O ATOM 0 H SER A 110 -3.078 -0.500 -12.121 1.00 0.00 H new ATOM 0 HA SER A 110 -1.950 -3.080 -12.271 1.00 0.00 H new ATOM 0 HB2 SER A 110 -0.949 -2.267 -10.134 1.00 0.00 H new ATOM 0 HB3 SER A 110 -1.207 -0.845 -11.125 1.00 0.00 H new ATOM 0 HG SER A 110 -3.473 -0.971 -9.989 1.00 0.00 H new ATOM 1155 N THR A 111 -4.685 -3.290 -10.712 1.00 0.00 N ATOM 1156 CA THR A 111 -5.473 -4.242 -9.884 1.00 0.00 C ATOM 1157 C THR A 111 -5.540 -5.617 -10.550 1.00 0.00 C ATOM 1158 O THR A 111 -4.903 -6.557 -10.118 1.00 0.00 O ATOM 1159 CB THR A 111 -6.870 -3.630 -9.778 1.00 0.00 C ATOM 1160 OG1 THR A 111 -7.377 -3.385 -11.083 1.00 0.00 O ATOM 1161 CG2 THR A 111 -6.798 -2.317 -9.001 1.00 0.00 C ATOM 0 H THR A 111 -5.215 -2.558 -11.186 1.00 0.00 H new ATOM 0 HA THR A 111 -5.019 -4.392 -8.905 1.00 0.00 H new ATOM 0 HB THR A 111 -7.531 -4.321 -9.254 1.00 0.00 H new ATOM 0 HG1 THR A 111 -8.273 -2.994 -11.018 1.00 0.00 H new ATOM 0 HG21 THR A 111 -7.795 -1.883 -8.927 1.00 0.00 H new ATOM 0 HG22 THR A 111 -6.410 -2.507 -8.000 1.00 0.00 H new ATOM 0 HG23 THR A 111 -6.138 -1.623 -9.520 1.00 0.00 H new ATOM 1169 N VAL A 112 -6.315 -5.740 -11.589 1.00 0.00 N ATOM 1170 CA VAL A 112 -6.440 -7.053 -12.290 1.00 0.00 C ATOM 1171 C VAL A 112 -7.014 -8.115 -11.346 1.00 0.00 C ATOM 1172 O VAL A 112 -7.005 -9.292 -11.647 1.00 0.00 O ATOM 1173 CB VAL A 112 -5.018 -7.424 -12.718 1.00 0.00 C ATOM 1174 CG1 VAL A 112 -5.048 -8.729 -13.514 1.00 0.00 C ATOM 1175 CG2 VAL A 112 -4.443 -6.305 -13.590 1.00 0.00 C ATOM 0 H VAL A 112 -6.872 -4.984 -11.988 1.00 0.00 H new ATOM 0 HA VAL A 112 -7.116 -6.993 -13.143 1.00 0.00 H new ATOM 0 HB VAL A 112 -4.393 -7.555 -11.834 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -4.035 -8.993 -13.819 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -5.459 -9.525 -12.893 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -5.671 -8.601 -14.399 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -3.430 -6.566 -13.896 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -5.067 -6.175 -14.474 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -4.421 -5.375 -13.021 1.00 0.00 H new ATOM 1185 N GLY A 113 -7.517 -7.714 -10.208 1.00 0.00 N ATOM 1186 CA GLY A 113 -8.089 -8.711 -9.259 1.00 0.00 C ATOM 1187 C GLY A 113 -9.009 -8.005 -8.259 1.00 0.00 C ATOM 1188 O GLY A 113 -10.210 -8.187 -8.269 1.00 0.00 O ATOM 0 H GLY A 113 -7.556 -6.743 -9.897 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -8.647 -9.470 -9.807 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -7.287 -9.225 -8.729 1.00 0.00 H new ATOM 1192 N ARG A 114 -8.450 -7.211 -7.385 1.00 0.00 N ATOM 1193 CA ARG A 114 -9.268 -6.508 -6.383 1.00 0.00 C ATOM 1194 C ARG A 114 -8.814 -5.048 -6.247 1.00 0.00 C ATOM 1195 O ARG A 114 -7.756 -4.675 -6.709 1.00 0.00 O ATOM 1196 CB ARG A 114 -9.012 -7.278 -5.100 1.00 0.00 C ATOM 1197 CG ARG A 114 -10.103 -6.973 -4.071 1.00 0.00 C ATOM 1198 CD ARG A 114 -11.402 -7.660 -4.491 1.00 0.00 C ATOM 1199 NE ARG A 114 -12.380 -6.550 -4.674 1.00 0.00 N ATOM 1200 CZ ARG A 114 -13.380 -6.418 -3.845 1.00 0.00 C ATOM 1201 NH1 ARG A 114 -13.215 -5.773 -2.721 1.00 0.00 N ATOM 1202 NH2 ARG A 114 -14.544 -6.927 -4.139 1.00 0.00 N ATOM 0 H ARG A 114 -7.449 -7.024 -7.331 1.00 0.00 H new ATOM 0 HA ARG A 114 -10.325 -6.473 -6.645 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -8.988 -8.348 -5.308 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -8.036 -7.010 -4.696 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -9.796 -7.322 -3.085 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -10.256 -5.896 -3.995 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -11.270 -8.226 -5.413 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -11.741 -8.364 -3.731 1.00 0.00 H new ATOM 0 HE ARG A 114 -12.268 -5.894 -5.447 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -12.305 -5.373 -2.491 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -13.996 -5.670 -2.073 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -14.674 -7.429 -5.017 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -15.324 -6.823 -3.491 1.00 0.00 H new ATOM 1216 N ALA A 115 -9.608 -4.224 -5.617 1.00 0.00 N ATOM 1217 CA ALA A 115 -9.224 -2.788 -5.450 1.00 0.00 C ATOM 1218 C ALA A 115 -9.947 -2.185 -4.244 1.00 0.00 C ATOM 1219 O ALA A 115 -10.809 -1.341 -4.383 1.00 0.00 O ATOM 1220 CB ALA A 115 -9.675 -2.105 -6.742 1.00 0.00 C ATOM 0 H ALA A 115 -10.507 -4.481 -5.210 1.00 0.00 H new ATOM 0 HA ALA A 115 -8.155 -2.664 -5.275 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -9.428 -1.044 -6.698 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -9.166 -2.561 -7.591 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -10.752 -2.222 -6.859 1.00 0.00 H new ATOM 1226 N TYR A 116 -9.599 -2.609 -3.059 1.00 0.00 N ATOM 1227 CA TYR A 116 -10.265 -2.051 -1.849 1.00 0.00 C ATOM 1228 C TYR A 116 -9.837 -0.596 -1.651 1.00 0.00 C ATOM 1229 O TYR A 116 -8.667 -0.272 -1.709 1.00 0.00 O ATOM 1230 CB TYR A 116 -9.768 -2.916 -0.690 1.00 0.00 C ATOM 1231 CG TYR A 116 -10.734 -2.818 0.467 1.00 0.00 C ATOM 1232 CD1 TYR A 116 -12.090 -3.106 0.274 1.00 0.00 C ATOM 1233 CD2 TYR A 116 -10.273 -2.441 1.733 1.00 0.00 C ATOM 1234 CE1 TYR A 116 -12.985 -3.017 1.347 1.00 0.00 C ATOM 1235 CE2 TYR A 116 -11.168 -2.352 2.806 1.00 0.00 C ATOM 1236 CZ TYR A 116 -12.523 -2.640 2.614 1.00 0.00 C ATOM 1237 OH TYR A 116 -13.403 -2.551 3.674 1.00 0.00 O ATOM 0 H TYR A 116 -8.885 -3.315 -2.878 1.00 0.00 H new ATOM 0 HA TYR A 116 -11.352 -2.062 -1.927 1.00 0.00 H new ATOM 0 HB2 TYR A 116 -9.674 -3.953 -1.011 1.00 0.00 H new ATOM 0 HB3 TYR A 116 -8.776 -2.588 -0.378 1.00 0.00 H new ATOM 0 HD1 TYR A 116 -12.446 -3.397 -0.703 1.00 0.00 H new ATOM 0 HD2 TYR A 116 -9.227 -2.219 1.883 1.00 0.00 H new ATOM 0 HE1 TYR A 116 -14.031 -3.239 1.198 1.00 0.00 H new ATOM 0 HE2 TYR A 116 -10.812 -2.061 3.783 1.00 0.00 H new ATOM 0 HH TYR A 116 -12.917 -2.278 4.480 1.00 0.00 H new ATOM 1247 N THR A 117 -10.770 0.285 -1.422 1.00 0.00 N ATOM 1248 CA THR A 117 -10.402 1.715 -1.226 1.00 0.00 C ATOM 1249 C THR A 117 -10.105 1.989 0.248 1.00 0.00 C ATOM 1250 O THR A 117 -10.792 1.513 1.129 1.00 0.00 O ATOM 1251 CB THR A 117 -11.625 2.511 -1.680 1.00 0.00 C ATOM 1252 OG1 THR A 117 -12.115 1.973 -2.899 1.00 0.00 O ATOM 1253 CG2 THR A 117 -11.234 3.975 -1.883 1.00 0.00 C ATOM 0 H THR A 117 -11.767 0.078 -1.362 1.00 0.00 H new ATOM 0 HA THR A 117 -9.508 1.987 -1.787 1.00 0.00 H new ATOM 0 HB THR A 117 -12.403 2.448 -0.920 1.00 0.00 H new ATOM 0 HG1 THR A 117 -12.900 2.482 -3.189 1.00 0.00 H new ATOM 0 HG21 THR A 117 -12.106 4.543 -2.207 1.00 0.00 H new ATOM 0 HG22 THR A 117 -10.862 4.386 -0.945 1.00 0.00 H new ATOM 0 HG23 THR A 117 -10.455 4.042 -2.643 1.00 0.00 H new ATOM 1261 N LEU A 118 -9.091 2.757 0.520 1.00 0.00 N ATOM 1262 CA LEU A 118 -8.749 3.067 1.936 1.00 0.00 C ATOM 1263 C LEU A 118 -9.085 4.515 2.252 1.00 0.00 C ATOM 1264 O LEU A 118 -8.374 5.173 2.986 1.00 0.00 O ATOM 1265 CB LEU A 118 -7.244 2.822 2.050 1.00 0.00 C ATOM 1266 CG LEU A 118 -6.992 1.627 2.972 1.00 0.00 C ATOM 1267 CD1 LEU A 118 -5.691 0.930 2.565 1.00 0.00 C ATOM 1268 CD2 LEU A 118 -6.877 2.116 4.419 1.00 0.00 C ATOM 0 H LEU A 118 -8.482 3.185 -0.177 1.00 0.00 H new ATOM 0 HA LEU A 118 -9.310 2.452 2.639 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -6.820 2.631 1.064 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -6.749 3.710 2.443 1.00 0.00 H new ATOM 0 HG LEU A 118 -7.821 0.924 2.889 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -5.513 0.079 3.223 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -5.771 0.582 1.535 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -4.861 1.632 2.647 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -6.697 1.266 5.077 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -6.048 2.819 4.501 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -7.803 2.611 4.710 1.00 0.00 H new ATOM 1280 N GLY A 119 -10.161 5.019 1.713 1.00 0.00 N ATOM 1281 CA GLY A 119 -10.539 6.432 1.993 1.00 0.00 C ATOM 1282 C GLY A 119 -9.510 7.364 1.368 1.00 0.00 C ATOM 1283 O GLY A 119 -9.820 8.206 0.549 1.00 0.00 O ATOM 0 H GLY A 119 -10.793 4.514 1.092 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -11.529 6.642 1.589 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -10.592 6.600 3.069 1.00 0.00 H new ATOM 1287 N THR A 120 -8.288 7.209 1.761 1.00 0.00 N ATOM 1288 CA THR A 120 -7.200 8.070 1.216 1.00 0.00 C ATOM 1289 C THR A 120 -6.235 7.229 0.378 1.00 0.00 C ATOM 1290 O THR A 120 -5.541 7.734 -0.482 1.00 0.00 O ATOM 1291 CB THR A 120 -6.491 8.634 2.448 1.00 0.00 C ATOM 1292 OG1 THR A 120 -6.594 7.701 3.516 1.00 0.00 O ATOM 1293 CG2 THR A 120 -7.143 9.956 2.857 1.00 0.00 C ATOM 0 H THR A 120 -7.985 6.516 2.445 1.00 0.00 H new ATOM 0 HA THR A 120 -7.579 8.859 0.567 1.00 0.00 H new ATOM 0 HB THR A 120 -5.441 8.809 2.216 1.00 0.00 H new ATOM 0 HG1 THR A 120 -6.139 8.058 4.307 1.00 0.00 H new ATOM 0 HG21 THR A 120 -6.636 10.356 3.735 1.00 0.00 H new ATOM 0 HG22 THR A 120 -7.065 10.669 2.037 1.00 0.00 H new ATOM 0 HG23 THR A 120 -8.194 9.786 3.091 1.00 0.00 H new ATOM 1301 N LYS A 121 -6.185 5.948 0.625 1.00 0.00 N ATOM 1302 CA LYS A 121 -5.263 5.076 -0.158 1.00 0.00 C ATOM 1303 C LYS A 121 -6.056 4.045 -0.970 1.00 0.00 C ATOM 1304 O LYS A 121 -7.259 4.137 -1.106 1.00 0.00 O ATOM 1305 CB LYS A 121 -4.392 4.381 0.886 1.00 0.00 C ATOM 1306 CG LYS A 121 -3.790 5.422 1.835 1.00 0.00 C ATOM 1307 CD LYS A 121 -2.481 4.882 2.417 1.00 0.00 C ATOM 1308 CE LYS A 121 -1.311 5.745 1.940 1.00 0.00 C ATOM 1309 NZ LYS A 121 -1.059 6.703 3.052 1.00 0.00 N ATOM 0 H LYS A 121 -6.741 5.469 1.333 1.00 0.00 H new ATOM 0 HA LYS A 121 -4.669 5.647 -0.872 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -4.987 3.663 1.450 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -3.597 3.820 0.395 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -3.606 6.354 1.301 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -4.492 5.648 2.638 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -2.527 4.885 3.506 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -2.333 3.848 2.107 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -0.430 5.137 1.736 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -1.558 6.269 1.016 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -0.269 7.329 2.798 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -1.913 7.273 3.219 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -0.820 6.176 3.916 1.00 0.00 H new ATOM 1323 N PHE A 122 -5.382 3.070 -1.515 1.00 0.00 N ATOM 1324 CA PHE A 122 -6.071 2.028 -2.331 1.00 0.00 C ATOM 1325 C PHE A 122 -5.491 0.651 -1.983 1.00 0.00 C ATOM 1326 O PHE A 122 -4.413 0.557 -1.427 1.00 0.00 O ATOM 1327 CB PHE A 122 -5.720 2.413 -3.761 1.00 0.00 C ATOM 1328 CG PHE A 122 -6.670 1.771 -4.745 1.00 0.00 C ATOM 1329 CD1 PHE A 122 -8.031 2.061 -4.678 1.00 0.00 C ATOM 1330 CD2 PHE A 122 -6.190 0.893 -5.729 1.00 0.00 C ATOM 1331 CE1 PHE A 122 -8.921 1.473 -5.583 1.00 0.00 C ATOM 1332 CE2 PHE A 122 -7.078 0.307 -6.635 1.00 0.00 C ATOM 1333 CZ PHE A 122 -8.444 0.596 -6.563 1.00 0.00 C ATOM 0 H PHE A 122 -4.373 2.949 -1.429 1.00 0.00 H new ATOM 0 HA PHE A 122 -7.147 1.974 -2.164 1.00 0.00 H new ATOM 0 HB2 PHE A 122 -5.757 3.497 -3.869 1.00 0.00 H new ATOM 0 HB3 PHE A 122 -4.698 2.106 -3.983 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -8.400 2.742 -3.925 1.00 0.00 H new ATOM 0 HD2 PHE A 122 -5.135 0.670 -5.786 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -9.976 1.696 -5.525 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -6.709 -0.370 -7.391 1.00 0.00 H new ATOM 0 HZ PHE A 122 -9.130 0.143 -7.263 1.00 0.00 H new ATOM 1343 N THR A 123 -6.174 -0.421 -2.297 1.00 0.00 N ATOM 1344 CA THR A 123 -5.627 -1.747 -1.966 1.00 0.00 C ATOM 1345 C THR A 123 -6.006 -2.765 -3.048 1.00 0.00 C ATOM 1346 O THR A 123 -7.112 -2.773 -3.547 1.00 0.00 O ATOM 1347 CB THR A 123 -6.248 -2.088 -0.602 1.00 0.00 C ATOM 1348 OG1 THR A 123 -5.285 -1.867 0.420 1.00 0.00 O ATOM 1349 CG2 THR A 123 -6.700 -3.549 -0.564 1.00 0.00 C ATOM 0 H THR A 123 -7.080 -0.424 -2.765 1.00 0.00 H new ATOM 0 HA THR A 123 -4.538 -1.763 -1.920 1.00 0.00 H new ATOM 0 HB THR A 123 -7.117 -1.449 -0.443 1.00 0.00 H new ATOM 0 HG1 THR A 123 -4.766 -1.062 0.212 1.00 0.00 H new ATOM 0 HG21 THR A 123 -7.137 -3.770 0.410 1.00 0.00 H new ATOM 0 HG22 THR A 123 -7.444 -3.720 -1.342 1.00 0.00 H new ATOM 0 HG23 THR A 123 -5.842 -4.200 -0.733 1.00 0.00 H new ATOM 1357 N ILE A 124 -5.091 -3.622 -3.407 1.00 0.00 N ATOM 1358 CA ILE A 124 -5.391 -4.641 -4.452 1.00 0.00 C ATOM 1359 C ILE A 124 -4.877 -6.015 -4.013 1.00 0.00 C ATOM 1360 O ILE A 124 -3.951 -6.124 -3.231 1.00 0.00 O ATOM 1361 CB ILE A 124 -4.644 -4.155 -5.692 1.00 0.00 C ATOM 1362 CG1 ILE A 124 -5.425 -3.009 -6.333 1.00 0.00 C ATOM 1363 CG2 ILE A 124 -4.507 -5.304 -6.694 1.00 0.00 C ATOM 1364 CD1 ILE A 124 -4.945 -1.676 -5.755 1.00 0.00 C ATOM 0 H ILE A 124 -4.147 -3.661 -3.022 1.00 0.00 H new ATOM 0 HA ILE A 124 -6.460 -4.750 -4.635 1.00 0.00 H new ATOM 0 HB ILE A 124 -3.651 -3.808 -5.406 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -5.285 -3.020 -7.414 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -6.492 -3.134 -6.148 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -3.974 -4.954 -7.578 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -3.952 -6.122 -6.235 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -5.498 -5.655 -6.983 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -5.503 -0.859 -6.213 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -5.108 -1.667 -4.677 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -3.882 -1.551 -5.963 1.00 0.00 H new ATOM 1376 N THR A 125 -5.468 -7.067 -4.512 1.00 0.00 N ATOM 1377 CA THR A 125 -5.010 -8.431 -4.122 1.00 0.00 C ATOM 1378 C THR A 125 -5.304 -9.432 -5.243 1.00 0.00 C ATOM 1379 O THR A 125 -5.751 -9.069 -6.313 1.00 0.00 O ATOM 1380 CB THR A 125 -5.809 -8.779 -2.865 1.00 0.00 C ATOM 1381 OG1 THR A 125 -5.619 -10.150 -2.551 1.00 0.00 O ATOM 1382 CG2 THR A 125 -7.294 -8.512 -3.109 1.00 0.00 C ATOM 0 H THR A 125 -6.246 -7.041 -5.171 1.00 0.00 H new ATOM 0 HA THR A 125 -3.936 -8.467 -3.941 1.00 0.00 H new ATOM 0 HB THR A 125 -5.464 -8.163 -2.034 1.00 0.00 H new ATOM 0 HG1 THR A 125 -4.677 -10.308 -2.331 1.00 0.00 H new ATOM 0 HG21 THR A 125 -7.861 -8.761 -2.212 1.00 0.00 H new ATOM 0 HG22 THR A 125 -7.440 -7.459 -3.350 1.00 0.00 H new ATOM 0 HG23 THR A 125 -7.642 -9.126 -3.940 1.00 0.00 H new ATOM 1390 N SER A 126 -5.048 -10.690 -5.005 1.00 0.00 N ATOM 1391 CA SER A 126 -5.303 -11.718 -6.056 1.00 0.00 C ATOM 1392 C SER A 126 -6.733 -12.257 -5.945 1.00 0.00 C ATOM 1393 O SER A 126 -7.651 -11.736 -6.548 1.00 0.00 O ATOM 1394 CB SER A 126 -4.291 -12.824 -5.770 1.00 0.00 C ATOM 1395 OG SER A 126 -4.550 -13.378 -4.487 1.00 0.00 O ATOM 0 H SER A 126 -4.673 -11.051 -4.128 1.00 0.00 H new ATOM 0 HA SER A 126 -5.199 -11.313 -7.063 1.00 0.00 H new ATOM 0 HB2 SER A 126 -4.357 -13.599 -6.533 1.00 0.00 H new ATOM 0 HB3 SER A 126 -3.278 -12.424 -5.808 1.00 0.00 H new ATOM 0 HG SER A 126 -4.432 -14.350 -4.521 1.00 0.00 H new