USER MOD reduce.3.24.130724 H: found=0, std=0, add=833, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 837 hydrogens (34 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: C 13 THR OG1 : rot 180:sc= -0.765 USER MOD Set 1.2: C 16 GLN : amide:sc= -6.52! C(o=-7.3!,f=-16!) USER MOD Single : C 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 1 MET N :NH3+ -130:sc= 0.106 (180deg=0) USER MOD Single : C 5 TYR OH : rot 180:sc= 0 USER MOD Single : C 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 11 GLN : amide:sc= 0 X(o=0,f=-0.058) USER MOD Single : C 17 LYS NZ :NH3+ 131:sc= 0.471 (180deg=-0.241!) USER MOD Single : C 18 ASN : amide:sc= -0.38 K(o=-0.38,f=-1.9) USER MOD Single : C 21 LYS NZ :NH3+ -147:sc= 0 (180deg=-0.0428) USER MOD Single : C 35 CYS SG : rot 89:sc= 1.12 USER MOD Single : C 37 SER OG : rot 150:sc= -0.0398 USER MOD Single : C 38 THR OG1 : rot 180:sc= 0.296! USER MOD Single : C 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 43 LYS NZ :NH3+ 137:sc= -0.123 (180deg=-1.06) USER MOD Single : C 45 MET CE :methyl -146:sc= -3.2! (180deg=-6.13!) USER MOD Single : C 47 MET CE :methyl -147:sc= -1.36 (180deg=-4.08!) USER MOD Single : C 50 GLN : amide:sc= -1.21! C(o=-1.2!,f=-1.5!) USER MOD Single : C 51 ASN : amide:sc= -1.55 K(o=-1.6,f=-0.84) USER MOD Single : C 53 THR OG1 : rot 180:sc= 0.055 USER MOD Single : C 58 GLN : amide:sc= -0.118 K(o=-0.12,f=-0.66) USER MOD Single : C 60 MET CE :methyl 180:sc= -3.22! (180deg=-3.22!) USER MOD Single : C 71 THR OG1 : rot 42:sc= 0.186 USER MOD Single : C 80 MET CE :methyl 149:sc= -4.59! (180deg=-8.66!) USER MOD Single : C 81 MET CE :methyl -176:sc= -18.9! (180deg=-19.4!) USER MOD Single : C 84 CYS SG : rot 61:sc= 1.17 USER MOD Single : C 85 MET CE :methyl 137:sc= -2.6! (180deg=-7.29!) USER MOD Single : C 86 LYS NZ :NH3+ -148:sc= -0.256 (180deg=-1.44!) USER MOD Single : C 89 SER OG : rot 66:sc= 0.869 USER MOD Single : I 149 SER OG : rot 180:sc= 0 USER MOD Single : I 153 MET CE :methyl -139:sc= -3.14 (180deg=-8!) USER MOD Single : I 154 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : I 155 GLN : amide:sc= -0.0815 X(o=-0.082,f=0) USER MOD Single : I 163 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET C 1 88.104 -20.450 -9.524 1.00 0.00 N ATOM 2 CA MET C 1 86.909 -20.401 -8.635 1.00 0.00 C ATOM 3 C MET C 1 86.834 -19.036 -7.958 1.00 0.00 C ATOM 4 O MET C 1 87.658 -18.157 -8.209 1.00 0.00 O ATOM 5 CB MET C 1 87.020 -21.493 -7.569 1.00 0.00 C ATOM 6 CG MET C 1 86.537 -22.824 -8.148 1.00 0.00 C ATOM 7 SD MET C 1 84.742 -22.953 -7.949 1.00 0.00 S ATOM 8 CE MET C 1 84.719 -24.567 -7.132 1.00 0.00 C ATOM 0 H1 MET C 1 87.823 -20.792 -10.465 1.00 0.00 H new ATOM 0 H2 MET C 1 88.512 -19.497 -9.610 1.00 0.00 H new ATOM 0 H3 MET C 1 88.812 -21.095 -9.119 1.00 0.00 H new ATOM 0 HA MET C 1 86.009 -20.563 -9.228 1.00 0.00 H new ATOM 0 HB2 MET C 1 88.053 -21.584 -7.233 1.00 0.00 H new ATOM 0 HB3 MET C 1 86.423 -21.226 -6.697 1.00 0.00 H new ATOM 0 HG2 MET C 1 86.802 -22.892 -9.203 1.00 0.00 H new ATOM 0 HG3 MET C 1 87.030 -23.654 -7.641 1.00 0.00 H new ATOM 0 HE1 MET C 1 83.689 -24.849 -6.913 1.00 0.00 H new ATOM 0 HE2 MET C 1 85.168 -25.313 -7.788 1.00 0.00 H new ATOM 0 HE3 MET C 1 85.286 -24.512 -6.203 1.00 0.00 H new ATOM 20 N ASP C 2 85.835 -18.869 -7.096 1.00 0.00 N ATOM 21 CA ASP C 2 85.658 -17.605 -6.386 1.00 0.00 C ATOM 22 C ASP C 2 85.097 -17.851 -4.989 1.00 0.00 C ATOM 23 O ASP C 2 84.426 -16.994 -4.413 1.00 0.00 O ATOM 24 CB ASP C 2 84.703 -16.689 -7.154 1.00 0.00 C ATOM 25 CG ASP C 2 83.460 -17.473 -7.562 1.00 0.00 C ATOM 26 OD1 ASP C 2 83.613 -18.485 -8.226 1.00 0.00 O ATOM 27 OD2 ASP C 2 82.373 -17.049 -7.205 1.00 0.00 O ATOM 0 H ASP C 2 85.142 -19.584 -6.873 1.00 0.00 H new ATOM 0 HA ASP C 2 86.634 -17.125 -6.305 1.00 0.00 H new ATOM 0 HB2 ASP C 2 84.421 -15.838 -6.534 1.00 0.00 H new ATOM 0 HB3 ASP C 2 85.199 -16.289 -8.038 1.00 0.00 H new ATOM 32 N ASP C 3 85.380 -19.034 -4.451 1.00 0.00 N ATOM 33 CA ASP C 3 84.901 -19.388 -3.117 1.00 0.00 C ATOM 34 C ASP C 3 85.857 -18.863 -2.050 1.00 0.00 C ATOM 35 O ASP C 3 85.458 -18.579 -0.921 1.00 0.00 O ATOM 36 CB ASP C 3 84.782 -20.907 -2.975 1.00 0.00 C ATOM 37 CG ASP C 3 86.015 -21.573 -3.576 1.00 0.00 C ATOM 38 OD1 ASP C 3 87.061 -21.511 -2.951 1.00 0.00 O ATOM 39 OD2 ASP C 3 85.896 -22.135 -4.652 1.00 0.00 O ATOM 0 H ASP C 3 85.932 -19.757 -4.912 1.00 0.00 H new ATOM 0 HA ASP C 3 83.920 -18.933 -2.982 1.00 0.00 H new ATOM 0 HB2 ASP C 3 84.685 -21.178 -1.924 1.00 0.00 H new ATOM 0 HB3 ASP C 3 83.883 -21.261 -3.479 1.00 0.00 H new ATOM 44 N ILE C 4 87.128 -18.742 -2.423 1.00 0.00 N ATOM 45 CA ILE C 4 88.145 -18.255 -1.495 1.00 0.00 C ATOM 46 C ILE C 4 87.688 -16.968 -0.815 1.00 0.00 C ATOM 47 O ILE C 4 88.113 -16.654 0.297 1.00 0.00 O ATOM 48 CB ILE C 4 89.459 -17.990 -2.232 1.00 0.00 C ATOM 49 CG1 ILE C 4 89.300 -16.770 -3.144 1.00 0.00 C ATOM 50 CG2 ILE C 4 89.826 -19.212 -3.074 1.00 0.00 C ATOM 51 CD1 ILE C 4 88.369 -17.114 -4.310 1.00 0.00 C ATOM 0 H ILE C 4 87.477 -18.972 -3.353 1.00 0.00 H new ATOM 0 HA ILE C 4 88.299 -19.025 -0.739 1.00 0.00 H new ATOM 0 HB ILE C 4 90.249 -17.798 -1.506 1.00 0.00 H new ATOM 0 HG12 ILE C 4 88.895 -15.931 -2.578 1.00 0.00 H new ATOM 0 HG13 ILE C 4 90.273 -16.458 -3.523 1.00 0.00 H new ATOM 0 HG21 ILE C 4 90.762 -19.024 -3.600 1.00 0.00 H new ATOM 0 HG22 ILE C 4 89.942 -20.080 -2.425 1.00 0.00 H new ATOM 0 HG23 ILE C 4 89.035 -19.405 -3.799 1.00 0.00 H new ATOM 0 HD11 ILE C 4 88.259 -16.243 -4.956 1.00 0.00 H new ATOM 0 HD12 ILE C 4 88.792 -17.939 -4.882 1.00 0.00 H new ATOM 0 HD13 ILE C 4 87.392 -17.404 -3.922 1.00 0.00 H new ATOM 63 N TYR C 5 86.819 -16.224 -1.494 1.00 0.00 N ATOM 64 CA TYR C 5 86.314 -14.970 -0.941 1.00 0.00 C ATOM 65 C TYR C 5 85.151 -15.234 0.010 1.00 0.00 C ATOM 66 O TYR C 5 85.101 -14.695 1.116 1.00 0.00 O ATOM 67 CB TYR C 5 85.846 -14.038 -2.061 1.00 0.00 C ATOM 68 CG TYR C 5 87.044 -13.561 -2.849 1.00 0.00 C ATOM 69 CD1 TYR C 5 87.502 -14.304 -3.943 1.00 0.00 C ATOM 70 CD2 TYR C 5 87.697 -12.378 -2.483 1.00 0.00 C ATOM 71 CE1 TYR C 5 88.613 -13.864 -4.673 1.00 0.00 C ATOM 72 CE2 TYR C 5 88.808 -11.937 -3.213 1.00 0.00 C ATOM 73 CZ TYR C 5 89.266 -12.680 -4.308 1.00 0.00 C ATOM 74 OH TYR C 5 90.361 -12.246 -5.028 1.00 0.00 O ATOM 0 H TYR C 5 86.454 -16.463 -2.416 1.00 0.00 H new ATOM 0 HA TYR C 5 87.127 -14.494 -0.393 1.00 0.00 H new ATOM 0 HB2 TYR C 5 85.150 -14.560 -2.717 1.00 0.00 H new ATOM 0 HB3 TYR C 5 85.310 -13.187 -1.641 1.00 0.00 H new ATOM 0 HD1 TYR C 5 86.998 -15.217 -4.224 1.00 0.00 H new ATOM 0 HD2 TYR C 5 87.344 -11.806 -1.638 1.00 0.00 H new ATOM 0 HE1 TYR C 5 88.966 -14.437 -5.517 1.00 0.00 H new ATOM 0 HE2 TYR C 5 89.311 -11.024 -2.931 1.00 0.00 H new ATOM 0 HH TYR C 5 90.694 -11.409 -4.643 1.00 0.00 H new ATOM 84 N LYS C 6 84.215 -16.071 -0.430 1.00 0.00 N ATOM 85 CA LYS C 6 83.056 -16.401 0.396 1.00 0.00 C ATOM 86 C LYS C 6 83.476 -16.571 1.852 1.00 0.00 C ATOM 87 O LYS C 6 83.085 -15.794 2.723 1.00 0.00 O ATOM 88 CB LYS C 6 82.403 -17.697 -0.086 1.00 0.00 C ATOM 89 CG LYS C 6 81.731 -17.459 -1.439 1.00 0.00 C ATOM 90 CD LYS C 6 80.440 -16.664 -1.234 1.00 0.00 C ATOM 91 CE LYS C 6 79.251 -17.625 -1.206 1.00 0.00 C ATOM 92 NZ LYS C 6 78.087 -16.955 -0.560 1.00 0.00 N ATOM 0 H LYS C 6 84.234 -16.528 -1.342 1.00 0.00 H new ATOM 0 HA LYS C 6 82.340 -15.583 0.313 1.00 0.00 H new ATOM 0 HB2 LYS C 6 83.153 -18.483 -0.174 1.00 0.00 H new ATOM 0 HB3 LYS C 6 81.667 -18.038 0.642 1.00 0.00 H new ATOM 0 HG2 LYS C 6 82.405 -16.915 -2.101 1.00 0.00 H new ATOM 0 HG3 LYS C 6 81.511 -18.412 -1.921 1.00 0.00 H new ATOM 0 HD2 LYS C 6 80.490 -16.102 -0.301 1.00 0.00 H new ATOM 0 HD3 LYS C 6 80.316 -15.938 -2.037 1.00 0.00 H new ATOM 0 HE2 LYS C 6 78.992 -17.930 -2.220 1.00 0.00 H new ATOM 0 HE3 LYS C 6 79.514 -18.530 -0.658 1.00 0.00 H new ATOM 0 HZ1 LYS C 6 77.278 -17.608 -0.540 1.00 0.00 H new ATOM 0 HZ2 LYS C 6 78.338 -16.685 0.413 1.00 0.00 H new ATOM 0 HZ3 LYS C 6 77.832 -16.104 -1.101 1.00 0.00 H new ATOM 106 N ALA C 7 84.282 -17.599 2.104 1.00 0.00 N ATOM 107 CA ALA C 7 84.758 -17.868 3.457 1.00 0.00 C ATOM 108 C ALA C 7 85.269 -16.585 4.102 1.00 0.00 C ATOM 109 O ALA C 7 84.955 -16.283 5.254 1.00 0.00 O ATOM 110 CB ALA C 7 85.888 -18.899 3.432 1.00 0.00 C ATOM 0 H ALA C 7 84.616 -18.253 1.397 1.00 0.00 H new ATOM 0 HA ALA C 7 83.924 -18.261 4.038 1.00 0.00 H new ATOM 0 HB1 ALA C 7 86.231 -19.088 4.449 1.00 0.00 H new ATOM 0 HB2 ALA C 7 85.523 -19.828 2.994 1.00 0.00 H new ATOM 0 HB3 ALA C 7 86.716 -18.517 2.835 1.00 0.00 H new ATOM 116 N ALA C 8 86.060 -15.830 3.345 1.00 0.00 N ATOM 117 CA ALA C 8 86.608 -14.576 3.852 1.00 0.00 C ATOM 118 C ALA C 8 85.478 -13.633 4.248 1.00 0.00 C ATOM 119 O ALA C 8 85.485 -13.053 5.334 1.00 0.00 O ATOM 120 CB ALA C 8 87.478 -13.899 2.791 1.00 0.00 C ATOM 0 H ALA C 8 86.333 -16.061 2.390 1.00 0.00 H new ATOM 0 HA ALA C 8 87.221 -14.802 4.725 1.00 0.00 H new ATOM 0 HB1 ALA C 8 87.877 -12.966 3.189 1.00 0.00 H new ATOM 0 HB2 ALA C 8 88.302 -14.560 2.520 1.00 0.00 H new ATOM 0 HB3 ALA C 8 86.876 -13.689 1.907 1.00 0.00 H new ATOM 126 N VAL C 9 84.499 -13.495 3.357 1.00 0.00 N ATOM 127 CA VAL C 9 83.356 -12.628 3.626 1.00 0.00 C ATOM 128 C VAL C 9 82.543 -13.185 4.789 1.00 0.00 C ATOM 129 O VAL C 9 81.757 -12.475 5.416 1.00 0.00 O ATOM 130 CB VAL C 9 82.457 -12.522 2.394 1.00 0.00 C ATOM 131 CG1 VAL C 9 81.148 -11.827 2.774 1.00 0.00 C ATOM 132 CG2 VAL C 9 83.171 -11.707 1.312 1.00 0.00 C ATOM 0 H VAL C 9 84.474 -13.967 2.453 1.00 0.00 H new ATOM 0 HA VAL C 9 83.733 -11.637 3.879 1.00 0.00 H new ATOM 0 HB VAL C 9 82.241 -13.521 2.015 1.00 0.00 H new ATOM 0 HG11 VAL C 9 80.508 -11.752 1.895 1.00 0.00 H new ATOM 0 HG12 VAL C 9 80.639 -12.406 3.545 1.00 0.00 H new ATOM 0 HG13 VAL C 9 81.363 -10.828 3.153 1.00 0.00 H new ATOM 0 HG21 VAL C 9 82.531 -11.630 0.433 1.00 0.00 H new ATOM 0 HG22 VAL C 9 83.387 -10.708 1.692 1.00 0.00 H new ATOM 0 HG23 VAL C 9 84.104 -12.201 1.040 1.00 0.00 H new ATOM 142 N GLU C 10 82.751 -14.467 5.073 1.00 0.00 N ATOM 143 CA GLU C 10 82.045 -15.122 6.168 1.00 0.00 C ATOM 144 C GLU C 10 82.808 -14.920 7.473 1.00 0.00 C ATOM 145 O GLU C 10 82.279 -15.142 8.563 1.00 0.00 O ATOM 146 CB GLU C 10 81.911 -16.622 5.893 1.00 0.00 C ATOM 147 CG GLU C 10 81.106 -16.836 4.610 1.00 0.00 C ATOM 148 CD GLU C 10 79.678 -17.234 4.965 1.00 0.00 C ATOM 149 OE1 GLU C 10 79.382 -17.312 6.146 1.00 0.00 O ATOM 150 OE2 GLU C 10 78.901 -17.457 4.051 1.00 0.00 O ATOM 0 H GLU C 10 83.398 -15.069 4.564 1.00 0.00 H new ATOM 0 HA GLU C 10 81.052 -14.681 6.251 1.00 0.00 H new ATOM 0 HB2 GLU C 10 82.898 -17.074 5.795 1.00 0.00 H new ATOM 0 HB3 GLU C 10 81.417 -17.113 6.731 1.00 0.00 H new ATOM 0 HG2 GLU C 10 81.103 -15.923 4.014 1.00 0.00 H new ATOM 0 HG3 GLU C 10 81.571 -17.612 4.002 1.00 0.00 H new ATOM 157 N GLN C 11 84.062 -14.495 7.342 1.00 0.00 N ATOM 158 CA GLN C 11 84.910 -14.260 8.505 1.00 0.00 C ATOM 159 C GLN C 11 84.529 -12.953 9.192 1.00 0.00 C ATOM 160 O GLN C 11 84.464 -12.874 10.419 1.00 0.00 O ATOM 161 CB GLN C 11 86.375 -14.176 8.076 1.00 0.00 C ATOM 162 CG GLN C 11 86.833 -15.539 7.553 1.00 0.00 C ATOM 163 CD GLN C 11 87.967 -16.065 8.426 1.00 0.00 C ATOM 164 OE1 GLN C 11 87.824 -16.172 9.644 1.00 0.00 O ATOM 165 NE2 GLN C 11 89.098 -16.404 7.870 1.00 0.00 N ATOM 0 H GLN C 11 84.511 -14.307 6.446 1.00 0.00 H new ATOM 0 HA GLN C 11 84.770 -15.089 9.198 1.00 0.00 H new ATOM 0 HB2 GLN C 11 86.495 -13.418 7.302 1.00 0.00 H new ATOM 0 HB3 GLN C 11 86.995 -13.871 8.919 1.00 0.00 H new ATOM 0 HG2 GLN C 11 85.999 -16.241 7.559 1.00 0.00 H new ATOM 0 HG3 GLN C 11 87.167 -15.450 6.519 1.00 0.00 H new ATOM 0 HE21 GLN C 11 89.217 -16.316 6.861 1.00 0.00 H new ATOM 0 HE22 GLN C 11 89.863 -16.757 8.445 1.00 0.00 H new ATOM 174 N LEU C 12 84.284 -11.928 8.383 1.00 0.00 N ATOM 175 CA LEU C 12 83.918 -10.619 8.909 1.00 0.00 C ATOM 176 C LEU C 12 82.902 -10.750 10.040 1.00 0.00 C ATOM 177 O LEU C 12 81.790 -11.241 9.843 1.00 0.00 O ATOM 178 CB LEU C 12 83.320 -9.758 7.796 1.00 0.00 C ATOM 179 CG LEU C 12 84.428 -9.179 6.899 1.00 0.00 C ATOM 180 CD1 LEU C 12 84.903 -7.844 7.475 1.00 0.00 C ATOM 181 CD2 LEU C 12 85.623 -10.140 6.804 1.00 0.00 C ATOM 0 H LEU C 12 84.332 -11.978 7.365 1.00 0.00 H new ATOM 0 HA LEU C 12 84.820 -10.148 9.298 1.00 0.00 H new ATOM 0 HB2 LEU C 12 82.635 -10.356 7.195 1.00 0.00 H new ATOM 0 HB3 LEU C 12 82.737 -8.946 8.231 1.00 0.00 H new ATOM 0 HG LEU C 12 84.018 -9.035 5.899 1.00 0.00 H new ATOM 0 HD11 LEU C 12 85.688 -7.433 6.840 1.00 0.00 H new ATOM 0 HD12 LEU C 12 84.066 -7.147 7.515 1.00 0.00 H new ATOM 0 HD13 LEU C 12 85.294 -8.000 8.481 1.00 0.00 H new ATOM 0 HD21 LEU C 12 86.390 -9.704 6.164 1.00 0.00 H new ATOM 0 HD22 LEU C 12 86.034 -10.309 7.799 1.00 0.00 H new ATOM 0 HD23 LEU C 12 85.294 -11.089 6.381 1.00 0.00 H new ATOM 193 N THR C 13 83.295 -10.295 11.228 1.00 0.00 N ATOM 194 CA THR C 13 82.409 -10.356 12.388 1.00 0.00 C ATOM 195 C THR C 13 81.247 -9.384 12.215 1.00 0.00 C ATOM 196 O THR C 13 81.281 -8.501 11.357 1.00 0.00 O ATOM 197 CB THR C 13 83.170 -9.999 13.668 1.00 0.00 C ATOM 198 OG1 THR C 13 84.272 -9.162 13.345 1.00 0.00 O ATOM 199 CG2 THR C 13 83.676 -11.278 14.337 1.00 0.00 C ATOM 0 H THR C 13 84.210 -9.885 11.412 1.00 0.00 H new ATOM 0 HA THR C 13 82.028 -11.374 12.468 1.00 0.00 H new ATOM 0 HB THR C 13 82.504 -9.474 14.352 1.00 0.00 H new ATOM 0 HG1 THR C 13 84.759 -8.932 14.164 1.00 0.00 H new ATOM 0 HG21 THR C 13 84.217 -11.022 15.248 1.00 0.00 H new ATOM 0 HG22 THR C 13 82.829 -11.918 14.586 1.00 0.00 H new ATOM 0 HG23 THR C 13 84.342 -11.806 13.655 1.00 0.00 H new ATOM 207 N GLU C 14 80.218 -9.555 13.039 1.00 0.00 N ATOM 208 CA GLU C 14 79.045 -8.687 12.968 1.00 0.00 C ATOM 209 C GLU C 14 79.455 -7.222 13.089 1.00 0.00 C ATOM 210 O GLU C 14 78.989 -6.367 12.336 1.00 0.00 O ATOM 211 CB GLU C 14 78.063 -9.024 14.092 1.00 0.00 C ATOM 212 CG GLU C 14 76.707 -9.400 13.491 1.00 0.00 C ATOM 213 CD GLU C 14 76.258 -10.747 14.049 1.00 0.00 C ATOM 214 OE1 GLU C 14 76.870 -11.206 14.999 1.00 0.00 O ATOM 215 OE2 GLU C 14 75.309 -11.299 13.518 1.00 0.00 O ATOM 0 H GLU C 14 80.171 -10.278 13.757 1.00 0.00 H new ATOM 0 HA GLU C 14 78.564 -8.850 12.003 1.00 0.00 H new ATOM 0 HB2 GLU C 14 78.449 -9.849 14.691 1.00 0.00 H new ATOM 0 HB3 GLU C 14 77.952 -8.170 14.760 1.00 0.00 H new ATOM 0 HG2 GLU C 14 75.969 -8.633 13.725 1.00 0.00 H new ATOM 0 HG3 GLU C 14 76.780 -9.451 12.405 1.00 0.00 H new ATOM 222 N GLU C 15 80.329 -6.944 14.050 1.00 0.00 N ATOM 223 CA GLU C 15 80.797 -5.578 14.273 1.00 0.00 C ATOM 224 C GLU C 15 81.261 -4.944 12.963 1.00 0.00 C ATOM 225 O GLU C 15 80.561 -4.119 12.376 1.00 0.00 O ATOM 226 CB GLU C 15 81.952 -5.568 15.278 1.00 0.00 C ATOM 227 CG GLU C 15 81.526 -6.304 16.550 1.00 0.00 C ATOM 228 CD GLU C 15 82.329 -5.780 17.735 1.00 0.00 C ATOM 229 OE1 GLU C 15 83.422 -6.278 17.952 1.00 0.00 O ATOM 230 OE2 GLU C 15 81.841 -4.887 18.407 1.00 0.00 O ATOM 0 H GLU C 15 80.726 -7.638 14.683 1.00 0.00 H new ATOM 0 HA GLU C 15 79.964 -4.999 14.672 1.00 0.00 H new ATOM 0 HB2 GLU C 15 82.830 -6.047 14.844 1.00 0.00 H new ATOM 0 HB3 GLU C 15 82.233 -4.542 15.515 1.00 0.00 H new ATOM 0 HG2 GLU C 15 80.460 -6.159 16.727 1.00 0.00 H new ATOM 0 HG3 GLU C 15 81.687 -7.376 16.434 1.00 0.00 H new ATOM 237 N GLN C 16 82.453 -5.330 12.514 1.00 0.00 N ATOM 238 CA GLN C 16 83.000 -4.777 11.270 1.00 0.00 C ATOM 239 C GLN C 16 81.894 -4.612 10.232 1.00 0.00 C ATOM 240 O GLN C 16 81.840 -3.611 9.517 1.00 0.00 O ATOM 241 CB GLN C 16 84.104 -5.667 10.667 1.00 0.00 C ATOM 242 CG GLN C 16 84.323 -6.923 11.516 1.00 0.00 C ATOM 243 CD GLN C 16 85.399 -7.792 10.876 1.00 0.00 C ATOM 244 OE1 GLN C 16 85.351 -9.018 10.970 1.00 0.00 O ATOM 245 NE2 GLN C 16 86.380 -7.226 10.226 1.00 0.00 N ATOM 0 H GLN C 16 83.052 -6.011 12.980 1.00 0.00 H new ATOM 0 HA GLN C 16 83.435 -3.811 11.525 1.00 0.00 H new ATOM 0 HB2 GLN C 16 83.831 -5.954 9.652 1.00 0.00 H new ATOM 0 HB3 GLN C 16 85.034 -5.103 10.599 1.00 0.00 H new ATOM 0 HG2 GLN C 16 84.621 -6.644 12.527 1.00 0.00 H new ATOM 0 HG3 GLN C 16 83.392 -7.483 11.601 1.00 0.00 H new ATOM 0 HE21 GLN C 16 86.421 -6.210 10.148 1.00 0.00 H new ATOM 0 HE22 GLN C 16 87.106 -7.800 9.797 1.00 0.00 H new ATOM 254 N LYS C 17 81.014 -5.606 10.154 1.00 0.00 N ATOM 255 CA LYS C 17 79.912 -5.562 9.195 1.00 0.00 C ATOM 256 C LYS C 17 79.087 -4.293 9.386 1.00 0.00 C ATOM 257 O LYS C 17 78.699 -3.636 8.419 1.00 0.00 O ATOM 258 CB LYS C 17 79.001 -6.779 9.371 1.00 0.00 C ATOM 259 CG LYS C 17 78.665 -7.372 8.001 1.00 0.00 C ATOM 260 CD LYS C 17 79.913 -8.031 7.409 1.00 0.00 C ATOM 261 CE LYS C 17 79.716 -9.547 7.365 1.00 0.00 C ATOM 262 NZ LYS C 17 79.807 -10.099 8.747 1.00 0.00 N ATOM 0 H LYS C 17 81.040 -6.443 10.736 1.00 0.00 H new ATOM 0 HA LYS C 17 80.339 -5.569 8.192 1.00 0.00 H new ATOM 0 HB2 LYS C 17 79.493 -7.528 9.992 1.00 0.00 H new ATOM 0 HB3 LYS C 17 78.086 -6.489 9.887 1.00 0.00 H new ATOM 0 HG2 LYS C 17 77.864 -8.106 8.097 1.00 0.00 H new ATOM 0 HG3 LYS C 17 78.303 -6.590 7.334 1.00 0.00 H new ATOM 0 HD2 LYS C 17 80.098 -7.648 6.405 1.00 0.00 H new ATOM 0 HD3 LYS C 17 80.788 -7.784 8.011 1.00 0.00 H new ATOM 0 HE2 LYS C 17 78.746 -9.786 6.929 1.00 0.00 H new ATOM 0 HE3 LYS C 17 80.473 -10.005 6.728 1.00 0.00 H new ATOM 0 HZ1 LYS C 17 78.997 -10.727 8.924 1.00 0.00 H new ATOM 0 HZ2 LYS C 17 80.691 -10.637 8.848 1.00 0.00 H new ATOM 0 HZ3 LYS C 17 79.796 -9.318 9.434 1.00 0.00 H new ATOM 276 N ASN C 18 78.824 -3.957 10.644 1.00 0.00 N ATOM 277 CA ASN C 18 78.042 -2.764 10.955 1.00 0.00 C ATOM 278 C ASN C 18 78.814 -1.506 10.569 1.00 0.00 C ATOM 279 O ASN C 18 78.455 -0.806 9.622 1.00 0.00 O ATOM 280 CB ASN C 18 77.717 -2.713 12.449 1.00 0.00 C ATOM 281 CG ASN C 18 77.175 -4.066 12.899 1.00 0.00 C ATOM 282 OD1 ASN C 18 76.674 -4.842 12.086 1.00 0.00 O ATOM 283 ND2 ASN C 18 77.245 -4.398 14.160 1.00 0.00 N ATOM 0 H ASN C 18 79.136 -4.487 11.458 1.00 0.00 H new ATOM 0 HA ASN C 18 77.115 -2.810 10.384 1.00 0.00 H new ATOM 0 HB2 ASN C 18 78.612 -2.460 13.018 1.00 0.00 H new ATOM 0 HB3 ASN C 18 76.983 -1.932 12.646 1.00 0.00 H new ATOM 0 HD21 ASN C 18 76.885 -5.300 14.471 1.00 0.00 H new ATOM 0 HD22 ASN C 18 77.660 -3.755 14.834 1.00 0.00 H new ATOM 290 N GLU C 19 79.879 -1.227 11.314 1.00 0.00 N ATOM 291 CA GLU C 19 80.697 -0.048 11.041 1.00 0.00 C ATOM 292 C GLU C 19 80.938 0.100 9.542 1.00 0.00 C ATOM 293 O GLU C 19 81.121 1.206 9.034 1.00 0.00 O ATOM 294 CB GLU C 19 82.047 -0.153 11.755 1.00 0.00 C ATOM 295 CG GLU C 19 82.636 -1.549 11.544 1.00 0.00 C ATOM 296 CD GLU C 19 83.862 -1.720 12.434 1.00 0.00 C ATOM 297 OE1 GLU C 19 83.693 -1.744 13.642 1.00 0.00 O ATOM 298 OE2 GLU C 19 84.951 -1.824 11.895 1.00 0.00 O ATOM 0 H GLU C 19 80.194 -1.793 12.102 1.00 0.00 H new ATOM 0 HA GLU C 19 80.159 0.825 11.410 1.00 0.00 H new ATOM 0 HB2 GLU C 19 82.732 0.603 11.371 1.00 0.00 H new ATOM 0 HB3 GLU C 19 81.922 0.042 12.820 1.00 0.00 H new ATOM 0 HG2 GLU C 19 81.892 -2.309 11.781 1.00 0.00 H new ATOM 0 HG3 GLU C 19 82.910 -1.686 10.498 1.00 0.00 H new ATOM 305 N PHE C 20 80.937 -1.031 8.841 1.00 0.00 N ATOM 306 CA PHE C 20 81.157 -1.023 7.397 1.00 0.00 C ATOM 307 C PHE C 20 79.931 -0.473 6.674 1.00 0.00 C ATOM 308 O PHE C 20 80.000 0.552 5.995 1.00 0.00 O ATOM 309 CB PHE C 20 81.439 -2.439 6.891 1.00 0.00 C ATOM 310 CG PHE C 20 82.927 -2.625 6.717 1.00 0.00 C ATOM 311 CD1 PHE C 20 83.661 -1.714 5.947 1.00 0.00 C ATOM 312 CD2 PHE C 20 83.572 -3.709 7.324 1.00 0.00 C ATOM 313 CE1 PHE C 20 85.042 -1.887 5.786 1.00 0.00 C ATOM 314 CE2 PHE C 20 84.952 -3.882 7.162 1.00 0.00 C ATOM 315 CZ PHE C 20 85.687 -2.971 6.393 1.00 0.00 C ATOM 0 H PHE C 20 80.788 -1.956 9.244 1.00 0.00 H new ATOM 0 HA PHE C 20 82.017 -0.386 7.191 1.00 0.00 H new ATOM 0 HB2 PHE C 20 81.050 -3.173 7.597 1.00 0.00 H new ATOM 0 HB3 PHE C 20 80.928 -2.606 5.943 1.00 0.00 H new ATOM 0 HD1 PHE C 20 83.163 -0.879 5.478 1.00 0.00 H new ATOM 0 HD2 PHE C 20 83.005 -4.412 7.917 1.00 0.00 H new ATOM 0 HE1 PHE C 20 85.609 -1.184 5.194 1.00 0.00 H new ATOM 0 HE2 PHE C 20 85.450 -4.718 7.630 1.00 0.00 H new ATOM 0 HZ PHE C 20 86.751 -3.105 6.268 1.00 0.00 H new ATOM 325 N LYS C 21 78.807 -1.167 6.827 1.00 0.00 N ATOM 326 CA LYS C 21 77.566 -0.742 6.184 1.00 0.00 C ATOM 327 C LYS C 21 77.427 0.773 6.251 1.00 0.00 C ATOM 328 O LYS C 21 77.218 1.438 5.237 1.00 0.00 O ATOM 329 CB LYS C 21 76.361 -1.385 6.870 1.00 0.00 C ATOM 330 CG LYS C 21 76.402 -2.896 6.650 1.00 0.00 C ATOM 331 CD LYS C 21 75.170 -3.330 5.852 1.00 0.00 C ATOM 332 CE LYS C 21 74.905 -4.818 6.089 1.00 0.00 C ATOM 333 NZ LYS C 21 75.958 -5.625 5.412 1.00 0.00 N ATOM 0 H LYS C 21 78.729 -2.018 7.384 1.00 0.00 H new ATOM 0 HA LYS C 21 77.600 -1.058 5.142 1.00 0.00 H new ATOM 0 HB2 LYS C 21 76.373 -1.161 7.937 1.00 0.00 H new ATOM 0 HB3 LYS C 21 75.436 -0.972 6.468 1.00 0.00 H new ATOM 0 HG2 LYS C 21 77.311 -3.172 6.115 1.00 0.00 H new ATOM 0 HG3 LYS C 21 76.428 -3.413 7.609 1.00 0.00 H new ATOM 0 HD2 LYS C 21 74.303 -2.743 6.154 1.00 0.00 H new ATOM 0 HD3 LYS C 21 75.327 -3.143 4.790 1.00 0.00 H new ATOM 0 HE2 LYS C 21 74.900 -5.031 7.158 1.00 0.00 H new ATOM 0 HE3 LYS C 21 73.921 -5.089 5.705 1.00 0.00 H new ATOM 0 HZ1 LYS C 21 75.548 -6.521 5.079 1.00 0.00 H new ATOM 0 HZ2 LYS C 21 76.335 -5.094 4.601 1.00 0.00 H new ATOM 0 HZ3 LYS C 21 76.727 -5.824 6.083 1.00 0.00 H new ATOM 347 N ALA C 22 77.550 1.315 7.457 1.00 0.00 N ATOM 348 CA ALA C 22 77.442 2.759 7.640 1.00 0.00 C ATOM 349 C ALA C 22 78.139 3.480 6.494 1.00 0.00 C ATOM 350 O ALA C 22 77.587 4.400 5.894 1.00 0.00 O ATOM 351 CB ALA C 22 78.080 3.185 8.962 1.00 0.00 C ATOM 0 H ALA C 22 77.722 0.786 8.312 1.00 0.00 H new ATOM 0 HA ALA C 22 76.385 3.023 7.654 1.00 0.00 H new ATOM 0 HB1 ALA C 22 77.989 4.265 9.079 1.00 0.00 H new ATOM 0 HB2 ALA C 22 77.573 2.686 9.788 1.00 0.00 H new ATOM 0 HB3 ALA C 22 79.134 2.908 8.963 1.00 0.00 H new ATOM 357 N ALA C 23 79.358 3.044 6.192 1.00 0.00 N ATOM 358 CA ALA C 23 80.123 3.653 5.109 1.00 0.00 C ATOM 359 C ALA C 23 79.488 3.330 3.762 1.00 0.00 C ATOM 360 O ALA C 23 79.499 4.149 2.843 1.00 0.00 O ATOM 361 CB ALA C 23 81.564 3.150 5.118 1.00 0.00 C ATOM 0 H ALA C 23 79.833 2.281 6.675 1.00 0.00 H new ATOM 0 HA ALA C 23 80.120 4.732 5.262 1.00 0.00 H new ATOM 0 HB1 ALA C 23 82.117 3.616 4.303 1.00 0.00 H new ATOM 0 HB2 ALA C 23 82.033 3.406 6.068 1.00 0.00 H new ATOM 0 HB3 ALA C 23 81.572 2.068 4.990 1.00 0.00 H new ATOM 367 N PHE C 24 78.926 2.130 3.654 1.00 0.00 N ATOM 368 CA PHE C 24 78.281 1.721 2.412 1.00 0.00 C ATOM 369 C PHE C 24 77.193 2.720 2.042 1.00 0.00 C ATOM 370 O PHE C 24 76.826 2.862 0.875 1.00 0.00 O ATOM 371 CB PHE C 24 77.666 0.327 2.557 1.00 0.00 C ATOM 372 CG PHE C 24 78.718 -0.709 2.248 1.00 0.00 C ATOM 373 CD1 PHE C 24 79.822 -0.859 3.095 1.00 0.00 C ATOM 374 CD2 PHE C 24 78.594 -1.514 1.110 1.00 0.00 C ATOM 375 CE1 PHE C 24 80.804 -1.812 2.803 1.00 0.00 C ATOM 376 CE2 PHE C 24 79.574 -2.469 0.820 1.00 0.00 C ATOM 377 CZ PHE C 24 80.680 -2.618 1.665 1.00 0.00 C ATOM 0 H PHE C 24 78.904 1.434 4.399 1.00 0.00 H new ATOM 0 HA PHE C 24 79.035 1.692 1.625 1.00 0.00 H new ATOM 0 HB2 PHE C 24 77.285 0.187 3.569 1.00 0.00 H new ATOM 0 HB3 PHE C 24 76.819 0.217 1.880 1.00 0.00 H new ATOM 0 HD1 PHE C 24 79.916 -0.239 3.974 1.00 0.00 H new ATOM 0 HD2 PHE C 24 77.742 -1.398 0.456 1.00 0.00 H new ATOM 0 HE1 PHE C 24 81.657 -1.926 3.455 1.00 0.00 H new ATOM 0 HE2 PHE C 24 79.477 -3.092 -0.057 1.00 0.00 H new ATOM 0 HZ PHE C 24 81.437 -3.354 1.439 1.00 0.00 H new ATOM 387 N ASP C 25 76.691 3.420 3.056 1.00 0.00 N ATOM 388 CA ASP C 25 75.650 4.419 2.841 1.00 0.00 C ATOM 389 C ASP C 25 76.269 5.767 2.478 1.00 0.00 C ATOM 390 O ASP C 25 75.561 6.743 2.236 1.00 0.00 O ATOM 391 CB ASP C 25 74.798 4.587 4.100 1.00 0.00 C ATOM 392 CG ASP C 25 73.595 3.654 4.029 1.00 0.00 C ATOM 393 OD1 ASP C 25 73.679 2.665 3.319 1.00 0.00 O ATOM 394 OD2 ASP C 25 72.608 3.940 4.685 1.00 0.00 O ATOM 0 H ASP C 25 76.986 3.315 4.027 1.00 0.00 H new ATOM 0 HA ASP C 25 75.021 4.074 2.020 1.00 0.00 H new ATOM 0 HB2 ASP C 25 75.392 4.364 4.986 1.00 0.00 H new ATOM 0 HB3 ASP C 25 74.465 5.621 4.191 1.00 0.00 H new ATOM 399 N ILE C 26 77.601 5.811 2.439 1.00 0.00 N ATOM 400 CA ILE C 26 78.298 7.048 2.096 1.00 0.00 C ATOM 401 C ILE C 26 79.005 6.893 0.755 1.00 0.00 C ATOM 402 O ILE C 26 79.118 7.842 -0.020 1.00 0.00 O ATOM 403 CB ILE C 26 79.337 7.432 3.156 1.00 0.00 C ATOM 404 CG1 ILE C 26 79.106 6.634 4.447 1.00 0.00 C ATOM 405 CG2 ILE C 26 79.223 8.930 3.450 1.00 0.00 C ATOM 406 CD1 ILE C 26 77.952 7.241 5.247 1.00 0.00 C ATOM 0 H ILE C 26 78.210 5.017 2.637 1.00 0.00 H new ATOM 0 HA ILE C 26 77.547 7.837 2.044 1.00 0.00 H new ATOM 0 HB ILE C 26 80.333 7.202 2.779 1.00 0.00 H new ATOM 0 HG12 ILE C 26 78.883 5.595 4.205 1.00 0.00 H new ATOM 0 HG13 ILE C 26 80.014 6.633 5.050 1.00 0.00 H new ATOM 0 HG21 ILE C 26 79.959 9.210 4.203 1.00 0.00 H new ATOM 0 HG22 ILE C 26 79.406 9.495 2.536 1.00 0.00 H new ATOM 0 HG23 ILE C 26 78.222 9.153 3.820 1.00 0.00 H new ATOM 0 HD11 ILE C 26 77.799 6.665 6.160 1.00 0.00 H new ATOM 0 HD12 ILE C 26 78.191 8.273 5.505 1.00 0.00 H new ATOM 0 HD13 ILE C 26 77.042 7.218 4.647 1.00 0.00 H new ATOM 418 N PHE C 27 79.479 5.678 0.494 1.00 0.00 N ATOM 419 CA PHE C 27 80.177 5.391 -0.755 1.00 0.00 C ATOM 420 C PHE C 27 79.218 5.515 -1.934 1.00 0.00 C ATOM 421 O PHE C 27 79.636 5.625 -3.086 1.00 0.00 O ATOM 422 CB PHE C 27 80.754 3.973 -0.732 1.00 0.00 C ATOM 423 CG PHE C 27 82.007 3.946 0.112 1.00 0.00 C ATOM 424 CD1 PHE C 27 82.008 4.524 1.389 1.00 0.00 C ATOM 425 CD2 PHE C 27 83.168 3.341 -0.382 1.00 0.00 C ATOM 426 CE1 PHE C 27 83.171 4.496 2.169 1.00 0.00 C ATOM 427 CE2 PHE C 27 84.330 3.313 0.398 1.00 0.00 C ATOM 428 CZ PHE C 27 84.332 3.891 1.674 1.00 0.00 C ATOM 0 H PHE C 27 79.393 4.882 1.126 1.00 0.00 H new ATOM 0 HA PHE C 27 80.988 6.111 -0.864 1.00 0.00 H new ATOM 0 HB2 PHE C 27 80.018 3.277 -0.329 1.00 0.00 H new ATOM 0 HB3 PHE C 27 80.980 3.646 -1.747 1.00 0.00 H new ATOM 0 HD1 PHE C 27 81.112 4.991 1.771 1.00 0.00 H new ATOM 0 HD2 PHE C 27 83.168 2.895 -1.366 1.00 0.00 H new ATOM 0 HE1 PHE C 27 83.172 4.941 3.153 1.00 0.00 H new ATOM 0 HE2 PHE C 27 85.225 2.846 0.016 1.00 0.00 H new ATOM 0 HZ PHE C 27 85.229 3.870 2.275 1.00 0.00 H new ATOM 438 N VAL C 28 77.925 5.494 -1.628 1.00 0.00 N ATOM 439 CA VAL C 28 76.905 5.604 -2.665 1.00 0.00 C ATOM 440 C VAL C 28 75.709 6.396 -2.146 1.00 0.00 C ATOM 441 O VAL C 28 74.579 6.216 -2.602 1.00 0.00 O ATOM 442 CB VAL C 28 76.441 4.213 -3.104 1.00 0.00 C ATOM 443 CG1 VAL C 28 77.661 3.315 -3.320 1.00 0.00 C ATOM 444 CG2 VAL C 28 75.550 3.602 -2.020 1.00 0.00 C ATOM 0 H VAL C 28 77.561 5.403 -0.680 1.00 0.00 H new ATOM 0 HA VAL C 28 77.339 6.124 -3.519 1.00 0.00 H new ATOM 0 HB VAL C 28 75.877 4.297 -4.033 1.00 0.00 H new ATOM 0 HG11 VAL C 28 77.332 2.324 -3.633 1.00 0.00 H new ATOM 0 HG12 VAL C 28 78.298 3.746 -4.092 1.00 0.00 H new ATOM 0 HG13 VAL C 28 78.223 3.234 -2.389 1.00 0.00 H new ATOM 0 HG21 VAL C 28 75.221 2.612 -2.335 1.00 0.00 H new ATOM 0 HG22 VAL C 28 76.113 3.519 -1.090 1.00 0.00 H new ATOM 0 HG23 VAL C 28 74.680 4.240 -1.862 1.00 0.00 H new ATOM 454 N LEU C 29 75.974 7.277 -1.185 1.00 0.00 N ATOM 455 CA LEU C 29 74.917 8.100 -0.604 1.00 0.00 C ATOM 456 C LEU C 29 74.210 8.896 -1.701 1.00 0.00 C ATOM 457 O LEU C 29 74.832 9.676 -2.421 1.00 0.00 O ATOM 458 CB LEU C 29 75.504 9.050 0.452 1.00 0.00 C ATOM 459 CG LEU C 29 76.078 10.305 -0.211 1.00 0.00 C ATOM 460 CD1 LEU C 29 74.976 11.358 -0.348 1.00 0.00 C ATOM 461 CD2 LEU C 29 77.208 10.865 0.656 1.00 0.00 C ATOM 0 H LEU C 29 76.902 7.439 -0.795 1.00 0.00 H new ATOM 0 HA LEU C 29 74.189 7.449 -0.119 1.00 0.00 H new ATOM 0 HB2 LEU C 29 74.730 9.331 1.166 1.00 0.00 H new ATOM 0 HB3 LEU C 29 76.286 8.539 1.014 1.00 0.00 H new ATOM 0 HG LEU C 29 76.465 10.051 -1.198 1.00 0.00 H new ATOM 0 HD11 LEU C 29 75.384 12.252 -0.820 1.00 0.00 H new ATOM 0 HD12 LEU C 29 74.167 10.961 -0.961 1.00 0.00 H new ATOM 0 HD13 LEU C 29 74.591 11.612 0.640 1.00 0.00 H new ATOM 0 HD21 LEU C 29 77.618 11.759 0.186 1.00 0.00 H new ATOM 0 HD22 LEU C 29 76.818 11.120 1.642 1.00 0.00 H new ATOM 0 HD23 LEU C 29 77.993 10.116 0.759 1.00 0.00 H new ATOM 473 N GLY C 30 72.904 8.679 -1.829 1.00 0.00 N ATOM 474 CA GLY C 30 72.125 9.373 -2.852 1.00 0.00 C ATOM 475 C GLY C 30 72.189 8.621 -4.180 1.00 0.00 C ATOM 476 O GLY C 30 71.450 8.922 -5.117 1.00 0.00 O ATOM 0 H GLY C 30 72.368 8.037 -1.246 1.00 0.00 H new ATOM 0 HA2 GLY C 30 71.088 9.463 -2.528 1.00 0.00 H new ATOM 0 HA3 GLY C 30 72.507 10.386 -2.983 1.00 0.00 H new ATOM 480 N ALA C 31 73.085 7.637 -4.247 1.00 0.00 N ATOM 481 CA ALA C 31 73.248 6.841 -5.463 1.00 0.00 C ATOM 482 C ALA C 31 71.904 6.291 -5.933 1.00 0.00 C ATOM 483 O ALA C 31 70.847 6.677 -5.434 1.00 0.00 O ATOM 484 CB ALA C 31 74.205 5.673 -5.211 1.00 0.00 C ATOM 0 H ALA C 31 73.704 7.373 -3.481 1.00 0.00 H new ATOM 0 HA ALA C 31 73.660 7.491 -6.235 1.00 0.00 H new ATOM 0 HB1 ALA C 31 74.316 5.090 -6.125 1.00 0.00 H new ATOM 0 HB2 ALA C 31 75.178 6.059 -4.906 1.00 0.00 H new ATOM 0 HB3 ALA C 31 73.803 5.037 -4.422 1.00 0.00 H new ATOM 490 N GLU C 32 71.963 5.386 -6.906 1.00 0.00 N ATOM 491 CA GLU C 32 70.753 4.783 -7.454 1.00 0.00 C ATOM 492 C GLU C 32 70.510 3.410 -6.833 1.00 0.00 C ATOM 493 O GLU C 32 69.369 2.969 -6.693 1.00 0.00 O ATOM 494 CB GLU C 32 70.882 4.631 -8.970 1.00 0.00 C ATOM 495 CG GLU C 32 69.491 4.513 -9.595 1.00 0.00 C ATOM 496 CD GLU C 32 69.548 4.962 -11.052 1.00 0.00 C ATOM 497 OE1 GLU C 32 70.644 5.187 -11.540 1.00 0.00 O ATOM 498 OE2 GLU C 32 68.495 5.073 -11.658 1.00 0.00 O ATOM 0 H GLU C 32 72.831 5.056 -7.329 1.00 0.00 H new ATOM 0 HA GLU C 32 69.912 5.436 -7.221 1.00 0.00 H new ATOM 0 HB2 GLU C 32 71.408 5.489 -9.388 1.00 0.00 H new ATOM 0 HB3 GLU C 32 71.475 3.748 -9.208 1.00 0.00 H new ATOM 0 HG2 GLU C 32 69.140 3.483 -9.534 1.00 0.00 H new ATOM 0 HG3 GLU C 32 68.779 5.126 -9.042 1.00 0.00 H new ATOM 505 N ASP C 33 71.598 2.739 -6.461 1.00 0.00 N ATOM 506 CA ASP C 33 71.492 1.414 -5.854 1.00 0.00 C ATOM 507 C ASP C 33 72.544 1.241 -4.762 1.00 0.00 C ATOM 508 O ASP C 33 72.257 1.399 -3.575 1.00 0.00 O ATOM 509 CB ASP C 33 71.677 0.317 -6.906 1.00 0.00 C ATOM 510 CG ASP C 33 72.571 0.826 -8.032 1.00 0.00 C ATOM 511 OD1 ASP C 33 73.707 1.170 -7.750 1.00 0.00 O ATOM 512 OD2 ASP C 33 72.107 0.864 -9.159 1.00 0.00 O ATOM 0 H ASP C 33 72.552 3.085 -6.567 1.00 0.00 H new ATOM 0 HA ASP C 33 70.497 1.327 -5.418 1.00 0.00 H new ATOM 0 HB2 ASP C 33 72.121 -0.567 -6.448 1.00 0.00 H new ATOM 0 HB3 ASP C 33 70.708 0.017 -7.306 1.00 0.00 H new ATOM 517 N GLY C 34 73.766 0.912 -5.174 1.00 0.00 N ATOM 518 CA GLY C 34 74.852 0.718 -4.218 1.00 0.00 C ATOM 519 C GLY C 34 76.202 0.709 -4.925 1.00 0.00 C ATOM 520 O GLY C 34 77.129 0.011 -4.516 1.00 0.00 O ATOM 0 H GLY C 34 74.027 0.776 -6.151 1.00 0.00 H new ATOM 0 HA2 GLY C 34 74.832 1.513 -3.473 1.00 0.00 H new ATOM 0 HA3 GLY C 34 74.709 -0.222 -3.685 1.00 0.00 H new ATOM 524 N CYS C 35 76.302 1.494 -5.994 1.00 0.00 N ATOM 525 CA CYS C 35 77.546 1.571 -6.755 1.00 0.00 C ATOM 526 C CYS C 35 78.423 2.703 -6.230 1.00 0.00 C ATOM 527 O CYS C 35 77.930 3.764 -5.848 1.00 0.00 O ATOM 528 CB CYS C 35 77.254 1.814 -8.236 1.00 0.00 C ATOM 529 SG CYS C 35 76.249 0.454 -8.883 1.00 0.00 S ATOM 0 H CYS C 35 75.547 2.080 -6.350 1.00 0.00 H new ATOM 0 HA CYS C 35 78.069 0.622 -6.639 1.00 0.00 H new ATOM 0 HB2 CYS C 35 76.729 2.761 -8.364 1.00 0.00 H new ATOM 0 HB3 CYS C 35 78.187 1.889 -8.794 1.00 0.00 H new ATOM 0 HG CYS C 35 74.989 0.726 -8.713 1.00 0.00 H new ATOM 535 N ILE C 36 79.731 2.462 -6.215 1.00 0.00 N ATOM 536 CA ILE C 36 80.676 3.466 -5.736 1.00 0.00 C ATOM 537 C ILE C 36 81.353 4.166 -6.909 1.00 0.00 C ATOM 538 O ILE C 36 82.515 3.903 -7.218 1.00 0.00 O ATOM 539 CB ILE C 36 81.750 2.819 -4.862 1.00 0.00 C ATOM 540 CG1 ILE C 36 81.085 1.902 -3.834 1.00 0.00 C ATOM 541 CG2 ILE C 36 82.539 3.908 -4.135 1.00 0.00 C ATOM 542 CD1 ILE C 36 82.160 1.215 -2.992 1.00 0.00 C ATOM 0 H ILE C 36 80.158 1.589 -6.526 1.00 0.00 H new ATOM 0 HA ILE C 36 80.118 4.195 -5.148 1.00 0.00 H new ATOM 0 HB ILE C 36 82.426 2.236 -5.488 1.00 0.00 H new ATOM 0 HG12 ILE C 36 80.420 2.480 -3.192 1.00 0.00 H new ATOM 0 HG13 ILE C 36 80.472 1.156 -4.339 1.00 0.00 H new ATOM 0 HG21 ILE C 36 83.305 3.447 -3.511 1.00 0.00 H new ATOM 0 HG22 ILE C 36 83.012 4.564 -4.866 1.00 0.00 H new ATOM 0 HG23 ILE C 36 81.863 4.490 -3.509 1.00 0.00 H new ATOM 0 HD11 ILE C 36 81.686 0.562 -2.259 1.00 0.00 H new ATOM 0 HD12 ILE C 36 82.807 0.624 -3.640 1.00 0.00 H new ATOM 0 HD13 ILE C 36 82.754 1.969 -2.475 1.00 0.00 H new ATOM 554 N SER C 37 80.618 5.064 -7.556 1.00 0.00 N ATOM 555 CA SER C 37 81.167 5.798 -8.691 1.00 0.00 C ATOM 556 C SER C 37 82.359 6.635 -8.241 1.00 0.00 C ATOM 557 O SER C 37 82.344 7.230 -7.163 1.00 0.00 O ATOM 558 CB SER C 37 80.110 6.719 -9.300 1.00 0.00 C ATOM 559 OG SER C 37 80.313 6.802 -10.705 1.00 0.00 O ATOM 0 H SER C 37 79.654 5.299 -7.319 1.00 0.00 H new ATOM 0 HA SER C 37 81.485 5.076 -9.443 1.00 0.00 H new ATOM 0 HB2 SER C 37 79.112 6.337 -9.087 1.00 0.00 H new ATOM 0 HB3 SER C 37 80.174 7.711 -8.852 1.00 0.00 H new ATOM 0 HG SER C 37 79.454 6.952 -11.151 1.00 0.00 H new ATOM 565 N THR C 38 83.394 6.672 -9.075 1.00 0.00 N ATOM 566 CA THR C 38 84.594 7.439 -8.748 1.00 0.00 C ATOM 567 C THR C 38 84.211 8.747 -8.067 1.00 0.00 C ATOM 568 O THR C 38 84.447 8.939 -6.875 1.00 0.00 O ATOM 569 CB THR C 38 85.394 7.761 -10.012 1.00 0.00 C ATOM 570 OG1 THR C 38 84.594 8.539 -10.891 1.00 0.00 O ATOM 571 CG2 THR C 38 85.806 6.463 -10.707 1.00 0.00 C ATOM 0 H THR C 38 83.428 6.187 -9.972 1.00 0.00 H new ATOM 0 HA THR C 38 85.205 6.834 -8.078 1.00 0.00 H new ATOM 0 HB THR C 38 86.289 8.322 -9.741 1.00 0.00 H new ATOM 0 HG1 THR C 38 85.105 8.748 -11.700 1.00 0.00 H new ATOM 0 HG21 THR C 38 86.375 6.697 -11.607 1.00 0.00 H new ATOM 0 HG22 THR C 38 86.422 5.868 -10.032 1.00 0.00 H new ATOM 0 HG23 THR C 38 84.915 5.897 -10.979 1.00 0.00 H new ATOM 579 N LYS C 39 83.617 9.643 -8.845 1.00 0.00 N ATOM 580 CA LYS C 39 83.198 10.938 -8.317 1.00 0.00 C ATOM 581 C LYS C 39 82.405 10.760 -7.024 1.00 0.00 C ATOM 582 O LYS C 39 82.448 11.608 -6.132 1.00 0.00 O ATOM 583 CB LYS C 39 82.330 11.678 -9.339 1.00 0.00 C ATOM 584 CG LYS C 39 81.477 10.671 -10.114 1.00 0.00 C ATOM 585 CD LYS C 39 80.092 11.268 -10.372 1.00 0.00 C ATOM 586 CE LYS C 39 79.056 10.144 -10.450 1.00 0.00 C ATOM 587 NZ LYS C 39 78.216 10.326 -11.668 1.00 0.00 N ATOM 0 H LYS C 39 83.415 9.501 -9.835 1.00 0.00 H new ATOM 0 HA LYS C 39 84.095 11.522 -8.112 1.00 0.00 H new ATOM 0 HB2 LYS C 39 81.689 12.399 -8.832 1.00 0.00 H new ATOM 0 HB3 LYS C 39 82.961 12.241 -10.027 1.00 0.00 H new ATOM 0 HG2 LYS C 39 81.959 10.421 -11.059 1.00 0.00 H new ATOM 0 HG3 LYS C 39 81.386 9.744 -9.548 1.00 0.00 H new ATOM 0 HD2 LYS C 39 79.830 11.963 -9.574 1.00 0.00 H new ATOM 0 HD3 LYS C 39 80.097 11.837 -11.302 1.00 0.00 H new ATOM 0 HE2 LYS C 39 79.556 9.176 -10.481 1.00 0.00 H new ATOM 0 HE3 LYS C 39 78.429 10.150 -9.558 1.00 0.00 H new ATOM 0 HZ1 LYS C 39 77.512 9.562 -11.721 1.00 0.00 H new ATOM 0 HZ2 LYS C 39 77.729 11.244 -11.620 1.00 0.00 H new ATOM 0 HZ3 LYS C 39 78.821 10.299 -12.514 1.00 0.00 H new ATOM 601 N GLU C 40 81.679 9.648 -6.931 1.00 0.00 N ATOM 602 CA GLU C 40 80.878 9.370 -5.740 1.00 0.00 C ATOM 603 C GLU C 40 81.778 9.044 -4.551 1.00 0.00 C ATOM 604 O GLU C 40 81.548 9.507 -3.434 1.00 0.00 O ATOM 605 CB GLU C 40 79.937 8.188 -5.991 1.00 0.00 C ATOM 606 CG GLU C 40 78.486 8.639 -5.806 1.00 0.00 C ATOM 607 CD GLU C 40 78.186 8.800 -4.320 1.00 0.00 C ATOM 608 OE1 GLU C 40 79.128 8.820 -3.544 1.00 0.00 O ATOM 609 OE2 GLU C 40 77.019 8.902 -3.979 1.00 0.00 O ATOM 0 H GLU C 40 81.628 8.932 -7.656 1.00 0.00 H new ATOM 0 HA GLU C 40 80.292 10.261 -5.516 1.00 0.00 H new ATOM 0 HB2 GLU C 40 80.083 7.802 -7.000 1.00 0.00 H new ATOM 0 HB3 GLU C 40 80.166 7.375 -5.302 1.00 0.00 H new ATOM 0 HG2 GLU C 40 78.319 9.583 -6.325 1.00 0.00 H new ATOM 0 HG3 GLU C 40 77.808 7.908 -6.247 1.00 0.00 H new ATOM 616 N LEU C 41 82.805 8.236 -4.804 1.00 0.00 N ATOM 617 CA LEU C 41 83.735 7.848 -3.747 1.00 0.00 C ATOM 618 C LEU C 41 84.545 9.051 -3.272 1.00 0.00 C ATOM 619 O LEU C 41 84.849 9.183 -2.086 1.00 0.00 O ATOM 620 CB LEU C 41 84.697 6.769 -4.249 1.00 0.00 C ATOM 621 CG LEU C 41 85.606 6.322 -3.104 1.00 0.00 C ATOM 622 CD1 LEU C 41 84.763 5.662 -2.010 1.00 0.00 C ATOM 623 CD2 LEU C 41 86.631 5.317 -3.633 1.00 0.00 C ATOM 0 H LEU C 41 83.013 7.841 -5.721 1.00 0.00 H new ATOM 0 HA LEU C 41 83.148 7.456 -2.916 1.00 0.00 H new ATOM 0 HB2 LEU C 41 84.136 5.918 -4.635 1.00 0.00 H new ATOM 0 HB3 LEU C 41 85.296 7.156 -5.073 1.00 0.00 H new ATOM 0 HG LEU C 41 86.123 7.188 -2.690 1.00 0.00 H new ATOM 0 HD11 LEU C 41 85.411 5.343 -1.194 1.00 0.00 H new ATOM 0 HD12 LEU C 41 84.031 6.377 -1.634 1.00 0.00 H new ATOM 0 HD13 LEU C 41 84.246 4.795 -2.422 1.00 0.00 H new ATOM 0 HD21 LEU C 41 87.280 4.997 -2.818 1.00 0.00 H new ATOM 0 HD22 LEU C 41 86.113 4.451 -4.045 1.00 0.00 H new ATOM 0 HD23 LEU C 41 87.231 5.786 -4.413 1.00 0.00 H new ATOM 635 N GLY C 42 84.895 9.924 -4.212 1.00 0.00 N ATOM 636 CA GLY C 42 85.676 11.114 -3.882 1.00 0.00 C ATOM 637 C GLY C 42 85.051 11.872 -2.715 1.00 0.00 C ATOM 638 O GLY C 42 85.718 12.652 -2.035 1.00 0.00 O ATOM 0 H GLY C 42 84.654 9.833 -5.199 1.00 0.00 H new ATOM 0 HA2 GLY C 42 86.696 10.825 -3.628 1.00 0.00 H new ATOM 0 HA3 GLY C 42 85.737 11.766 -4.753 1.00 0.00 H new ATOM 642 N LYS C 43 83.761 11.636 -2.493 1.00 0.00 N ATOM 643 CA LYS C 43 83.050 12.305 -1.408 1.00 0.00 C ATOM 644 C LYS C 43 83.459 11.719 -0.060 1.00 0.00 C ATOM 645 O LYS C 43 83.851 12.443 0.855 1.00 0.00 O ATOM 646 CB LYS C 43 81.538 12.147 -1.582 1.00 0.00 C ATOM 647 CG LYS C 43 80.930 13.483 -2.015 1.00 0.00 C ATOM 648 CD LYS C 43 80.122 14.074 -0.858 1.00 0.00 C ATOM 649 CE LYS C 43 79.324 15.281 -1.356 1.00 0.00 C ATOM 650 NZ LYS C 43 78.381 14.846 -2.426 1.00 0.00 N ATOM 0 H LYS C 43 83.192 10.993 -3.044 1.00 0.00 H new ATOM 0 HA LYS C 43 83.311 13.363 -1.438 1.00 0.00 H new ATOM 0 HB2 LYS C 43 81.325 11.380 -2.327 1.00 0.00 H new ATOM 0 HB3 LYS C 43 81.086 11.816 -0.647 1.00 0.00 H new ATOM 0 HG2 LYS C 43 81.719 14.174 -2.312 1.00 0.00 H new ATOM 0 HG3 LYS C 43 80.288 13.338 -2.884 1.00 0.00 H new ATOM 0 HD2 LYS C 43 79.447 13.322 -0.450 1.00 0.00 H new ATOM 0 HD3 LYS C 43 80.790 14.374 -0.050 1.00 0.00 H new ATOM 0 HE2 LYS C 43 78.772 15.731 -0.531 1.00 0.00 H new ATOM 0 HE3 LYS C 43 80.001 16.044 -1.741 1.00 0.00 H new ATOM 0 HZ1 LYS C 43 77.456 15.299 -2.279 1.00 0.00 H new ATOM 0 HZ2 LYS C 43 78.758 15.122 -3.355 1.00 0.00 H new ATOM 0 HZ3 LYS C 43 78.269 13.813 -2.391 1.00 0.00 H new ATOM 664 N VAL C 44 83.361 10.397 0.052 1.00 0.00 N ATOM 665 CA VAL C 44 83.722 9.717 1.295 1.00 0.00 C ATOM 666 C VAL C 44 85.142 10.087 1.714 1.00 0.00 C ATOM 667 O VAL C 44 85.368 10.575 2.820 1.00 0.00 O ATOM 668 CB VAL C 44 83.627 8.201 1.124 1.00 0.00 C ATOM 669 CG1 VAL C 44 84.142 7.511 2.389 1.00 0.00 C ATOM 670 CG2 VAL C 44 82.166 7.808 0.889 1.00 0.00 C ATOM 0 H VAL C 44 83.038 9.780 -0.693 1.00 0.00 H new ATOM 0 HA VAL C 44 83.023 10.037 2.068 1.00 0.00 H new ATOM 0 HB VAL C 44 84.231 7.892 0.271 1.00 0.00 H new ATOM 0 HG11 VAL C 44 84.074 6.430 2.267 1.00 0.00 H new ATOM 0 HG12 VAL C 44 85.181 7.792 2.560 1.00 0.00 H new ATOM 0 HG13 VAL C 44 83.538 7.818 3.243 1.00 0.00 H new ATOM 0 HG21 VAL C 44 82.095 6.727 0.767 1.00 0.00 H new ATOM 0 HG22 VAL C 44 81.564 8.117 1.744 1.00 0.00 H new ATOM 0 HG23 VAL C 44 81.797 8.300 -0.011 1.00 0.00 H new ATOM 680 N MET C 45 86.096 9.852 0.816 1.00 0.00 N ATOM 681 CA MET C 45 87.492 10.170 1.107 1.00 0.00 C ATOM 682 C MET C 45 87.579 11.477 1.886 1.00 0.00 C ATOM 683 O MET C 45 88.136 11.531 2.983 1.00 0.00 O ATOM 684 CB MET C 45 88.293 10.312 -0.189 1.00 0.00 C ATOM 685 CG MET C 45 88.546 8.928 -0.788 1.00 0.00 C ATOM 686 SD MET C 45 90.241 8.410 -0.420 1.00 0.00 S ATOM 687 CE MET C 45 89.872 7.487 1.092 1.00 0.00 C ATOM 0 H MET C 45 85.932 9.448 -0.106 1.00 0.00 H new ATOM 0 HA MET C 45 87.908 9.356 1.701 1.00 0.00 H new ATOM 0 HB2 MET C 45 87.748 10.933 -0.900 1.00 0.00 H new ATOM 0 HB3 MET C 45 89.241 10.812 0.010 1.00 0.00 H new ATOM 0 HG2 MET C 45 87.838 8.208 -0.378 1.00 0.00 H new ATOM 0 HG3 MET C 45 88.388 8.953 -1.866 1.00 0.00 H new ATOM 0 HE1 MET C 45 90.702 7.588 1.791 1.00 0.00 H new ATOM 0 HE2 MET C 45 88.964 7.882 1.547 1.00 0.00 H new ATOM 0 HE3 MET C 45 89.728 6.434 0.849 1.00 0.00 H new ATOM 697 N ARG C 46 87.017 12.528 1.302 1.00 0.00 N ATOM 698 CA ARG C 46 87.021 13.839 1.935 1.00 0.00 C ATOM 699 C ARG C 46 86.420 13.764 3.336 1.00 0.00 C ATOM 700 O ARG C 46 86.869 14.446 4.256 1.00 0.00 O ATOM 701 CB ARG C 46 86.208 14.823 1.097 1.00 0.00 C ATOM 702 CG ARG C 46 86.549 16.249 1.516 1.00 0.00 C ATOM 703 CD ARG C 46 85.296 16.930 2.067 1.00 0.00 C ATOM 704 NE ARG C 46 85.459 18.382 2.081 1.00 0.00 N ATOM 705 CZ ARG C 46 85.549 19.073 0.948 1.00 0.00 C ATOM 706 NH1 ARG C 46 85.502 18.454 -0.200 1.00 0.00 N ATOM 707 NH2 ARG C 46 85.686 20.370 0.985 1.00 0.00 N ATOM 0 H ARG C 46 86.554 12.498 0.394 1.00 0.00 H new ATOM 0 HA ARG C 46 88.054 14.178 2.008 1.00 0.00 H new ATOM 0 HB2 ARG C 46 86.425 14.682 0.038 1.00 0.00 H new ATOM 0 HB3 ARG C 46 85.142 14.638 1.231 1.00 0.00 H new ATOM 0 HG2 ARG C 46 87.334 16.240 2.273 1.00 0.00 H new ATOM 0 HG3 ARG C 46 86.935 16.808 0.663 1.00 0.00 H new ATOM 0 HD2 ARG C 46 84.433 16.662 1.457 1.00 0.00 H new ATOM 0 HD3 ARG C 46 85.096 16.572 3.077 1.00 0.00 H new ATOM 0 HE ARG C 46 85.504 18.873 2.974 1.00 0.00 H new ATOM 0 HH11 ARG C 46 85.396 17.440 -0.229 1.00 0.00 H new ATOM 0 HH12 ARG C 46 85.571 18.984 -1.069 1.00 0.00 H new ATOM 0 HH21 ARG C 46 85.724 20.853 1.882 1.00 0.00 H new ATOM 0 HH22 ARG C 46 85.755 20.901 0.117 1.00 0.00 H new ATOM 721 N MET C 47 85.393 12.930 3.484 1.00 0.00 N ATOM 722 CA MET C 47 84.729 12.776 4.777 1.00 0.00 C ATOM 723 C MET C 47 85.707 12.260 5.828 1.00 0.00 C ATOM 724 O MET C 47 85.562 12.537 7.019 1.00 0.00 O ATOM 725 CB MET C 47 83.558 11.796 4.667 1.00 0.00 C ATOM 726 CG MET C 47 82.516 12.350 3.693 1.00 0.00 C ATOM 727 SD MET C 47 81.228 13.220 4.620 1.00 0.00 S ATOM 728 CE MET C 47 80.770 11.853 5.715 1.00 0.00 C ATOM 0 H MET C 47 85.006 12.357 2.735 1.00 0.00 H new ATOM 0 HA MET C 47 84.358 13.756 5.077 1.00 0.00 H new ATOM 0 HB2 MET C 47 83.914 10.825 4.321 1.00 0.00 H new ATOM 0 HB3 MET C 47 83.108 11.640 5.647 1.00 0.00 H new ATOM 0 HG2 MET C 47 82.990 13.028 2.984 1.00 0.00 H new ATOM 0 HG3 MET C 47 82.077 11.538 3.113 1.00 0.00 H new ATOM 0 HE1 MET C 47 79.705 11.909 5.942 1.00 0.00 H new ATOM 0 HE2 MET C 47 80.987 10.905 5.223 1.00 0.00 H new ATOM 0 HE3 MET C 47 81.342 11.921 6.640 1.00 0.00 H new ATOM 738 N LEU C 48 86.703 11.504 5.376 1.00 0.00 N ATOM 739 CA LEU C 48 87.700 10.951 6.290 1.00 0.00 C ATOM 740 C LEU C 48 88.847 11.937 6.488 1.00 0.00 C ATOM 741 O LEU C 48 89.474 11.978 7.547 1.00 0.00 O ATOM 742 CB LEU C 48 88.263 9.635 5.745 1.00 0.00 C ATOM 743 CG LEU C 48 87.215 8.947 4.868 1.00 0.00 C ATOM 744 CD1 LEU C 48 87.645 7.505 4.593 1.00 0.00 C ATOM 745 CD2 LEU C 48 85.865 8.944 5.589 1.00 0.00 C ATOM 0 H LEU C 48 86.842 11.262 4.395 1.00 0.00 H new ATOM 0 HA LEU C 48 87.209 10.765 7.245 1.00 0.00 H new ATOM 0 HB2 LEU C 48 89.166 9.827 5.166 1.00 0.00 H new ATOM 0 HB3 LEU C 48 88.547 8.981 6.570 1.00 0.00 H new ATOM 0 HG LEU C 48 87.123 9.487 3.925 1.00 0.00 H new ATOM 0 HD11 LEU C 48 86.898 7.015 3.968 1.00 0.00 H new ATOM 0 HD12 LEU C 48 88.606 7.504 4.078 1.00 0.00 H new ATOM 0 HD13 LEU C 48 87.738 6.967 5.536 1.00 0.00 H new ATOM 0 HD21 LEU C 48 85.119 8.454 4.963 1.00 0.00 H new ATOM 0 HD22 LEU C 48 85.958 8.406 6.532 1.00 0.00 H new ATOM 0 HD23 LEU C 48 85.555 9.970 5.786 1.00 0.00 H new ATOM 757 N GLY C 49 89.113 12.731 5.456 1.00 0.00 N ATOM 758 CA GLY C 49 90.188 13.717 5.522 1.00 0.00 C ATOM 759 C GLY C 49 90.997 13.728 4.229 1.00 0.00 C ATOM 760 O GLY C 49 91.849 14.592 4.021 1.00 0.00 O ATOM 0 H GLY C 49 88.605 12.713 4.572 1.00 0.00 H new ATOM 0 HA2 GLY C 49 89.768 14.707 5.701 1.00 0.00 H new ATOM 0 HA3 GLY C 49 90.843 13.491 6.363 1.00 0.00 H new ATOM 764 N GLN C 50 90.718 12.761 3.359 1.00 0.00 N ATOM 765 CA GLN C 50 91.424 12.669 2.084 1.00 0.00 C ATOM 766 C GLN C 50 90.586 13.301 0.978 1.00 0.00 C ATOM 767 O GLN C 50 89.386 13.049 0.872 1.00 0.00 O ATOM 768 CB GLN C 50 91.704 11.208 1.724 1.00 0.00 C ATOM 769 CG GLN C 50 91.853 10.381 3.004 1.00 0.00 C ATOM 770 CD GLN C 50 92.822 11.079 3.952 1.00 0.00 C ATOM 771 OE1 GLN C 50 92.560 11.186 5.150 1.00 0.00 O ATOM 772 NE2 GLN C 50 93.939 11.565 3.483 1.00 0.00 N ATOM 0 H GLN C 50 90.016 12.037 3.511 1.00 0.00 H new ATOM 0 HA GLN C 50 92.371 13.200 2.181 1.00 0.00 H new ATOM 0 HB2 GLN C 50 90.891 10.811 1.116 1.00 0.00 H new ATOM 0 HB3 GLN C 50 92.613 11.138 1.127 1.00 0.00 H new ATOM 0 HG2 GLN C 50 90.883 10.258 3.485 1.00 0.00 H new ATOM 0 HG3 GLN C 50 92.219 9.383 2.764 1.00 0.00 H new ATOM 0 HE21 GLN C 50 94.157 11.477 2.490 1.00 0.00 H new ATOM 0 HE22 GLN C 50 94.594 12.033 4.109 1.00 0.00 H new ATOM 781 N ASN C 51 91.226 14.130 0.158 1.00 0.00 N ATOM 782 CA ASN C 51 90.516 14.795 -0.931 1.00 0.00 C ATOM 783 C ASN C 51 91.127 14.437 -2.282 1.00 0.00 C ATOM 784 O ASN C 51 91.836 15.239 -2.890 1.00 0.00 O ATOM 785 CB ASN C 51 90.560 16.313 -0.752 1.00 0.00 C ATOM 786 CG ASN C 51 89.331 16.936 -1.406 1.00 0.00 C ATOM 787 OD1 ASN C 51 88.631 17.740 -0.789 1.00 0.00 O ATOM 788 ND2 ASN C 51 89.024 16.610 -2.632 1.00 0.00 N ATOM 0 H ASN C 51 92.219 14.355 0.224 1.00 0.00 H new ATOM 0 HA ASN C 51 89.481 14.453 -0.905 1.00 0.00 H new ATOM 0 HB2 ASN C 51 90.588 16.565 0.308 1.00 0.00 H new ATOM 0 HB3 ASN C 51 91.468 16.717 -1.200 1.00 0.00 H new ATOM 0 HD21 ASN C 51 88.204 17.021 -3.079 1.00 0.00 H new ATOM 0 HD22 ASN C 51 89.604 15.944 -3.143 1.00 0.00 H new ATOM 795 N PRO C 52 90.840 13.232 -2.766 1.00 0.00 N ATOM 796 CA PRO C 52 91.345 12.760 -4.065 1.00 0.00 C ATOM 797 C PRO C 52 90.475 13.237 -5.226 1.00 0.00 C ATOM 798 O PRO C 52 89.375 13.752 -5.022 1.00 0.00 O ATOM 799 CB PRO C 52 91.260 11.247 -3.909 1.00 0.00 C ATOM 800 CG PRO C 52 90.202 10.967 -2.845 1.00 0.00 C ATOM 801 CD PRO C 52 89.996 12.261 -2.048 1.00 0.00 C ATOM 0 HA PRO C 52 92.343 13.131 -4.297 1.00 0.00 H new ATOM 0 HB2 PRO C 52 90.990 10.776 -4.854 1.00 0.00 H new ATOM 0 HB3 PRO C 52 92.224 10.835 -3.612 1.00 0.00 H new ATOM 0 HG2 PRO C 52 89.268 10.649 -3.308 1.00 0.00 H new ATOM 0 HG3 PRO C 52 90.524 10.159 -2.188 1.00 0.00 H new ATOM 0 HD2 PRO C 52 88.950 12.566 -2.038 1.00 0.00 H new ATOM 0 HD3 PRO C 52 90.305 12.148 -1.009 1.00 0.00 H new ATOM 809 N THR C 53 90.974 13.061 -6.446 1.00 0.00 N ATOM 810 CA THR C 53 90.224 13.481 -7.629 1.00 0.00 C ATOM 811 C THR C 53 89.520 12.280 -8.255 1.00 0.00 C ATOM 812 O THR C 53 89.650 11.152 -7.781 1.00 0.00 O ATOM 813 CB THR C 53 91.151 14.124 -8.674 1.00 0.00 C ATOM 814 OG1 THR C 53 91.397 13.199 -9.725 1.00 0.00 O ATOM 815 CG2 THR C 53 92.480 14.524 -8.029 1.00 0.00 C ATOM 0 H THR C 53 91.881 12.637 -6.642 1.00 0.00 H new ATOM 0 HA THR C 53 89.487 14.219 -7.313 1.00 0.00 H new ATOM 0 HB THR C 53 90.667 15.015 -9.073 1.00 0.00 H new ATOM 0 HG1 THR C 53 91.987 13.610 -10.391 1.00 0.00 H new ATOM 0 HG21 THR C 53 93.127 14.978 -8.780 1.00 0.00 H new ATOM 0 HG22 THR C 53 92.295 15.240 -7.229 1.00 0.00 H new ATOM 0 HG23 THR C 53 92.966 13.639 -7.619 1.00 0.00 H new ATOM 823 N PRO C 54 88.772 12.516 -9.330 1.00 0.00 N ATOM 824 CA PRO C 54 88.044 11.447 -10.034 1.00 0.00 C ATOM 825 C PRO C 54 88.953 10.648 -10.963 1.00 0.00 C ATOM 826 O PRO C 54 88.594 9.569 -11.436 1.00 0.00 O ATOM 827 CB PRO C 54 87.002 12.229 -10.822 1.00 0.00 C ATOM 828 CG PRO C 54 87.545 13.643 -10.997 1.00 0.00 C ATOM 829 CD PRO C 54 88.607 13.861 -9.913 1.00 0.00 C ATOM 0 HA PRO C 54 87.622 10.702 -9.359 1.00 0.00 H new ATOM 0 HB2 PRO C 54 86.821 11.763 -11.790 1.00 0.00 H new ATOM 0 HB3 PRO C 54 86.049 12.244 -10.292 1.00 0.00 H new ATOM 0 HG2 PRO C 54 87.978 13.768 -11.990 1.00 0.00 H new ATOM 0 HG3 PRO C 54 86.744 14.376 -10.903 1.00 0.00 H new ATOM 0 HD2 PRO C 54 89.541 14.235 -10.333 1.00 0.00 H new ATOM 0 HD3 PRO C 54 88.279 14.586 -9.168 1.00 0.00 H new ATOM 837 N GLU C 55 90.141 11.192 -11.210 1.00 0.00 N ATOM 838 CA GLU C 55 91.109 10.527 -12.075 1.00 0.00 C ATOM 839 C GLU C 55 91.853 9.450 -11.293 1.00 0.00 C ATOM 840 O GLU C 55 92.127 8.365 -11.806 1.00 0.00 O ATOM 841 CB GLU C 55 92.121 11.536 -12.623 1.00 0.00 C ATOM 842 CG GLU C 55 91.377 12.735 -13.214 1.00 0.00 C ATOM 843 CD GLU C 55 90.663 12.310 -14.493 1.00 0.00 C ATOM 844 OE1 GLU C 55 91.338 11.854 -15.401 1.00 0.00 O ATOM 845 OE2 GLU C 55 89.452 12.448 -14.546 1.00 0.00 O ATOM 0 H GLU C 55 90.454 12.084 -10.827 1.00 0.00 H new ATOM 0 HA GLU C 55 90.570 10.073 -12.906 1.00 0.00 H new ATOM 0 HB2 GLU C 55 92.789 11.865 -11.827 1.00 0.00 H new ATOM 0 HB3 GLU C 55 92.741 11.067 -13.387 1.00 0.00 H new ATOM 0 HG2 GLU C 55 90.656 13.120 -12.493 1.00 0.00 H new ATOM 0 HG3 GLU C 55 92.078 13.542 -13.427 1.00 0.00 H new ATOM 852 N GLU C 56 92.169 9.762 -10.038 1.00 0.00 N ATOM 853 CA GLU C 56 92.875 8.814 -9.182 1.00 0.00 C ATOM 854 C GLU C 56 91.912 7.744 -8.680 1.00 0.00 C ATOM 855 O GLU C 56 92.185 6.547 -8.775 1.00 0.00 O ATOM 856 CB GLU C 56 93.492 9.529 -7.979 1.00 0.00 C ATOM 857 CG GLU C 56 94.157 10.828 -8.440 1.00 0.00 C ATOM 858 CD GLU C 56 95.090 11.336 -7.346 1.00 0.00 C ATOM 859 OE1 GLU C 56 95.379 10.571 -6.440 1.00 0.00 O ATOM 860 OE2 GLU C 56 95.501 12.481 -7.430 1.00 0.00 O ATOM 0 H GLU C 56 91.950 10.655 -9.596 1.00 0.00 H new ATOM 0 HA GLU C 56 93.667 8.352 -9.771 1.00 0.00 H new ATOM 0 HB2 GLU C 56 92.723 9.746 -7.238 1.00 0.00 H new ATOM 0 HB3 GLU C 56 94.226 8.884 -7.497 1.00 0.00 H new ATOM 0 HG2 GLU C 56 94.717 10.656 -9.360 1.00 0.00 H new ATOM 0 HG3 GLU C 56 93.399 11.578 -8.664 1.00 0.00 H new ATOM 867 N LEU C 57 90.778 8.191 -8.145 1.00 0.00 N ATOM 868 CA LEU C 57 89.774 7.264 -7.630 1.00 0.00 C ATOM 869 C LEU C 57 89.571 6.113 -8.608 1.00 0.00 C ATOM 870 O LEU C 57 89.677 4.942 -8.242 1.00 0.00 O ATOM 871 CB LEU C 57 88.441 7.983 -7.413 1.00 0.00 C ATOM 872 CG LEU C 57 88.501 8.779 -6.108 1.00 0.00 C ATOM 873 CD1 LEU C 57 87.344 9.780 -6.063 1.00 0.00 C ATOM 874 CD2 LEU C 57 88.391 7.820 -4.920 1.00 0.00 C ATOM 0 H LEU C 57 90.533 9.177 -8.057 1.00 0.00 H new ATOM 0 HA LEU C 57 90.129 6.873 -6.676 1.00 0.00 H new ATOM 0 HB2 LEU C 57 88.234 8.650 -8.250 1.00 0.00 H new ATOM 0 HB3 LEU C 57 87.627 7.259 -7.374 1.00 0.00 H new ATOM 0 HG LEU C 57 89.448 9.317 -6.056 1.00 0.00 H new ATOM 0 HD11 LEU C 57 87.389 10.346 -5.133 1.00 0.00 H new ATOM 0 HD12 LEU C 57 87.422 10.464 -6.908 1.00 0.00 H new ATOM 0 HD13 LEU C 57 86.397 9.244 -6.116 1.00 0.00 H new ATOM 0 HD21 LEU C 57 88.434 8.387 -3.990 1.00 0.00 H new ATOM 0 HD22 LEU C 57 87.445 7.281 -4.974 1.00 0.00 H new ATOM 0 HD23 LEU C 57 89.216 7.108 -4.949 1.00 0.00 H new ATOM 886 N GLN C 58 89.288 6.457 -9.862 1.00 0.00 N ATOM 887 CA GLN C 58 89.086 5.440 -10.888 1.00 0.00 C ATOM 888 C GLN C 58 90.111 4.326 -10.714 1.00 0.00 C ATOM 889 O GLN C 58 89.771 3.143 -10.713 1.00 0.00 O ATOM 890 CB GLN C 58 89.231 6.046 -12.285 1.00 0.00 C ATOM 891 CG GLN C 58 88.994 4.963 -13.340 1.00 0.00 C ATOM 892 CD GLN C 58 87.555 5.044 -13.838 1.00 0.00 C ATOM 893 OE1 GLN C 58 87.052 6.129 -14.129 1.00 0.00 O ATOM 894 NE2 GLN C 58 86.853 3.948 -13.954 1.00 0.00 N ATOM 0 H GLN C 58 89.194 7.419 -10.188 1.00 0.00 H new ATOM 0 HA GLN C 58 88.079 5.037 -10.782 1.00 0.00 H new ATOM 0 HB2 GLN C 58 88.516 6.859 -12.416 1.00 0.00 H new ATOM 0 HB3 GLN C 58 90.226 6.474 -12.406 1.00 0.00 H new ATOM 0 HG2 GLN C 58 89.686 5.093 -14.172 1.00 0.00 H new ATOM 0 HG3 GLN C 58 89.188 3.978 -12.915 1.00 0.00 H new ATOM 0 HE21 GLN C 58 87.269 3.048 -13.713 1.00 0.00 H new ATOM 0 HE22 GLN C 58 85.889 3.992 -14.285 1.00 0.00 H new ATOM 903 N GLU C 59 91.371 4.721 -10.550 1.00 0.00 N ATOM 904 CA GLU C 59 92.441 3.748 -10.358 1.00 0.00 C ATOM 905 C GLU C 59 92.064 2.791 -9.234 1.00 0.00 C ATOM 906 O GLU C 59 92.247 1.578 -9.342 1.00 0.00 O ATOM 907 CB GLU C 59 93.752 4.452 -10.001 1.00 0.00 C ATOM 908 CG GLU C 59 94.849 4.014 -10.974 1.00 0.00 C ATOM 909 CD GLU C 59 95.696 2.922 -10.330 1.00 0.00 C ATOM 910 OE1 GLU C 59 95.667 2.816 -9.115 1.00 0.00 O ATOM 911 OE2 GLU C 59 96.362 2.207 -11.061 1.00 0.00 O ATOM 0 H GLU C 59 91.673 5.695 -10.546 1.00 0.00 H new ATOM 0 HA GLU C 59 92.578 3.196 -11.288 1.00 0.00 H new ATOM 0 HB2 GLU C 59 93.621 5.533 -10.047 1.00 0.00 H new ATOM 0 HB3 GLU C 59 94.040 4.209 -8.978 1.00 0.00 H new ATOM 0 HG2 GLU C 59 94.404 3.646 -11.898 1.00 0.00 H new ATOM 0 HG3 GLU C 59 95.475 4.866 -11.239 1.00 0.00 H new ATOM 918 N MET C 60 91.521 3.353 -8.158 1.00 0.00 N ATOM 919 CA MET C 60 91.101 2.543 -7.020 1.00 0.00 C ATOM 920 C MET C 60 89.891 1.703 -7.408 1.00 0.00 C ATOM 921 O MET C 60 89.623 0.658 -6.816 1.00 0.00 O ATOM 922 CB MET C 60 90.731 3.431 -5.829 1.00 0.00 C ATOM 923 CG MET C 60 91.891 4.378 -5.515 1.00 0.00 C ATOM 924 SD MET C 60 92.653 3.898 -3.946 1.00 0.00 S ATOM 925 CE MET C 60 91.557 4.845 -2.863 1.00 0.00 C ATOM 0 H MET C 60 91.363 4.355 -8.050 1.00 0.00 H new ATOM 0 HA MET C 60 91.930 1.896 -6.735 1.00 0.00 H new ATOM 0 HB2 MET C 60 89.832 4.004 -6.055 1.00 0.00 H new ATOM 0 HB3 MET C 60 90.506 2.814 -4.959 1.00 0.00 H new ATOM 0 HG2 MET C 60 92.630 4.344 -6.316 1.00 0.00 H new ATOM 0 HG3 MET C 60 91.531 5.405 -5.457 1.00 0.00 H new ATOM 0 HE1 MET C 60 91.851 4.693 -1.825 1.00 0.00 H new ATOM 0 HE2 MET C 60 91.629 5.904 -3.109 1.00 0.00 H new ATOM 0 HE3 MET C 60 90.529 4.509 -3.002 1.00 0.00 H new ATOM 935 N ILE C 61 89.165 2.177 -8.418 1.00 0.00 N ATOM 936 CA ILE C 61 87.983 1.469 -8.894 1.00 0.00 C ATOM 937 C ILE C 61 88.397 0.245 -9.705 1.00 0.00 C ATOM 938 O ILE C 61 87.747 -0.800 -9.657 1.00 0.00 O ATOM 939 CB ILE C 61 87.124 2.384 -9.771 1.00 0.00 C ATOM 940 CG1 ILE C 61 86.779 3.657 -8.994 1.00 0.00 C ATOM 941 CG2 ILE C 61 85.835 1.657 -10.157 1.00 0.00 C ATOM 942 CD1 ILE C 61 85.953 3.298 -7.759 1.00 0.00 C ATOM 0 H ILE C 61 89.373 3.041 -8.918 1.00 0.00 H new ATOM 0 HA ILE C 61 87.402 1.156 -8.027 1.00 0.00 H new ATOM 0 HB ILE C 61 87.677 2.647 -10.673 1.00 0.00 H new ATOM 0 HG12 ILE C 61 87.692 4.171 -8.696 1.00 0.00 H new ATOM 0 HG13 ILE C 61 86.220 4.343 -9.630 1.00 0.00 H new ATOM 0 HG21 ILE C 61 85.223 2.308 -10.781 1.00 0.00 H new ATOM 0 HG22 ILE C 61 86.080 0.750 -10.710 1.00 0.00 H new ATOM 0 HG23 ILE C 61 85.282 1.394 -9.255 1.00 0.00 H new ATOM 0 HD11 ILE C 61 85.709 4.206 -7.208 1.00 0.00 H new ATOM 0 HD12 ILE C 61 85.033 2.803 -8.068 1.00 0.00 H new ATOM 0 HD13 ILE C 61 86.528 2.629 -7.119 1.00 0.00 H new ATOM 954 N ASP C 62 89.492 0.388 -10.447 1.00 0.00 N ATOM 955 CA ASP C 62 89.997 -0.710 -11.267 1.00 0.00 C ATOM 956 C ASP C 62 90.323 -1.918 -10.394 1.00 0.00 C ATOM 957 O ASP C 62 90.457 -3.039 -10.885 1.00 0.00 O ATOM 958 CB ASP C 62 91.262 -0.282 -12.014 1.00 0.00 C ATOM 959 CG ASP C 62 90.878 0.560 -13.227 1.00 0.00 C ATOM 960 OD1 ASP C 62 89.745 1.010 -13.276 1.00 0.00 O ATOM 961 OD2 ASP C 62 91.723 0.743 -14.087 1.00 0.00 O ATOM 0 H ASP C 62 90.043 1.245 -10.498 1.00 0.00 H new ATOM 0 HA ASP C 62 89.223 -0.977 -11.986 1.00 0.00 H new ATOM 0 HB2 ASP C 62 91.912 0.290 -11.352 1.00 0.00 H new ATOM 0 HB3 ASP C 62 91.824 -1.160 -12.331 1.00 0.00 H new ATOM 966 N GLU C 63 90.445 -1.677 -9.091 1.00 0.00 N ATOM 967 CA GLU C 63 90.753 -2.753 -8.153 1.00 0.00 C ATOM 968 C GLU C 63 89.504 -3.580 -7.873 1.00 0.00 C ATOM 969 O GLU C 63 89.587 -4.751 -7.502 1.00 0.00 O ATOM 970 CB GLU C 63 91.279 -2.184 -6.834 1.00 0.00 C ATOM 971 CG GLU C 63 92.137 -0.948 -7.113 1.00 0.00 C ATOM 972 CD GLU C 63 93.499 -1.115 -6.448 1.00 0.00 C ATOM 973 OE1 GLU C 63 93.980 -2.235 -6.402 1.00 0.00 O ATOM 974 OE2 GLU C 63 94.040 -0.120 -5.995 1.00 0.00 O ATOM 0 H GLU C 63 90.337 -0.757 -8.664 1.00 0.00 H new ATOM 0 HA GLU C 63 91.519 -3.384 -8.603 1.00 0.00 H new ATOM 0 HB2 GLU C 63 90.446 -1.921 -6.182 1.00 0.00 H new ATOM 0 HB3 GLU C 63 91.868 -2.937 -6.311 1.00 0.00 H new ATOM 0 HG2 GLU C 63 92.259 -0.812 -8.188 1.00 0.00 H new ATOM 0 HG3 GLU C 63 91.642 -0.055 -6.733 1.00 0.00 H new ATOM 981 N VAL C 64 88.343 -2.957 -8.058 1.00 0.00 N ATOM 982 CA VAL C 64 87.077 -3.645 -7.825 1.00 0.00 C ATOM 983 C VAL C 64 86.310 -3.806 -9.134 1.00 0.00 C ATOM 984 O VAL C 64 85.466 -4.691 -9.272 1.00 0.00 O ATOM 985 CB VAL C 64 86.217 -2.866 -6.823 1.00 0.00 C ATOM 986 CG1 VAL C 64 87.100 -2.346 -5.689 1.00 0.00 C ATOM 987 CG2 VAL C 64 85.541 -1.682 -7.521 1.00 0.00 C ATOM 0 H VAL C 64 88.253 -1.988 -8.365 1.00 0.00 H new ATOM 0 HA VAL C 64 87.298 -4.630 -7.415 1.00 0.00 H new ATOM 0 HB VAL C 64 85.452 -3.530 -6.420 1.00 0.00 H new ATOM 0 HG11 VAL C 64 86.489 -1.792 -4.977 1.00 0.00 H new ATOM 0 HG12 VAL C 64 87.575 -3.187 -5.183 1.00 0.00 H new ATOM 0 HG13 VAL C 64 87.867 -1.688 -6.098 1.00 0.00 H new ATOM 0 HG21 VAL C 64 84.932 -1.135 -6.801 1.00 0.00 H new ATOM 0 HG22 VAL C 64 86.302 -1.019 -7.931 1.00 0.00 H new ATOM 0 HG23 VAL C 64 84.907 -2.049 -8.328 1.00 0.00 H new ATOM 997 N ASP C 65 86.613 -2.936 -10.092 1.00 0.00 N ATOM 998 CA ASP C 65 85.946 -2.982 -11.390 1.00 0.00 C ATOM 999 C ASP C 65 86.545 -4.081 -12.262 1.00 0.00 C ATOM 1000 O ASP C 65 87.374 -3.820 -13.134 1.00 0.00 O ATOM 1001 CB ASP C 65 86.088 -1.640 -12.112 1.00 0.00 C ATOM 1002 CG ASP C 65 84.739 -0.930 -12.135 1.00 0.00 C ATOM 1003 OD1 ASP C 65 84.125 -0.834 -11.086 1.00 0.00 O ATOM 1004 OD2 ASP C 65 84.340 -0.492 -13.202 1.00 0.00 O ATOM 0 H ASP C 65 87.309 -2.197 -9.997 1.00 0.00 H new ATOM 0 HA ASP C 65 84.891 -3.192 -11.217 1.00 0.00 H new ATOM 0 HB2 ASP C 65 86.829 -1.020 -11.607 1.00 0.00 H new ATOM 0 HB3 ASP C 65 86.445 -1.798 -13.130 1.00 0.00 H new ATOM 1009 N GLU C 66 86.113 -5.315 -12.016 1.00 0.00 N ATOM 1010 CA GLU C 66 86.609 -6.453 -12.786 1.00 0.00 C ATOM 1011 C GLU C 66 85.759 -6.658 -14.036 1.00 0.00 C ATOM 1012 O GLU C 66 86.252 -7.096 -15.076 1.00 0.00 O ATOM 1013 CB GLU C 66 86.567 -7.730 -11.946 1.00 0.00 C ATOM 1014 CG GLU C 66 87.911 -7.930 -11.245 1.00 0.00 C ATOM 1015 CD GLU C 66 87.982 -9.343 -10.675 1.00 0.00 C ATOM 1016 OE1 GLU C 66 87.024 -9.753 -10.040 1.00 0.00 O ATOM 1017 OE2 GLU C 66 88.992 -9.993 -10.882 1.00 0.00 O ATOM 0 H GLU C 66 85.428 -5.552 -11.298 1.00 0.00 H new ATOM 0 HA GLU C 66 87.639 -6.241 -13.072 1.00 0.00 H new ATOM 0 HB2 GLU C 66 85.767 -7.665 -11.208 1.00 0.00 H new ATOM 0 HB3 GLU C 66 86.346 -8.588 -12.581 1.00 0.00 H new ATOM 0 HG2 GLU C 66 88.728 -7.769 -11.949 1.00 0.00 H new ATOM 0 HG3 GLU C 66 88.029 -7.198 -10.446 1.00 0.00 H new ATOM 1024 N ASP C 67 84.473 -6.339 -13.918 1.00 0.00 N ATOM 1025 CA ASP C 67 83.551 -6.493 -15.040 1.00 0.00 C ATOM 1026 C ASP C 67 83.550 -5.243 -15.919 1.00 0.00 C ATOM 1027 O ASP C 67 82.853 -5.183 -16.932 1.00 0.00 O ATOM 1028 CB ASP C 67 82.131 -6.745 -14.531 1.00 0.00 C ATOM 1029 CG ASP C 67 81.770 -5.688 -13.493 1.00 0.00 C ATOM 1030 OD1 ASP C 67 82.436 -4.667 -13.460 1.00 0.00 O ATOM 1031 OD2 ASP C 67 80.834 -5.917 -12.744 1.00 0.00 O ATOM 0 H ASP C 67 84.048 -5.975 -13.065 1.00 0.00 H new ATOM 0 HA ASP C 67 83.886 -7.346 -15.631 1.00 0.00 H new ATOM 0 HB2 ASP C 67 81.424 -6.712 -15.360 1.00 0.00 H new ATOM 0 HB3 ASP C 67 82.061 -7.740 -14.092 1.00 0.00 H new ATOM 1036 N GLY C 68 84.340 -4.247 -15.524 1.00 0.00 N ATOM 1037 CA GLY C 68 84.423 -3.005 -16.288 1.00 0.00 C ATOM 1038 C GLY C 68 83.056 -2.336 -16.393 1.00 0.00 C ATOM 1039 O GLY C 68 82.672 -1.840 -17.452 1.00 0.00 O ATOM 0 H GLY C 68 84.925 -4.274 -14.689 1.00 0.00 H new ATOM 0 HA2 GLY C 68 85.129 -2.326 -15.809 1.00 0.00 H new ATOM 0 HA3 GLY C 68 84.808 -3.213 -17.286 1.00 0.00 H new ATOM 1043 N SER C 69 82.326 -2.325 -15.281 1.00 0.00 N ATOM 1044 CA SER C 69 81.002 -1.710 -15.259 1.00 0.00 C ATOM 1045 C SER C 69 81.102 -0.227 -14.909 1.00 0.00 C ATOM 1046 O SER C 69 80.114 0.505 -14.961 1.00 0.00 O ATOM 1047 CB SER C 69 80.106 -2.404 -14.233 1.00 0.00 C ATOM 1048 OG SER C 69 80.638 -2.199 -12.930 1.00 0.00 O ATOM 0 H SER C 69 82.624 -2.730 -14.393 1.00 0.00 H new ATOM 0 HA SER C 69 80.568 -1.818 -16.253 1.00 0.00 H new ATOM 0 HB2 SER C 69 79.092 -2.008 -14.291 1.00 0.00 H new ATOM 0 HB3 SER C 69 80.044 -3.470 -14.449 1.00 0.00 H new ATOM 1054 N GLY C 70 82.308 0.209 -14.551 1.00 0.00 N ATOM 1055 CA GLY C 70 82.525 1.608 -14.194 1.00 0.00 C ATOM 1056 C GLY C 70 81.777 1.964 -12.914 1.00 0.00 C ATOM 1057 O GLY C 70 81.346 3.101 -12.725 1.00 0.00 O ATOM 0 H GLY C 70 83.140 -0.379 -14.501 1.00 0.00 H new ATOM 0 HA2 GLY C 70 83.591 1.793 -14.061 1.00 0.00 H new ATOM 0 HA3 GLY C 70 82.189 2.252 -15.007 1.00 0.00 H new ATOM 1061 N THR C 71 81.628 0.975 -12.036 1.00 0.00 N ATOM 1062 CA THR C 71 80.930 1.191 -10.771 1.00 0.00 C ATOM 1063 C THR C 71 81.322 0.117 -9.760 1.00 0.00 C ATOM 1064 O THR C 71 82.011 -0.847 -10.095 1.00 0.00 O ATOM 1065 CB THR C 71 79.415 1.151 -10.983 1.00 0.00 C ATOM 1066 OG1 THR C 71 79.113 0.295 -12.076 1.00 0.00 O ATOM 1067 CG2 THR C 71 78.901 2.561 -11.280 1.00 0.00 C ATOM 0 H THR C 71 81.977 0.026 -12.174 1.00 0.00 H new ATOM 0 HA THR C 71 81.215 2.171 -10.389 1.00 0.00 H new ATOM 0 HB THR C 71 78.932 0.774 -10.081 1.00 0.00 H new ATOM 0 HG1 THR C 71 79.669 -0.510 -12.024 1.00 0.00 H new ATOM 0 HG21 THR C 71 77.822 2.531 -11.431 1.00 0.00 H new ATOM 0 HG22 THR C 71 79.132 3.217 -10.440 1.00 0.00 H new ATOM 0 HG23 THR C 71 79.383 2.942 -12.181 1.00 0.00 H new ATOM 1075 N VAL C 72 80.878 0.292 -8.518 1.00 0.00 N ATOM 1076 CA VAL C 72 81.196 -0.672 -7.467 1.00 0.00 C ATOM 1077 C VAL C 72 79.929 -1.138 -6.759 1.00 0.00 C ATOM 1078 O VAL C 72 79.546 -0.594 -5.723 1.00 0.00 O ATOM 1079 CB VAL C 72 82.138 -0.055 -6.433 1.00 0.00 C ATOM 1080 CG1 VAL C 72 82.772 -1.165 -5.591 1.00 0.00 C ATOM 1081 CG2 VAL C 72 83.238 0.730 -7.151 1.00 0.00 C ATOM 0 H VAL C 72 80.305 1.080 -8.217 1.00 0.00 H new ATOM 0 HA VAL C 72 81.683 -1.524 -7.941 1.00 0.00 H new ATOM 0 HB VAL C 72 81.575 0.616 -5.784 1.00 0.00 H new ATOM 0 HG11 VAL C 72 83.443 -0.724 -4.854 1.00 0.00 H new ATOM 0 HG12 VAL C 72 81.990 -1.726 -5.080 1.00 0.00 H new ATOM 0 HG13 VAL C 72 83.335 -1.837 -6.239 1.00 0.00 H new ATOM 0 HG21 VAL C 72 83.910 1.170 -6.415 1.00 0.00 H new ATOM 0 HG22 VAL C 72 83.800 0.058 -7.800 1.00 0.00 H new ATOM 0 HG23 VAL C 72 82.788 1.521 -7.751 1.00 0.00 H new ATOM 1091 N ASP C 73 79.289 -2.156 -7.324 1.00 0.00 N ATOM 1092 CA ASP C 73 78.069 -2.696 -6.732 1.00 0.00 C ATOM 1093 C ASP C 73 78.322 -3.079 -5.274 1.00 0.00 C ATOM 1094 O ASP C 73 79.312 -2.661 -4.673 1.00 0.00 O ATOM 1095 CB ASP C 73 77.597 -3.928 -7.510 1.00 0.00 C ATOM 1096 CG ASP C 73 78.675 -5.007 -7.469 1.00 0.00 C ATOM 1097 OD1 ASP C 73 79.442 -5.017 -6.521 1.00 0.00 O ATOM 1098 OD2 ASP C 73 78.718 -5.808 -8.388 1.00 0.00 O ATOM 0 H ASP C 73 79.590 -2.620 -8.181 1.00 0.00 H new ATOM 0 HA ASP C 73 77.294 -1.931 -6.777 1.00 0.00 H new ATOM 0 HB2 ASP C 73 76.671 -4.309 -7.079 1.00 0.00 H new ATOM 0 HB3 ASP C 73 77.380 -3.656 -8.543 1.00 0.00 H new ATOM 1103 N PHE C 74 77.420 -3.874 -4.708 1.00 0.00 N ATOM 1104 CA PHE C 74 77.561 -4.299 -3.318 1.00 0.00 C ATOM 1105 C PHE C 74 78.425 -5.555 -3.215 1.00 0.00 C ATOM 1106 O PHE C 74 78.599 -6.117 -2.134 1.00 0.00 O ATOM 1107 CB PHE C 74 76.187 -4.590 -2.710 1.00 0.00 C ATOM 1108 CG PHE C 74 76.317 -4.723 -1.213 1.00 0.00 C ATOM 1109 CD1 PHE C 74 76.221 -3.589 -0.398 1.00 0.00 C ATOM 1110 CD2 PHE C 74 76.533 -5.981 -0.639 1.00 0.00 C ATOM 1111 CE1 PHE C 74 76.342 -3.714 0.991 1.00 0.00 C ATOM 1112 CE2 PHE C 74 76.655 -6.106 0.749 1.00 0.00 C ATOM 1113 CZ PHE C 74 76.559 -4.972 1.564 1.00 0.00 C ATOM 0 H PHE C 74 76.592 -4.234 -5.183 1.00 0.00 H new ATOM 0 HA PHE C 74 78.043 -3.489 -2.771 1.00 0.00 H new ATOM 0 HB2 PHE C 74 75.492 -3.787 -2.955 1.00 0.00 H new ATOM 0 HB3 PHE C 74 75.777 -5.507 -3.133 1.00 0.00 H new ATOM 0 HD1 PHE C 74 76.054 -2.618 -0.841 1.00 0.00 H new ATOM 0 HD2 PHE C 74 76.606 -6.856 -1.268 1.00 0.00 H new ATOM 0 HE1 PHE C 74 76.268 -2.839 1.620 1.00 0.00 H new ATOM 0 HE2 PHE C 74 76.823 -7.077 1.191 1.00 0.00 H new ATOM 0 HZ PHE C 74 76.652 -5.068 2.636 1.00 0.00 H new ATOM 1123 N ASP C 75 78.962 -5.996 -4.348 1.00 0.00 N ATOM 1124 CA ASP C 75 79.800 -7.193 -4.359 1.00 0.00 C ATOM 1125 C ASP C 75 81.276 -6.827 -4.483 1.00 0.00 C ATOM 1126 O ASP C 75 82.096 -7.205 -3.647 1.00 0.00 O ATOM 1127 CB ASP C 75 79.416 -8.103 -5.527 1.00 0.00 C ATOM 1128 CG ASP C 75 78.609 -9.286 -5.005 1.00 0.00 C ATOM 1129 OD1 ASP C 75 78.271 -9.276 -3.833 1.00 0.00 O ATOM 1130 OD2 ASP C 75 78.341 -10.185 -5.785 1.00 0.00 O ATOM 0 H ASP C 75 78.836 -5.552 -5.258 1.00 0.00 H new ATOM 0 HA ASP C 75 79.639 -7.716 -3.416 1.00 0.00 H new ATOM 0 HB2 ASP C 75 78.832 -7.546 -6.260 1.00 0.00 H new ATOM 0 HB3 ASP C 75 80.312 -8.457 -6.036 1.00 0.00 H new ATOM 1135 N GLU C 76 81.605 -6.095 -5.542 1.00 0.00 N ATOM 1136 CA GLU C 76 82.993 -5.693 -5.775 1.00 0.00 C ATOM 1137 C GLU C 76 83.436 -4.644 -4.758 1.00 0.00 C ATOM 1138 O GLU C 76 84.613 -4.297 -4.680 1.00 0.00 O ATOM 1139 CB GLU C 76 83.182 -5.129 -7.191 1.00 0.00 C ATOM 1140 CG GLU C 76 81.923 -4.380 -7.637 1.00 0.00 C ATOM 1141 CD GLU C 76 82.230 -3.570 -8.892 1.00 0.00 C ATOM 1142 OE1 GLU C 76 83.395 -3.473 -9.241 1.00 0.00 O ATOM 1143 OE2 GLU C 76 81.295 -3.057 -9.485 1.00 0.00 O ATOM 0 H GLU C 76 80.942 -5.770 -6.246 1.00 0.00 H new ATOM 0 HA GLU C 76 83.607 -6.587 -5.664 1.00 0.00 H new ATOM 0 HB2 GLU C 76 84.040 -4.456 -7.210 1.00 0.00 H new ATOM 0 HB3 GLU C 76 83.397 -5.940 -7.887 1.00 0.00 H new ATOM 0 HG2 GLU C 76 81.118 -5.087 -7.836 1.00 0.00 H new ATOM 0 HG3 GLU C 76 81.578 -3.720 -6.841 1.00 0.00 H new ATOM 1150 N PHE C 77 82.484 -4.142 -3.976 1.00 0.00 N ATOM 1151 CA PHE C 77 82.802 -3.132 -2.969 1.00 0.00 C ATOM 1152 C PHE C 77 83.352 -3.789 -1.705 1.00 0.00 C ATOM 1153 O PHE C 77 84.533 -3.656 -1.383 1.00 0.00 O ATOM 1154 CB PHE C 77 81.553 -2.320 -2.613 1.00 0.00 C ATOM 1155 CG PHE C 77 81.896 -1.262 -1.587 1.00 0.00 C ATOM 1156 CD1 PHE C 77 83.230 -0.892 -1.366 1.00 0.00 C ATOM 1157 CD2 PHE C 77 80.873 -0.651 -0.854 1.00 0.00 C ATOM 1158 CE1 PHE C 77 83.536 0.088 -0.413 1.00 0.00 C ATOM 1159 CE2 PHE C 77 81.178 0.328 0.099 1.00 0.00 C ATOM 1160 CZ PHE C 77 82.510 0.698 0.319 1.00 0.00 C ATOM 0 H PHE C 77 81.501 -4.412 -4.017 1.00 0.00 H new ATOM 0 HA PHE C 77 83.558 -2.467 -3.386 1.00 0.00 H new ATOM 0 HB2 PHE C 77 81.147 -1.851 -3.509 1.00 0.00 H new ATOM 0 HB3 PHE C 77 80.780 -2.981 -2.221 1.00 0.00 H new ATOM 0 HD1 PHE C 77 84.022 -1.362 -1.930 1.00 0.00 H new ATOM 0 HD2 PHE C 77 79.845 -0.935 -1.024 1.00 0.00 H new ATOM 0 HE1 PHE C 77 84.564 0.373 -0.243 1.00 0.00 H new ATOM 0 HE2 PHE C 77 80.386 0.797 0.664 1.00 0.00 H new ATOM 0 HZ PHE C 77 82.746 1.454 1.053 1.00 0.00 H new ATOM 1170 N LEU C 78 82.484 -4.500 -0.993 1.00 0.00 N ATOM 1171 CA LEU C 78 82.889 -5.176 0.237 1.00 0.00 C ATOM 1172 C LEU C 78 84.288 -5.774 0.092 1.00 0.00 C ATOM 1173 O LEU C 78 85.240 -5.336 0.737 1.00 0.00 O ATOM 1174 CB LEU C 78 81.906 -6.302 0.570 1.00 0.00 C ATOM 1175 CG LEU C 78 80.711 -5.731 1.333 1.00 0.00 C ATOM 1176 CD1 LEU C 78 79.552 -6.728 1.285 1.00 0.00 C ATOM 1177 CD2 LEU C 78 81.108 -5.485 2.791 1.00 0.00 C ATOM 0 H LEU C 78 81.503 -4.623 -1.243 1.00 0.00 H new ATOM 0 HA LEU C 78 82.893 -4.437 1.038 1.00 0.00 H new ATOM 0 HB2 LEU C 78 81.568 -6.786 -0.346 1.00 0.00 H new ATOM 0 HB3 LEU C 78 82.402 -7.066 1.169 1.00 0.00 H new ATOM 0 HG LEU C 78 80.403 -4.791 0.875 1.00 0.00 H new ATOM 0 HD11 LEU C 78 78.699 -6.321 1.829 1.00 0.00 H new ATOM 0 HD12 LEU C 78 79.269 -6.907 0.248 1.00 0.00 H new ATOM 0 HD13 LEU C 78 79.861 -7.667 1.744 1.00 0.00 H new ATOM 0 HD21 LEU C 78 80.257 -5.078 3.336 1.00 0.00 H new ATOM 0 HD22 LEU C 78 81.415 -6.426 3.248 1.00 0.00 H new ATOM 0 HD23 LEU C 78 81.935 -4.776 2.828 1.00 0.00 H new ATOM 1189 N VAL C 79 84.388 -6.792 -0.756 1.00 0.00 N ATOM 1190 CA VAL C 79 85.660 -7.476 -0.986 1.00 0.00 C ATOM 1191 C VAL C 79 86.837 -6.500 -0.994 1.00 0.00 C ATOM 1192 O VAL C 79 87.745 -6.597 -0.168 1.00 0.00 O ATOM 1193 CB VAL C 79 85.627 -8.213 -2.325 1.00 0.00 C ATOM 1194 CG1 VAL C 79 86.937 -8.978 -2.518 1.00 0.00 C ATOM 1195 CG2 VAL C 79 84.455 -9.197 -2.336 1.00 0.00 C ATOM 0 H VAL C 79 83.606 -7.163 -1.296 1.00 0.00 H new ATOM 0 HA VAL C 79 85.798 -8.182 -0.167 1.00 0.00 H new ATOM 0 HB VAL C 79 85.505 -7.493 -3.134 1.00 0.00 H new ATOM 0 HG11 VAL C 79 86.914 -9.504 -3.473 1.00 0.00 H new ATOM 0 HG12 VAL C 79 87.772 -8.277 -2.509 1.00 0.00 H new ATOM 0 HG13 VAL C 79 87.060 -9.699 -1.710 1.00 0.00 H new ATOM 0 HG21 VAL C 79 84.431 -9.723 -3.290 1.00 0.00 H new ATOM 0 HG22 VAL C 79 84.577 -9.918 -1.527 1.00 0.00 H new ATOM 0 HG23 VAL C 79 83.521 -8.652 -2.198 1.00 0.00 H new ATOM 1205 N MET C 80 86.822 -5.578 -1.952 1.00 0.00 N ATOM 1206 CA MET C 80 87.906 -4.603 -2.085 1.00 0.00 C ATOM 1207 C MET C 80 88.469 -4.202 -0.718 1.00 0.00 C ATOM 1208 O MET C 80 89.670 -3.976 -0.574 1.00 0.00 O ATOM 1209 CB MET C 80 87.417 -3.358 -2.849 1.00 0.00 C ATOM 1210 CG MET C 80 86.941 -2.268 -1.878 1.00 0.00 C ATOM 1211 SD MET C 80 88.360 -1.288 -1.319 1.00 0.00 S ATOM 1212 CE MET C 80 89.001 -0.839 -2.952 1.00 0.00 C ATOM 0 H MET C 80 86.079 -5.483 -2.644 1.00 0.00 H new ATOM 0 HA MET C 80 88.709 -5.073 -2.652 1.00 0.00 H new ATOM 0 HB2 MET C 80 88.223 -2.969 -3.471 1.00 0.00 H new ATOM 0 HB3 MET C 80 86.603 -3.634 -3.519 1.00 0.00 H new ATOM 0 HG2 MET C 80 86.212 -1.623 -2.369 1.00 0.00 H new ATOM 0 HG3 MET C 80 86.441 -2.722 -1.023 1.00 0.00 H new ATOM 0 HE1 MET C 80 89.482 0.137 -2.898 1.00 0.00 H new ATOM 0 HE2 MET C 80 89.728 -1.584 -3.275 1.00 0.00 H new ATOM 0 HE3 MET C 80 88.179 -0.799 -3.667 1.00 0.00 H new ATOM 1222 N MET C 81 87.593 -4.111 0.278 1.00 0.00 N ATOM 1223 CA MET C 81 88.025 -3.730 1.622 1.00 0.00 C ATOM 1224 C MET C 81 88.711 -4.898 2.325 1.00 0.00 C ATOM 1225 O MET C 81 89.797 -4.751 2.885 1.00 0.00 O ATOM 1226 CB MET C 81 86.831 -3.276 2.464 1.00 0.00 C ATOM 1227 CG MET C 81 86.576 -1.787 2.225 1.00 0.00 C ATOM 1228 SD MET C 81 84.805 -1.448 2.373 1.00 0.00 S ATOM 1229 CE MET C 81 84.283 -2.310 0.869 1.00 0.00 C ATOM 0 H MET C 81 86.594 -4.293 0.185 1.00 0.00 H new ATOM 0 HA MET C 81 88.732 -2.907 1.518 1.00 0.00 H new ATOM 0 HB2 MET C 81 85.946 -3.854 2.201 1.00 0.00 H new ATOM 0 HB3 MET C 81 87.027 -3.457 3.521 1.00 0.00 H new ATOM 0 HG2 MET C 81 87.133 -1.191 2.948 1.00 0.00 H new ATOM 0 HG3 MET C 81 86.931 -1.501 1.235 1.00 0.00 H new ATOM 0 HE1 MET C 81 83.213 -2.168 0.721 1.00 0.00 H new ATOM 0 HE2 MET C 81 84.824 -1.908 0.013 1.00 0.00 H new ATOM 0 HE3 MET C 81 84.497 -3.374 0.967 1.00 0.00 H new ATOM 1239 N VAL C 82 88.064 -6.059 2.295 1.00 0.00 N ATOM 1240 CA VAL C 82 88.620 -7.246 2.940 1.00 0.00 C ATOM 1241 C VAL C 82 89.917 -7.675 2.254 1.00 0.00 C ATOM 1242 O VAL C 82 90.815 -8.237 2.881 1.00 0.00 O ATOM 1243 CB VAL C 82 87.607 -8.398 2.897 1.00 0.00 C ATOM 1244 CG1 VAL C 82 87.674 -9.119 1.546 1.00 0.00 C ATOM 1245 CG2 VAL C 82 87.920 -9.390 4.019 1.00 0.00 C ATOM 0 H VAL C 82 87.164 -6.204 1.837 1.00 0.00 H new ATOM 0 HA VAL C 82 88.838 -6.998 3.979 1.00 0.00 H new ATOM 0 HB VAL C 82 86.604 -7.992 3.030 1.00 0.00 H new ATOM 0 HG11 VAL C 82 86.949 -9.933 1.532 1.00 0.00 H new ATOM 0 HG12 VAL C 82 87.444 -8.415 0.746 1.00 0.00 H new ATOM 0 HG13 VAL C 82 88.676 -9.522 1.398 1.00 0.00 H new ATOM 0 HG21 VAL C 82 87.202 -10.210 3.991 1.00 0.00 H new ATOM 0 HG22 VAL C 82 88.927 -9.785 3.885 1.00 0.00 H new ATOM 0 HG23 VAL C 82 87.854 -8.883 4.982 1.00 0.00 H new ATOM 1255 N ARG C 83 89.994 -7.405 0.956 1.00 0.00 N ATOM 1256 CA ARG C 83 91.176 -7.767 0.176 1.00 0.00 C ATOM 1257 C ARG C 83 92.411 -7.017 0.670 1.00 0.00 C ATOM 1258 O ARG C 83 93.530 -7.526 0.599 1.00 0.00 O ATOM 1259 CB ARG C 83 90.957 -7.436 -1.301 1.00 0.00 C ATOM 1260 CG ARG C 83 91.203 -8.686 -2.148 1.00 0.00 C ATOM 1261 CD ARG C 83 90.544 -8.509 -3.517 1.00 0.00 C ATOM 1262 NE ARG C 83 90.635 -7.120 -3.956 1.00 0.00 N ATOM 1263 CZ ARG C 83 91.790 -6.608 -4.371 1.00 0.00 C ATOM 1264 NH1 ARG C 83 92.863 -7.349 -4.392 1.00 0.00 N ATOM 1265 NH2 ARG C 83 91.851 -5.363 -4.759 1.00 0.00 N ATOM 0 H ARG C 83 89.259 -6.940 0.423 1.00 0.00 H new ATOM 0 HA ARG C 83 91.336 -8.838 0.298 1.00 0.00 H new ATOM 0 HB2 ARG C 83 89.941 -7.073 -1.456 1.00 0.00 H new ATOM 0 HB3 ARG C 83 91.631 -6.637 -1.609 1.00 0.00 H new ATOM 0 HG2 ARG C 83 92.273 -8.854 -2.266 1.00 0.00 H new ATOM 0 HG3 ARG C 83 90.796 -9.564 -1.647 1.00 0.00 H new ATOM 0 HD2 ARG C 83 91.028 -9.159 -4.246 1.00 0.00 H new ATOM 0 HD3 ARG C 83 89.498 -8.812 -3.465 1.00 0.00 H new ATOM 0 HE ARG C 83 89.801 -6.534 -3.944 1.00 0.00 H new ATOM 0 HH11 ARG C 83 92.817 -8.322 -4.090 1.00 0.00 H new ATOM 0 HH12 ARG C 83 93.748 -6.955 -4.711 1.00 0.00 H new ATOM 0 HH21 ARG C 83 91.012 -4.782 -4.744 1.00 0.00 H new ATOM 0 HH22 ARG C 83 92.737 -4.971 -5.077 1.00 0.00 H new ATOM 1279 N CYS C 84 92.201 -5.802 1.167 1.00 0.00 N ATOM 1280 CA CYS C 84 93.313 -4.993 1.664 1.00 0.00 C ATOM 1281 C CYS C 84 93.612 -5.323 3.125 1.00 0.00 C ATOM 1282 O CYS C 84 94.518 -4.752 3.731 1.00 0.00 O ATOM 1283 CB CYS C 84 92.988 -3.503 1.548 1.00 0.00 C ATOM 1284 SG CYS C 84 92.368 -3.147 -0.115 1.00 0.00 S ATOM 0 H CYS C 84 91.285 -5.359 1.237 1.00 0.00 H new ATOM 0 HA CYS C 84 94.187 -5.224 1.056 1.00 0.00 H new ATOM 0 HB2 CYS C 84 92.243 -3.224 2.293 1.00 0.00 H new ATOM 0 HB3 CYS C 84 93.879 -2.909 1.750 1.00 0.00 H new ATOM 0 HG CYS C 84 91.282 -3.829 -0.328 1.00 0.00 H new ATOM 1290 N MET C 85 92.841 -6.251 3.684 1.00 0.00 N ATOM 1291 CA MET C 85 93.033 -6.648 5.075 1.00 0.00 C ATOM 1292 C MET C 85 94.235 -7.579 5.204 1.00 0.00 C ATOM 1293 O MET C 85 94.990 -7.510 6.174 1.00 0.00 O ATOM 1294 CB MET C 85 91.789 -7.365 5.600 1.00 0.00 C ATOM 1295 CG MET C 85 90.570 -6.455 5.442 1.00 0.00 C ATOM 1296 SD MET C 85 90.736 -5.028 6.543 1.00 0.00 S ATOM 1297 CE MET C 85 89.453 -4.006 5.778 1.00 0.00 C ATOM 0 H MET C 85 92.085 -6.738 3.202 1.00 0.00 H new ATOM 0 HA MET C 85 93.209 -5.746 5.662 1.00 0.00 H new ATOM 0 HB2 MET C 85 91.635 -8.295 5.053 1.00 0.00 H new ATOM 0 HB3 MET C 85 91.925 -7.630 6.649 1.00 0.00 H new ATOM 0 HG2 MET C 85 90.483 -6.122 4.408 1.00 0.00 H new ATOM 0 HG3 MET C 85 89.659 -7.005 5.677 1.00 0.00 H new ATOM 0 HE1 MET C 85 88.853 -3.533 6.555 1.00 0.00 H new ATOM 0 HE2 MET C 85 89.919 -3.237 5.162 1.00 0.00 H new ATOM 0 HE3 MET C 85 88.813 -4.631 5.155 1.00 0.00 H new ATOM 1307 N LYS C 86 94.401 -8.452 4.215 1.00 0.00 N ATOM 1308 CA LYS C 86 95.513 -9.399 4.227 1.00 0.00 C ATOM 1309 C LYS C 86 96.801 -8.723 3.766 1.00 0.00 C ATOM 1310 O LYS C 86 97.855 -8.877 4.385 1.00 0.00 O ATOM 1311 CB LYS C 86 95.216 -10.585 3.308 1.00 0.00 C ATOM 1312 CG LYS C 86 94.013 -11.361 3.848 1.00 0.00 C ATOM 1313 CD LYS C 86 92.727 -10.594 3.532 1.00 0.00 C ATOM 1314 CE LYS C 86 91.547 -11.566 3.495 1.00 0.00 C ATOM 1315 NZ LYS C 86 91.774 -12.582 2.429 1.00 0.00 N ATOM 0 H LYS C 86 93.788 -8.524 3.403 1.00 0.00 H new ATOM 0 HA LYS C 86 95.638 -9.754 5.250 1.00 0.00 H new ATOM 0 HB2 LYS C 86 95.011 -10.233 2.297 1.00 0.00 H new ATOM 0 HB3 LYS C 86 96.086 -11.239 3.247 1.00 0.00 H new ATOM 0 HG2 LYS C 86 93.976 -12.354 3.400 1.00 0.00 H new ATOM 0 HG3 LYS C 86 94.110 -11.501 4.925 1.00 0.00 H new ATOM 0 HD2 LYS C 86 92.555 -9.826 4.286 1.00 0.00 H new ATOM 0 HD3 LYS C 86 92.822 -10.084 2.573 1.00 0.00 H new ATOM 0 HE2 LYS C 86 91.436 -12.056 4.462 1.00 0.00 H new ATOM 0 HE3 LYS C 86 90.621 -11.024 3.304 1.00 0.00 H new ATOM 0 HZ1 LYS C 86 90.860 -12.873 2.026 1.00 0.00 H new ATOM 0 HZ2 LYS C 86 92.368 -12.173 1.680 1.00 0.00 H new ATOM 0 HZ3 LYS C 86 92.252 -13.411 2.836 1.00 0.00 H new ATOM 1329 N ASP C 87 96.708 -7.974 2.671 1.00 0.00 N ATOM 1330 CA ASP C 87 97.877 -7.280 2.133 1.00 0.00 C ATOM 1331 C ASP C 87 97.659 -5.770 2.147 1.00 0.00 C ATOM 1332 O ASP C 87 97.633 -5.121 1.101 1.00 0.00 O ATOM 1333 CB ASP C 87 98.154 -7.733 0.697 1.00 0.00 C ATOM 1334 CG ASP C 87 99.179 -8.862 0.707 1.00 0.00 C ATOM 1335 OD1 ASP C 87 99.949 -8.929 1.652 1.00 0.00 O ATOM 1336 OD2 ASP C 87 99.179 -9.643 -0.230 1.00 0.00 O ATOM 0 H ASP C 87 95.847 -7.832 2.143 1.00 0.00 H new ATOM 0 HA ASP C 87 98.732 -7.526 2.763 1.00 0.00 H new ATOM 0 HB2 ASP C 87 97.230 -8.071 0.227 1.00 0.00 H new ATOM 0 HB3 ASP C 87 98.525 -6.896 0.106 1.00 0.00 H new ATOM 1341 N ASP C 88 97.507 -5.216 3.347 1.00 0.00 N ATOM 1342 CA ASP C 88 97.295 -3.778 3.492 1.00 0.00 C ATOM 1343 C ASP C 88 98.427 -3.003 2.822 1.00 0.00 C ATOM 1344 O ASP C 88 99.389 -3.588 2.325 1.00 0.00 O ATOM 1345 CB ASP C 88 97.235 -3.393 4.972 1.00 0.00 C ATOM 1346 CG ASP C 88 98.418 -4.013 5.707 1.00 0.00 C ATOM 1347 OD1 ASP C 88 98.554 -5.225 5.655 1.00 0.00 O ATOM 1348 OD2 ASP C 88 99.173 -3.268 6.310 1.00 0.00 O ATOM 0 H ASP C 88 97.526 -5.734 4.225 1.00 0.00 H new ATOM 0 HA ASP C 88 96.349 -3.526 3.013 1.00 0.00 H new ATOM 0 HB2 ASP C 88 97.256 -2.308 5.078 1.00 0.00 H new ATOM 0 HB3 ASP C 88 96.299 -3.738 5.411 1.00 0.00 H new ATOM 1353 N SER C 89 98.298 -1.678 2.815 1.00 0.00 N ATOM 1354 CA SER C 89 99.315 -0.825 2.203 1.00 0.00 C ATOM 1355 C SER C 89 100.474 -0.602 3.169 1.00 0.00 C ATOM 1356 O SER C 89 100.994 0.502 3.194 1.00 0.00 O ATOM 1357 CB SER C 89 98.719 0.530 1.819 1.00 0.00 C ATOM 1358 OG SER C 89 98.642 1.354 2.975 1.00 0.00 O ATOM 1359 OXT SER C 89 100.826 -1.538 3.869 1.00 0.00 O ATOM 0 H SER C 89 97.509 -1.176 3.221 1.00 0.00 H new ATOM 0 HA SER C 89 99.679 -1.327 1.307 1.00 0.00 H new ATOM 0 HB2 SER C 89 99.335 1.009 1.058 1.00 0.00 H new ATOM 0 HB3 SER C 89 97.727 0.395 1.388 1.00 0.00 H new ATOM 0 HG SER C 89 99.547 1.566 3.286 1.00 0.00 H new TER 1365 SER C 89 ATOM 1366 N ARG I 147 96.218 2.959 6.100 1.00 0.00 N ATOM 1367 CA ARG I 147 95.075 3.649 6.765 1.00 0.00 C ATOM 1368 C ARG I 147 93.763 3.143 6.173 1.00 0.00 C ATOM 1369 O ARG I 147 92.848 3.920 5.899 1.00 0.00 O ATOM 1370 CB ARG I 147 95.189 5.158 6.539 1.00 0.00 C ATOM 1371 CG ARG I 147 94.670 5.900 7.772 1.00 0.00 C ATOM 1372 CD ARG I 147 94.432 7.370 7.421 1.00 0.00 C ATOM 1373 NE ARG I 147 95.422 8.224 8.074 1.00 0.00 N ATOM 1374 CZ ARG I 147 95.418 9.541 7.890 1.00 0.00 C ATOM 1375 NH1 ARG I 147 94.511 10.092 7.131 1.00 0.00 N ATOM 1376 NH2 ARG I 147 96.321 10.283 8.473 1.00 0.00 N ATOM 0 HA ARG I 147 95.096 3.440 7.835 1.00 0.00 H new ATOM 0 HB2 ARG I 147 96.227 5.430 6.348 1.00 0.00 H new ATOM 0 HB3 ARG I 147 94.616 5.449 5.659 1.00 0.00 H new ATOM 0 HG2 ARG I 147 93.743 5.444 8.121 1.00 0.00 H new ATOM 0 HG3 ARG I 147 95.390 5.822 8.586 1.00 0.00 H new ATOM 0 HD2 ARG I 147 94.485 7.504 6.341 1.00 0.00 H new ATOM 0 HD3 ARG I 147 93.429 7.665 7.730 1.00 0.00 H new ATOM 0 HE ARG I 147 96.127 7.804 8.680 1.00 0.00 H new ATOM 0 HH11 ARG I 147 93.804 9.512 6.678 1.00 0.00 H new ATOM 0 HH12 ARG I 147 94.509 11.102 6.990 1.00 0.00 H new ATOM 0 HH21 ARG I 147 97.028 9.852 9.069 1.00 0.00 H new ATOM 0 HH22 ARG I 147 96.319 11.293 8.333 1.00 0.00 H new ATOM 1392 N ILE I 148 93.684 1.830 5.982 1.00 0.00 N ATOM 1393 CA ILE I 148 92.481 1.220 5.423 1.00 0.00 C ATOM 1394 C ILE I 148 92.126 -0.044 6.197 1.00 0.00 C ATOM 1395 O ILE I 148 92.928 -0.972 6.299 1.00 0.00 O ATOM 1396 CB ILE I 148 92.698 0.864 3.949 1.00 0.00 C ATOM 1397 CG1 ILE I 148 91.477 0.109 3.413 1.00 0.00 C ATOM 1398 CG2 ILE I 148 93.940 -0.018 3.815 1.00 0.00 C ATOM 1399 CD1 ILE I 148 90.584 1.073 2.630 1.00 0.00 C ATOM 0 H ILE I 148 94.431 1.172 6.204 1.00 0.00 H new ATOM 0 HA ILE I 148 91.664 1.938 5.503 1.00 0.00 H new ATOM 0 HB ILE I 148 92.836 1.780 3.375 1.00 0.00 H new ATOM 0 HG12 ILE I 148 91.797 -0.711 2.770 1.00 0.00 H new ATOM 0 HG13 ILE I 148 90.918 -0.332 4.238 1.00 0.00 H new ATOM 0 HG21 ILE I 148 94.095 -0.272 2.766 1.00 0.00 H new ATOM 0 HG22 ILE I 148 94.810 0.520 4.191 1.00 0.00 H new ATOM 0 HG23 ILE I 148 93.801 -0.932 4.393 1.00 0.00 H new ATOM 0 HD11 ILE I 148 89.715 0.536 2.249 1.00 0.00 H new ATOM 0 HD12 ILE I 148 90.254 1.878 3.287 1.00 0.00 H new ATOM 0 HD13 ILE I 148 91.146 1.493 1.796 1.00 0.00 H new ATOM 1411 N SER I 149 90.915 -0.070 6.745 1.00 0.00 N ATOM 1412 CA SER I 149 90.465 -1.228 7.511 1.00 0.00 C ATOM 1413 C SER I 149 89.105 -0.957 8.146 1.00 0.00 C ATOM 1414 O SER I 149 88.177 -1.757 8.024 1.00 0.00 O ATOM 1415 CB SER I 149 91.470 -1.561 8.613 1.00 0.00 C ATOM 1416 OG SER I 149 90.906 -2.530 9.487 1.00 0.00 O ATOM 0 H SER I 149 90.235 0.687 6.675 1.00 0.00 H new ATOM 0 HA SER I 149 90.382 -2.071 6.825 1.00 0.00 H new ATOM 0 HB2 SER I 149 92.393 -1.942 8.176 1.00 0.00 H new ATOM 0 HB3 SER I 149 91.729 -0.660 9.169 1.00 0.00 H new ATOM 0 HG SER I 149 91.549 -2.747 10.194 1.00 0.00 H new ATOM 1422 N ALA I 150 88.996 0.181 8.829 1.00 0.00 N ATOM 1423 CA ALA I 150 87.741 0.545 9.483 1.00 0.00 C ATOM 1424 C ALA I 150 87.847 1.925 10.127 1.00 0.00 C ATOM 1425 O ALA I 150 86.979 2.779 9.946 1.00 0.00 O ATOM 1426 CB ALA I 150 87.389 -0.479 10.563 1.00 0.00 C ATOM 0 H ALA I 150 89.750 0.858 8.943 1.00 0.00 H new ATOM 0 HA ALA I 150 86.961 0.561 8.722 1.00 0.00 H new ATOM 0 HB1 ALA I 150 86.452 -0.195 11.042 1.00 0.00 H new ATOM 0 HB2 ALA I 150 87.281 -1.464 10.109 1.00 0.00 H new ATOM 0 HB3 ALA I 150 88.183 -0.509 11.309 1.00 0.00 H new ATOM 1432 N ASP I 151 88.918 2.129 10.887 1.00 0.00 N ATOM 1433 CA ASP I 151 89.133 3.406 11.566 1.00 0.00 C ATOM 1434 C ASP I 151 88.820 4.577 10.639 1.00 0.00 C ATOM 1435 O ASP I 151 88.095 5.502 11.007 1.00 0.00 O ATOM 1436 CB ASP I 151 90.584 3.520 12.040 1.00 0.00 C ATOM 1437 CG ASP I 151 90.684 3.067 13.492 1.00 0.00 C ATOM 1438 OD1 ASP I 151 90.088 2.053 13.818 1.00 0.00 O ATOM 1439 OD2 ASP I 151 91.355 3.740 14.258 1.00 0.00 O ATOM 0 H ASP I 151 89.647 1.434 11.049 1.00 0.00 H new ATOM 0 HA ASP I 151 88.462 3.441 12.424 1.00 0.00 H new ATOM 0 HB2 ASP I 151 91.232 2.908 11.412 1.00 0.00 H new ATOM 0 HB3 ASP I 151 90.928 4.550 11.945 1.00 0.00 H new ATOM 1444 N ALA I 152 89.383 4.533 9.435 1.00 0.00 N ATOM 1445 CA ALA I 152 89.165 5.603 8.464 1.00 0.00 C ATOM 1446 C ALA I 152 87.740 5.561 7.917 1.00 0.00 C ATOM 1447 O ALA I 152 87.279 6.507 7.278 1.00 0.00 O ATOM 1448 CB ALA I 152 90.149 5.475 7.299 1.00 0.00 C ATOM 0 H ALA I 152 89.987 3.778 9.110 1.00 0.00 H new ATOM 0 HA ALA I 152 89.324 6.552 8.976 1.00 0.00 H new ATOM 0 HB1 ALA I 152 89.974 6.279 6.585 1.00 0.00 H new ATOM 0 HB2 ALA I 152 91.170 5.541 7.676 1.00 0.00 H new ATOM 0 HB3 ALA I 152 90.006 4.514 6.806 1.00 0.00 H new ATOM 1454 N MET I 153 87.050 4.453 8.169 1.00 0.00 N ATOM 1455 CA MET I 153 85.677 4.297 7.690 1.00 0.00 C ATOM 1456 C MET I 153 84.686 4.927 8.666 1.00 0.00 C ATOM 1457 O MET I 153 83.825 5.715 8.276 1.00 0.00 O ATOM 1458 CB MET I 153 85.335 2.815 7.526 1.00 0.00 C ATOM 1459 CG MET I 153 86.426 2.123 6.707 1.00 0.00 C ATOM 1460 SD MET I 153 86.363 2.715 4.998 1.00 0.00 S ATOM 1461 CE MET I 153 84.613 2.361 4.701 1.00 0.00 C ATOM 0 H MET I 153 87.412 3.658 8.695 1.00 0.00 H new ATOM 0 HA MET I 153 85.603 4.801 6.726 1.00 0.00 H new ATOM 0 HB2 MET I 153 85.245 2.342 8.504 1.00 0.00 H new ATOM 0 HB3 MET I 153 84.370 2.707 7.030 1.00 0.00 H new ATOM 0 HG2 MET I 153 87.406 2.329 7.139 1.00 0.00 H new ATOM 0 HG3 MET I 153 86.286 1.042 6.734 1.00 0.00 H new ATOM 0 HE1 MET I 153 84.490 1.948 3.700 1.00 0.00 H new ATOM 0 HE2 MET I 153 84.258 1.640 5.437 1.00 0.00 H new ATOM 0 HE3 MET I 153 84.036 3.282 4.787 1.00 0.00 H new ATOM 1471 N MET I 154 84.812 4.560 9.938 1.00 0.00 N ATOM 1472 CA MET I 154 83.917 5.084 10.970 1.00 0.00 C ATOM 1473 C MET I 154 84.002 6.605 11.048 1.00 0.00 C ATOM 1474 O MET I 154 83.157 7.256 11.663 1.00 0.00 O ATOM 1475 CB MET I 154 84.283 4.500 12.335 1.00 0.00 C ATOM 1476 CG MET I 154 83.070 3.784 12.927 1.00 0.00 C ATOM 1477 SD MET I 154 82.861 4.282 14.654 1.00 0.00 S ATOM 1478 CE MET I 154 81.152 3.721 14.845 1.00 0.00 C ATOM 0 H MET I 154 85.518 3.908 10.279 1.00 0.00 H new ATOM 0 HA MET I 154 82.900 4.796 10.703 1.00 0.00 H new ATOM 0 HB2 MET I 154 85.115 3.803 12.233 1.00 0.00 H new ATOM 0 HB3 MET I 154 84.612 5.294 13.005 1.00 0.00 H new ATOM 0 HG2 MET I 154 82.175 4.029 12.356 1.00 0.00 H new ATOM 0 HG3 MET I 154 83.204 2.704 12.862 1.00 0.00 H new ATOM 0 HE1 MET I 154 80.810 3.933 15.858 1.00 0.00 H new ATOM 0 HE2 MET I 154 80.516 4.243 14.131 1.00 0.00 H new ATOM 0 HE3 MET I 154 81.099 2.648 14.661 1.00 0.00 H new ATOM 1488 N GLN I 155 85.034 7.165 10.428 1.00 0.00 N ATOM 1489 CA GLN I 155 85.223 8.613 10.444 1.00 0.00 C ATOM 1490 C GLN I 155 84.136 9.314 9.632 1.00 0.00 C ATOM 1491 O GLN I 155 83.697 10.411 9.976 1.00 0.00 O ATOM 1492 CB GLN I 155 86.591 8.976 9.862 1.00 0.00 C ATOM 1493 CG GLN I 155 87.474 9.567 10.962 1.00 0.00 C ATOM 1494 CD GLN I 155 88.626 10.341 10.331 1.00 0.00 C ATOM 1495 OE1 GLN I 155 88.929 11.461 10.742 1.00 0.00 O ATOM 1496 NE2 GLN I 155 89.295 9.805 9.348 1.00 0.00 N ATOM 0 H GLN I 155 85.746 6.647 9.913 1.00 0.00 H new ATOM 0 HA GLN I 155 85.164 8.945 11.481 1.00 0.00 H new ATOM 0 HB2 GLN I 155 87.064 8.090 9.438 1.00 0.00 H new ATOM 0 HB3 GLN I 155 86.474 9.694 9.050 1.00 0.00 H new ATOM 0 HG2 GLN I 155 86.886 10.226 11.600 1.00 0.00 H new ATOM 0 HG3 GLN I 155 87.862 8.771 11.598 1.00 0.00 H new ATOM 0 HE21 GLN I 155 89.045 8.877 9.007 1.00 0.00 H new ATOM 0 HE22 GLN I 155 90.069 10.314 8.920 1.00 0.00 H new ATOM 1505 N ALA I 156 83.717 8.673 8.545 1.00 0.00 N ATOM 1506 CA ALA I 156 82.689 9.249 7.679 1.00 0.00 C ATOM 1507 C ALA I 156 81.285 8.919 8.184 1.00 0.00 C ATOM 1508 O ALA I 156 80.296 9.464 7.693 1.00 0.00 O ATOM 1509 CB ALA I 156 82.839 8.718 6.252 1.00 0.00 C ATOM 0 H ALA I 156 84.068 7.764 8.243 1.00 0.00 H new ATOM 0 HA ALA I 156 82.822 10.331 7.690 1.00 0.00 H new ATOM 0 HB1 ALA I 156 82.067 9.155 5.618 1.00 0.00 H new ATOM 0 HB2 ALA I 156 83.822 8.987 5.865 1.00 0.00 H new ATOM 0 HB3 ALA I 156 82.735 7.633 6.255 1.00 0.00 H new ATOM 1515 N LEU I 157 81.200 8.017 9.161 1.00 0.00 N ATOM 1516 CA LEU I 157 79.896 7.632 9.703 1.00 0.00 C ATOM 1517 C LEU I 157 80.034 7.027 11.097 1.00 0.00 C ATOM 1518 O LEU I 157 79.760 5.845 11.307 1.00 0.00 O ATOM 1519 CB LEU I 157 79.190 6.623 8.784 1.00 0.00 C ATOM 1520 CG LEU I 157 80.195 5.633 8.172 1.00 0.00 C ATOM 1521 CD1 LEU I 157 81.057 6.344 7.129 1.00 0.00 C ATOM 1522 CD2 LEU I 157 81.094 5.049 9.265 1.00 0.00 C ATOM 0 H LEU I 157 81.999 7.547 9.586 1.00 0.00 H new ATOM 0 HA LEU I 157 79.296 8.540 9.766 1.00 0.00 H new ATOM 0 HB2 LEU I 157 78.436 6.077 9.350 1.00 0.00 H new ATOM 0 HB3 LEU I 157 78.668 7.155 7.988 1.00 0.00 H new ATOM 0 HG LEU I 157 79.642 4.824 7.694 1.00 0.00 H new ATOM 0 HD11 LEU I 157 81.766 5.636 6.700 1.00 0.00 H new ATOM 0 HD12 LEU I 157 80.419 6.742 6.340 1.00 0.00 H new ATOM 0 HD13 LEU I 157 81.601 7.161 7.603 1.00 0.00 H new ATOM 0 HD21 LEU I 157 81.801 4.350 8.819 1.00 0.00 H new ATOM 0 HD22 LEU I 157 81.641 5.854 9.755 1.00 0.00 H new ATOM 0 HD23 LEU I 157 80.481 4.527 10.000 1.00 0.00 H new ATOM 1534 N LEU I 158 80.451 7.852 12.052 1.00 0.00 N ATOM 1535 CA LEU I 158 80.612 7.385 13.426 1.00 0.00 C ATOM 1536 C LEU I 158 79.250 7.213 14.098 1.00 0.00 C ATOM 1537 O LEU I 158 79.161 6.755 15.238 1.00 0.00 O ATOM 1538 CB LEU I 158 81.448 8.379 14.237 1.00 0.00 C ATOM 1539 CG LEU I 158 82.337 7.615 15.220 1.00 0.00 C ATOM 1540 CD1 LEU I 158 83.773 7.585 14.695 1.00 0.00 C ATOM 1541 CD2 LEU I 158 82.310 8.314 16.582 1.00 0.00 C ATOM 0 H LEU I 158 80.681 8.835 11.904 1.00 0.00 H new ATOM 0 HA LEU I 158 81.124 6.423 13.394 1.00 0.00 H new ATOM 0 HB2 LEU I 158 82.062 8.984 13.570 1.00 0.00 H new ATOM 0 HB3 LEU I 158 80.795 9.064 14.778 1.00 0.00 H new ATOM 0 HG LEU I 158 81.966 6.595 15.325 1.00 0.00 H new ATOM 0 HD11 LEU I 158 84.405 7.040 15.396 1.00 0.00 H new ATOM 0 HD12 LEU I 158 83.795 7.088 13.725 1.00 0.00 H new ATOM 0 HD13 LEU I 158 84.143 8.605 14.589 1.00 0.00 H new ATOM 0 HD21 LEU I 158 82.943 7.770 17.283 1.00 0.00 H new ATOM 0 HD22 LEU I 158 82.680 9.334 16.475 1.00 0.00 H new ATOM 0 HD23 LEU I 158 81.288 8.337 16.959 1.00 0.00 H new ATOM 1553 N GLY I 159 78.189 7.582 13.381 1.00 0.00 N ATOM 1554 CA GLY I 159 76.836 7.460 13.922 1.00 0.00 C ATOM 1555 C GLY I 159 75.810 8.044 12.956 1.00 0.00 C ATOM 1556 O GLY I 159 75.409 9.202 13.079 1.00 0.00 O ATOM 0 H GLY I 159 78.238 7.963 12.436 1.00 0.00 H new ATOM 0 HA2 GLY I 159 76.608 6.411 14.110 1.00 0.00 H new ATOM 0 HA3 GLY I 159 76.775 7.976 14.880 1.00 0.00 H new ATOM 1560 N ALA I 160 75.389 7.228 11.994 1.00 0.00 N ATOM 1561 CA ALA I 160 74.407 7.670 11.007 1.00 0.00 C ATOM 1562 C ALA I 160 73.299 8.473 11.681 1.00 0.00 C ATOM 1563 O ALA I 160 73.281 9.702 11.626 1.00 0.00 O ATOM 1564 CB ALA I 160 73.786 6.467 10.297 1.00 0.00 C ATOM 0 H ALA I 160 75.708 6.266 11.876 1.00 0.00 H new ATOM 0 HA ALA I 160 74.920 8.298 10.279 1.00 0.00 H new ATOM 0 HB1 ALA I 160 73.057 6.813 9.565 1.00 0.00 H new ATOM 0 HB2 ALA I 160 74.567 5.900 9.791 1.00 0.00 H new ATOM 0 HB3 ALA I 160 73.291 5.829 11.029 1.00 0.00 H new ATOM 1570 N ARG I 161 72.374 7.760 12.316 1.00 0.00 N ATOM 1571 CA ARG I 161 71.260 8.411 13.000 1.00 0.00 C ATOM 1572 C ARG I 161 71.637 8.731 14.443 1.00 0.00 C ATOM 1573 O ARG I 161 70.907 8.403 15.378 1.00 0.00 O ATOM 1574 CB ARG I 161 70.028 7.504 12.997 1.00 0.00 C ATOM 1575 CG ARG I 161 68.763 8.363 12.970 1.00 0.00 C ATOM 1576 CD ARG I 161 68.163 8.347 11.563 1.00 0.00 C ATOM 1577 NE ARG I 161 67.879 6.978 11.137 1.00 0.00 N ATOM 1578 CZ ARG I 161 67.704 6.684 9.852 1.00 0.00 C ATOM 1579 NH1 ARG I 161 67.791 7.624 8.951 1.00 0.00 N ATOM 1580 NH2 ARG I 161 67.447 5.456 9.492 1.00 0.00 N ATOM 0 H ARG I 161 72.372 6.742 12.372 1.00 0.00 H new ATOM 0 HA ARG I 161 71.032 9.335 12.470 1.00 0.00 H new ATOM 0 HB2 ARG I 161 70.051 6.844 12.130 1.00 0.00 H new ATOM 0 HB3 ARG I 161 70.030 6.868 13.882 1.00 0.00 H new ATOM 0 HG2 ARG I 161 68.038 7.984 13.690 1.00 0.00 H new ATOM 0 HG3 ARG I 161 68.999 9.386 13.264 1.00 0.00 H new ATOM 0 HD2 ARG I 161 67.246 8.936 11.547 1.00 0.00 H new ATOM 0 HD3 ARG I 161 68.854 8.815 10.862 1.00 0.00 H new ATOM 0 HE ARG I 161 67.814 6.237 11.835 1.00 0.00 H new ATOM 0 HH11 ARG I 161 67.993 8.583 9.233 1.00 0.00 H new ATOM 0 HH12 ARG I 161 67.657 7.399 7.965 1.00 0.00 H new ATOM 0 HH21 ARG I 161 67.380 4.721 10.196 1.00 0.00 H new ATOM 0 HH22 ARG I 161 67.313 5.231 8.506 1.00 0.00 H new ATOM 1594 N ALA I 162 72.787 9.377 14.612 1.00 0.00 N ATOM 1595 CA ALA I 162 73.255 9.739 15.946 1.00 0.00 C ATOM 1596 C ALA I 162 72.634 11.060 16.388 1.00 0.00 C ATOM 1597 O ALA I 162 72.809 12.092 15.740 1.00 0.00 O ATOM 1598 CB ALA I 162 74.779 9.876 15.959 1.00 0.00 C ATOM 0 H ALA I 162 73.406 9.658 13.851 1.00 0.00 H new ATOM 0 HA ALA I 162 72.955 8.948 16.634 1.00 0.00 H new ATOM 0 HB1 ALA I 162 75.111 10.146 16.961 1.00 0.00 H new ATOM 0 HB2 ALA I 162 75.232 8.928 15.670 1.00 0.00 H new ATOM 0 HB3 ALA I 162 75.081 10.652 15.255 1.00 0.00 H new ATOM 1604 N LYS I 163 71.904 11.016 17.499 1.00 0.00 N ATOM 1605 CA LYS I 163 71.256 12.216 18.022 1.00 0.00 C ATOM 1606 C LYS I 163 70.430 11.877 19.259 1.00 0.00 C ATOM 1607 O LYS I 163 70.976 11.264 20.162 1.00 0.00 O ATOM 1608 CB LYS I 163 70.340 12.833 16.964 1.00 0.00 C ATOM 1609 CG LYS I 163 69.895 14.224 17.421 1.00 0.00 C ATOM 1610 CD LYS I 163 70.176 15.241 16.313 1.00 0.00 C ATOM 1611 CE LYS I 163 69.022 16.242 16.233 1.00 0.00 C ATOM 1612 NZ LYS I 163 69.557 17.591 15.895 1.00 0.00 N ATOM 1613 OXT LYS I 163 69.265 12.236 19.285 1.00 0.00 O ATOM 0 H LYS I 163 71.747 10.172 18.050 1.00 0.00 H new ATOM 0 HA LYS I 163 72.034 12.931 18.289 1.00 0.00 H new ATOM 0 HB2 LYS I 163 70.864 12.902 16.010 1.00 0.00 H new ATOM 0 HB3 LYS I 163 69.470 12.196 16.805 1.00 0.00 H new ATOM 0 HG2 LYS I 163 68.832 14.216 17.661 1.00 0.00 H new ATOM 0 HG3 LYS I 163 70.425 14.506 18.331 1.00 0.00 H new ATOM 0 HD2 LYS I 163 71.111 15.764 16.513 1.00 0.00 H new ATOM 0 HD3 LYS I 163 70.295 14.730 15.358 1.00 0.00 H new ATOM 0 HE2 LYS I 163 68.303 15.925 15.478 1.00 0.00 H new ATOM 0 HE3 LYS I 163 68.491 16.278 17.184 1.00 0.00 H new ATOM 0 HZ1 LYS I 163 68.773 18.272 15.841 1.00 0.00 H new ATOM 0 HZ2 LYS I 163 70.227 17.893 16.631 1.00 0.00 H new ATOM 0 HZ3 LYS I 163 70.045 17.551 14.977 1.00 0.00 H new TER 1627 LYS I 163 HETATM 1628 CA CA C 93 82.355 -2.990 -11.238 1.00 0.00 CA HETATM 1629 C1 BEP C 92 92.080 0.657 -1.502 1.00 0.00 C HETATM 1630 C2 BEP C 92 91.267 1.611 -0.622 1.00 0.00 C HETATM 1631 C3 BEP C 92 90.130 2.303 -1.456 1.00 0.00 C HETATM 1632 O1 BEP C 92 93.390 1.223 -1.757 1.00 0.00 O HETATM 1633 N2 BEP C 92 92.156 2.639 -0.008 1.00 0.00 N HETATM 1634 N3 BEP C 92 88.783 1.790 -1.080 1.00 0.00 N HETATM 1635 C4 BEP C 92 94.273 0.395 -2.555 1.00 0.00 C HETATM 1636 C5 BEP C 92 95.707 0.543 -2.039 1.00 0.00 C HETATM 1637 C6 BEP C 92 96.626 -0.410 -2.806 1.00 0.00 C HETATM 1638 C7 BEP C 92 95.750 0.201 -0.548 1.00 0.00 C HETATM 1639 C8 BEP C 92 91.522 3.807 0.665 1.00 0.00 C HETATM 1640 C9 BEP C 92 92.403 4.100 1.891 1.00 0.00 C HETATM 1641 C10 BEP C 92 93.731 3.399 1.572 1.00 0.00 C HETATM 1642 C11 BEP C 92 93.314 2.170 0.787 1.00 0.00 C HETATM 1643 C12 BEP C 92 88.272 2.116 0.282 1.00 0.00 C HETATM 1644 C13 BEP C 92 87.814 3.578 0.525 1.00 0.00 C HETATM 1645 C14 BEP C 92 87.687 4.462 -0.554 1.00 0.00 C HETATM 1646 C15 BEP C 92 87.273 5.782 -0.332 1.00 0.00 C HETATM 1647 C16 BEP C 92 86.987 6.216 0.969 1.00 0.00 C HETATM 1648 C17 BEP C 92 87.115 5.332 2.048 1.00 0.00 C HETATM 1649 C18 BEP C 92 87.529 4.013 1.826 1.00 0.00 C HETATM 1650 C19 BEP C 92 87.777 1.749 -2.164 1.00 0.00 C HETATM 1651 C20 BEP C 92 86.593 1.019 -1.996 1.00 0.00 C HETATM 1652 C21 BEP C 92 85.642 0.981 -3.025 1.00 0.00 C HETATM 1653 C22 BEP C 92 85.875 1.674 -4.220 1.00 0.00 C HETATM 1654 C23 BEP C 92 87.058 2.404 -4.387 1.00 0.00 C HETATM 1655 C24 BEP C 92 88.009 2.443 -3.359 1.00 0.00 C HETATM 0 H241 BEP C 92 88.929 3.013 -3.489 1.00 0.00 H new HETATM 0 H231 BEP C 92 87.239 2.942 -5.317 1.00 0.00 H new HETATM 0 H221 BEP C 92 85.135 1.645 -5.020 1.00 0.00 H new HETATM 0 H211 BEP C 92 84.721 0.412 -2.895 1.00 0.00 H new HETATM 0 H201 BEP C 92 86.412 0.481 -1.066 1.00 0.00 H new HETATM 0 H181 BEP C 92 87.630 3.325 2.665 1.00 0.00 H new HETATM 0 H171 BEP C 92 86.892 5.671 3.060 1.00 0.00 H new HETATM 0 H161 BEP C 92 86.665 7.243 1.142 1.00 0.00 H new HETATM 0 H151 BEP C 92 87.174 6.471 -1.171 1.00 0.00 H new HETATM 0 H141 BEP C 92 87.910 4.123 -1.566 1.00 0.00 H new HETATM 0 H122 BEP C 92 87.431 1.456 0.496 1.00 0.00 H new HETATM 0 H121 BEP C 92 89.054 1.880 1.004 1.00 0.00 H new HETATM 0 H112 BEP C 92 93.040 1.347 1.447 1.00 0.00 H new HETATM 0 H111 BEP C 92 94.120 1.811 0.147 1.00 0.00 H new HETATM 0 H102 BEP C 92 94.392 4.041 0.989 1.00 0.00 H new HETATM 0 H101 BEP C 92 94.269 3.129 2.481 1.00 0.00 H new HETATM 0 H92 BEP C 92 92.542 5.171 2.035 1.00 0.00 H new HETATM 0 H91 BEP C 92 91.956 3.711 2.806 1.00 0.00 H new HETATM 0 H82 BEP C 92 91.478 4.668 -0.002 1.00 0.00 H new HETATM 0 H81 BEP C 92 90.498 3.581 0.962 1.00 0.00 H new HETATM 0 H73 BEP C 92 95.095 0.879 -0.000 1.00 0.00 H new HETATM 0 H72 BEP C 92 95.415 -0.826 -0.400 1.00 0.00 H new HETATM 0 H71 BEP C 92 96.771 0.306 -0.180 1.00 0.00 H new HETATM 0 H63 BEP C 92 96.291 -1.437 -2.658 1.00 0.00 H new HETATM 0 H62 BEP C 92 96.596 -0.168 -3.868 1.00 0.00 H new HETATM 0 H61 BEP C 92 97.647 -0.305 -2.439 1.00 0.00 H new HETATM 0 H51 BEP C 92 96.042 1.570 -2.187 1.00 0.00 H new HETATM 0 H42 BEP C 92 93.960 -0.648 -2.501 1.00 0.00 H new HETATM 0 H41 BEP C 92 94.219 0.690 -3.603 1.00 0.00 H new HETATM 0 H32 BEP C 92 90.167 3.381 -1.297 1.00 0.00 H new HETATM 0 H31 BEP C 92 90.302 2.131 -2.519 1.00 0.00 H new HETATM 0 H21 BEP C 92 90.804 1.029 0.175 1.00 0.00 H new HETATM 0 H12 BEP C 92 92.181 -0.310 -1.010 1.00 0.00 H new HETATM 0 H11 BEP C 92 91.559 0.483 -2.444 1.00 0.00 H new