USER MOD reduce.3.24.130724 H: found=0, std=0, add=803, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 803 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: I 7 MET CE :methyl -167:sc= -12.3! (180deg=-9.99!) USER MOD Set 1.2: I 8 MET CE :methyl -130:sc= -6.27 (180deg=-5.86!) USER MOD Set 2.1: C 69 SER OG : rot -94:sc= 0.754 USER MOD Set 2.2: C 71 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: C 60 MET CE :methyl -124:sc= -2.39 (180deg=-4.31!) USER MOD Set 3.2: I 1 ARG N :NH3+ -128:sc= -1.41! (180deg=-2.26!) USER MOD Single : C 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 1 MET N :NH3+ -160:sc= 0 (180deg=-0.412) 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= -0.691 X(o=-0.69,f=-0.21) USER MOD Single : C 13 THR OG1 : rot 180:sc= -3.12! USER MOD Single : C 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : C 17 LYS NZ :NH3+ 162:sc= -0.0551 (180deg=-0.329) USER MOD Single : C 18 ASN : amide:sc= -4.47! C(o=-4.5!,f=-5.1!) USER MOD Single : C 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 35 CYS SG : rot 1:sc= 0.441 USER MOD Single : C 37 SER OG : rot 16:sc= -0.652 USER MOD Single : C 38 THR OG1 : rot -82:sc= 0.0738 USER MOD Single : C 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 45 MET CE :methyl 149:sc= -7.05! (180deg=-9!) USER MOD Single : C 47 MET CE :methyl -157:sc= -3.07! (180deg=-4.29!) USER MOD Single : C 50 GLN : amide:sc= -0.186 X(o=-0.19,f=-0.031) USER MOD Single : C 51 ASN : amide:sc= -1.79 K(o=-1.8,f=-4.6!) USER MOD Single : C 53 THR OG1 : rot -97:sc= -0.887 USER MOD Single : C 58 GLN : amide:sc= -0.275 K(o=-0.28,f=-1.5!) USER MOD Single : C 80 MET CE :methyl 150:sc= 0 (180deg=-1.41) USER MOD Single : C 81 MET CE :methyl -116:sc= -0.159 (180deg=-2.43!) USER MOD Single : C 84 CYS SG : rot 180:sc= 0.00484 USER MOD Single : C 85 MET CE :methyl -103:sc= -0.0766 (180deg=-1.45) USER MOD Single : C 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 89 SER OG : rot -53:sc= 0.433 USER MOD Single : I 3 SER OG : rot 180:sc= 0 USER MOD Single : I 9 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : I 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET C 1 57.150 -18.483 19.222 1.00 0.00 N ATOM 2 CA MET C 1 56.787 -17.506 18.154 1.00 0.00 C ATOM 3 C MET C 1 58.049 -16.853 17.583 1.00 0.00 C ATOM 4 O MET C 1 58.655 -16.004 18.205 1.00 0.00 O ATOM 5 CB MET C 1 55.911 -16.464 18.851 1.00 0.00 C ATOM 6 CG MET C 1 54.638 -17.133 19.370 1.00 0.00 C ATOM 7 SD MET C 1 53.242 -15.996 19.191 1.00 0.00 S ATOM 8 CE MET C 1 53.208 -15.407 20.902 1.00 0.00 C ATOM 0 H1 MET C 1 56.365 -19.150 19.364 1.00 0.00 H new ATOM 0 H2 MET C 1 58.002 -19.007 18.938 1.00 0.00 H new ATOM 0 H3 MET C 1 57.336 -17.974 20.110 1.00 0.00 H new ATOM 0 HA MET C 1 56.270 -17.980 17.319 1.00 0.00 H new ATOM 0 HB2 MET C 1 56.457 -16.008 19.677 1.00 0.00 H new ATOM 0 HB3 MET C 1 55.657 -15.664 18.156 1.00 0.00 H new ATOM 0 HG2 MET C 1 54.446 -18.052 18.816 1.00 0.00 H new ATOM 0 HG3 MET C 1 54.762 -17.412 20.416 1.00 0.00 H new ATOM 0 HE1 MET C 1 52.405 -14.680 21.021 1.00 0.00 H new ATOM 0 HE2 MET C 1 53.038 -16.249 21.573 1.00 0.00 H new ATOM 0 HE3 MET C 1 54.161 -14.937 21.144 1.00 0.00 H new ATOM 20 N ASP C 2 58.449 -17.243 16.402 1.00 0.00 N ATOM 21 CA ASP C 2 59.671 -16.644 15.793 1.00 0.00 C ATOM 22 C ASP C 2 59.348 -16.058 14.415 1.00 0.00 C ATOM 23 O ASP C 2 59.992 -16.366 13.433 1.00 0.00 O ATOM 24 CB ASP C 2 60.656 -17.806 15.662 1.00 0.00 C ATOM 25 CG ASP C 2 61.923 -17.496 16.461 1.00 0.00 C ATOM 26 OD1 ASP C 2 62.107 -16.343 16.817 1.00 0.00 O ATOM 27 OD2 ASP C 2 62.689 -18.415 16.701 1.00 0.00 O ATOM 0 H ASP C 2 57.982 -17.950 15.834 1.00 0.00 H new ATOM 0 HA ASP C 2 60.074 -15.830 16.395 1.00 0.00 H new ATOM 0 HB2 ASP C 2 60.200 -18.726 16.027 1.00 0.00 H new ATOM 0 HB3 ASP C 2 60.906 -17.968 14.613 1.00 0.00 H new ATOM 32 N ASP C 3 58.354 -15.215 14.336 1.00 0.00 N ATOM 33 CA ASP C 3 57.991 -14.610 13.021 1.00 0.00 C ATOM 34 C ASP C 3 57.561 -13.152 13.211 1.00 0.00 C ATOM 35 O ASP C 3 58.348 -12.240 13.063 1.00 0.00 O ATOM 36 CB ASP C 3 56.824 -15.453 12.506 1.00 0.00 C ATOM 37 CG ASP C 3 57.294 -16.311 11.329 1.00 0.00 C ATOM 38 OD1 ASP C 3 57.700 -15.739 10.330 1.00 0.00 O ATOM 39 OD2 ASP C 3 57.241 -17.524 11.447 1.00 0.00 O ATOM 0 H ASP C 3 57.778 -14.919 15.124 1.00 0.00 H new ATOM 0 HA ASP C 3 58.828 -14.605 12.323 1.00 0.00 H new ATOM 0 HB2 ASP C 3 56.441 -16.090 13.304 1.00 0.00 H new ATOM 0 HB3 ASP C 3 56.004 -14.806 12.194 1.00 0.00 H new ATOM 44 N ILE C 4 56.314 -12.931 13.537 1.00 0.00 N ATOM 45 CA ILE C 4 55.818 -11.536 13.742 1.00 0.00 C ATOM 46 C ILE C 4 55.842 -10.756 12.425 1.00 0.00 C ATOM 47 O ILE C 4 54.839 -10.230 11.985 1.00 0.00 O ATOM 48 CB ILE C 4 56.778 -10.905 14.753 1.00 0.00 C ATOM 49 CG1 ILE C 4 57.024 -11.881 15.909 1.00 0.00 C ATOM 50 CG2 ILE C 4 56.161 -9.616 15.302 1.00 0.00 C ATOM 51 CD1 ILE C 4 55.767 -11.975 16.773 1.00 0.00 C ATOM 0 H ILE C 4 55.614 -13.660 13.671 1.00 0.00 H new ATOM 0 HA ILE C 4 54.788 -11.524 14.098 1.00 0.00 H new ATOM 0 HB ILE C 4 57.724 -10.680 14.261 1.00 0.00 H new ATOM 0 HG12 ILE C 4 57.285 -12.865 15.519 1.00 0.00 H new ATOM 0 HG13 ILE C 4 57.868 -11.543 16.511 1.00 0.00 H new ATOM 0 HG21 ILE C 4 56.843 -9.164 16.023 1.00 0.00 H new ATOM 0 HG22 ILE C 4 55.985 -8.919 14.483 1.00 0.00 H new ATOM 0 HG23 ILE C 4 55.215 -9.846 15.792 1.00 0.00 H new ATOM 0 HD11 ILE C 4 55.942 -12.669 17.595 1.00 0.00 H new ATOM 0 HD12 ILE C 4 55.527 -10.990 17.174 1.00 0.00 H new ATOM 0 HD13 ILE C 4 54.935 -12.333 16.167 1.00 0.00 H new ATOM 63 N TYR C 5 56.979 -10.673 11.793 1.00 0.00 N ATOM 64 CA TYR C 5 57.065 -9.923 10.508 1.00 0.00 C ATOM 65 C TYR C 5 56.892 -10.877 9.322 1.00 0.00 C ATOM 66 O TYR C 5 55.965 -10.755 8.546 1.00 0.00 O ATOM 67 CB TYR C 5 58.464 -9.305 10.503 1.00 0.00 C ATOM 68 CG TYR C 5 58.630 -8.424 11.718 1.00 0.00 C ATOM 69 CD1 TYR C 5 58.925 -8.995 12.963 1.00 0.00 C ATOM 70 CD2 TYR C 5 58.490 -7.036 11.600 1.00 0.00 C ATOM 71 CE1 TYR C 5 59.079 -8.177 14.089 1.00 0.00 C ATOM 72 CE2 TYR C 5 58.645 -6.219 12.728 1.00 0.00 C ATOM 73 CZ TYR C 5 58.939 -6.790 13.971 1.00 0.00 C ATOM 74 OH TYR C 5 59.092 -5.985 15.082 1.00 0.00 O ATOM 0 H TYR C 5 57.853 -11.092 12.110 1.00 0.00 H new ATOM 0 HA TYR C 5 56.285 -9.167 10.419 1.00 0.00 H new ATOM 0 HB2 TYR C 5 59.220 -10.090 10.504 1.00 0.00 H new ATOM 0 HB3 TYR C 5 58.612 -8.721 9.594 1.00 0.00 H new ATOM 0 HD1 TYR C 5 59.034 -10.066 13.054 1.00 0.00 H new ATOM 0 HD2 TYR C 5 58.263 -6.595 10.641 1.00 0.00 H new ATOM 0 HE1 TYR C 5 59.306 -8.617 15.049 1.00 0.00 H new ATOM 0 HE2 TYR C 5 58.537 -5.148 12.638 1.00 0.00 H new ATOM 0 HH TYR C 5 58.964 -5.048 14.827 1.00 0.00 H new ATOM 84 N LYS C 6 57.775 -11.826 9.176 1.00 0.00 N ATOM 85 CA LYS C 6 57.656 -12.784 8.038 1.00 0.00 C ATOM 86 C LYS C 6 56.245 -13.379 7.995 1.00 0.00 C ATOM 87 O LYS C 6 55.773 -13.805 6.959 1.00 0.00 O ATOM 88 CB LYS C 6 58.691 -13.872 8.325 1.00 0.00 C ATOM 89 CG LYS C 6 60.001 -13.531 7.613 1.00 0.00 C ATOM 90 CD LYS C 6 61.146 -13.524 8.628 1.00 0.00 C ATOM 91 CE LYS C 6 62.443 -13.098 7.935 1.00 0.00 C ATOM 92 NZ LYS C 6 63.470 -13.093 9.013 1.00 0.00 N ATOM 0 H LYS C 6 58.572 -11.980 9.793 1.00 0.00 H new ATOM 0 HA LYS C 6 57.828 -12.305 7.074 1.00 0.00 H new ATOM 0 HB2 LYS C 6 58.859 -13.954 9.399 1.00 0.00 H new ATOM 0 HB3 LYS C 6 58.321 -14.839 7.985 1.00 0.00 H new ATOM 0 HG2 LYS C 6 60.201 -14.260 6.828 1.00 0.00 H new ATOM 0 HG3 LYS C 6 59.922 -12.557 7.131 1.00 0.00 H new ATOM 0 HD2 LYS C 6 60.917 -12.840 9.445 1.00 0.00 H new ATOM 0 HD3 LYS C 6 61.264 -14.515 9.065 1.00 0.00 H new ATOM 0 HE2 LYS C 6 62.711 -13.791 7.138 1.00 0.00 H new ATOM 0 HE3 LYS C 6 62.343 -12.112 7.480 1.00 0.00 H new ATOM 0 HZ1 LYS C 6 64.389 -12.810 8.616 1.00 0.00 H new ATOM 0 HZ2 LYS C 6 63.191 -12.419 9.755 1.00 0.00 H new ATOM 0 HZ3 LYS C 6 63.548 -14.046 9.422 1.00 0.00 H new ATOM 106 N ALA C 7 55.569 -13.408 9.111 1.00 0.00 N ATOM 107 CA ALA C 7 54.187 -13.973 9.129 1.00 0.00 C ATOM 108 C ALA C 7 53.277 -13.169 8.196 1.00 0.00 C ATOM 109 O ALA C 7 52.639 -13.711 7.317 1.00 0.00 O ATOM 110 CB ALA C 7 53.722 -13.837 10.579 1.00 0.00 C ATOM 0 H ALA C 7 55.911 -13.066 10.009 1.00 0.00 H new ATOM 0 HA ALA C 7 54.159 -15.008 8.788 1.00 0.00 H new ATOM 0 HB1 ALA C 7 52.711 -14.232 10.675 1.00 0.00 H new ATOM 0 HB2 ALA C 7 54.393 -14.396 11.230 1.00 0.00 H new ATOM 0 HB3 ALA C 7 53.730 -12.786 10.867 1.00 0.00 H new ATOM 116 N ALA C 8 53.216 -11.878 8.381 1.00 0.00 N ATOM 117 CA ALA C 8 52.348 -11.040 7.505 1.00 0.00 C ATOM 118 C ALA C 8 52.767 -11.198 6.041 1.00 0.00 C ATOM 119 O ALA C 8 51.972 -11.035 5.136 1.00 0.00 O ATOM 120 CB ALA C 8 52.575 -9.603 7.976 1.00 0.00 C ATOM 0 H ALA C 8 53.729 -11.368 9.100 1.00 0.00 H new ATOM 0 HA ALA C 8 51.298 -11.327 7.568 1.00 0.00 H new ATOM 0 HB1 ALA C 8 51.968 -8.924 7.377 1.00 0.00 H new ATOM 0 HB2 ALA C 8 52.291 -9.515 9.025 1.00 0.00 H new ATOM 0 HB3 ALA C 8 53.628 -9.345 7.862 1.00 0.00 H new ATOM 126 N VAL C 9 54.009 -11.515 5.800 1.00 0.00 N ATOM 127 CA VAL C 9 54.475 -11.683 4.395 1.00 0.00 C ATOM 128 C VAL C 9 53.792 -12.894 3.755 1.00 0.00 C ATOM 129 O VAL C 9 53.285 -12.824 2.655 1.00 0.00 O ATOM 130 CB VAL C 9 55.983 -11.913 4.499 1.00 0.00 C ATOM 131 CG1 VAL C 9 56.605 -11.860 3.104 1.00 0.00 C ATOM 132 CG2 VAL C 9 56.606 -10.824 5.376 1.00 0.00 C ATOM 0 H VAL C 9 54.721 -11.665 6.515 1.00 0.00 H new ATOM 0 HA VAL C 9 54.238 -10.818 3.776 1.00 0.00 H new ATOM 0 HB VAL C 9 56.171 -12.890 4.944 1.00 0.00 H new ATOM 0 HG11 VAL C 9 57.680 -12.024 3.178 1.00 0.00 H new ATOM 0 HG12 VAL C 9 56.162 -12.635 2.478 1.00 0.00 H new ATOM 0 HG13 VAL C 9 56.417 -10.883 2.659 1.00 0.00 H new ATOM 0 HG21 VAL C 9 57.681 -10.988 5.450 1.00 0.00 H new ATOM 0 HG22 VAL C 9 56.418 -9.847 4.931 1.00 0.00 H new ATOM 0 HG23 VAL C 9 56.164 -10.861 6.371 1.00 0.00 H new ATOM 142 N GLU C 10 53.776 -14.005 4.435 1.00 0.00 N ATOM 143 CA GLU C 10 53.129 -15.222 3.864 1.00 0.00 C ATOM 144 C GLU C 10 51.772 -14.868 3.245 1.00 0.00 C ATOM 145 O GLU C 10 51.286 -15.551 2.366 1.00 0.00 O ATOM 146 CB GLU C 10 52.945 -16.166 5.054 1.00 0.00 C ATOM 147 CG GLU C 10 54.167 -17.075 5.176 1.00 0.00 C ATOM 148 CD GLU C 10 54.013 -18.267 4.230 1.00 0.00 C ATOM 149 OE1 GLU C 10 53.523 -18.067 3.131 1.00 0.00 O ATOM 150 OE2 GLU C 10 54.386 -19.360 4.622 1.00 0.00 O ATOM 0 H GLU C 10 54.183 -14.125 5.363 1.00 0.00 H new ATOM 0 HA GLU C 10 53.728 -15.672 3.072 1.00 0.00 H new ATOM 0 HB2 GLU C 10 52.813 -15.591 5.971 1.00 0.00 H new ATOM 0 HB3 GLU C 10 52.044 -16.765 4.921 1.00 0.00 H new ATOM 0 HG2 GLU C 10 55.073 -16.519 4.933 1.00 0.00 H new ATOM 0 HG3 GLU C 10 54.273 -17.424 6.203 1.00 0.00 H new ATOM 157 N GLN C 11 51.156 -13.809 3.694 1.00 0.00 N ATOM 158 CA GLN C 11 49.831 -13.422 3.128 1.00 0.00 C ATOM 159 C GLN C 11 50.013 -12.633 1.828 1.00 0.00 C ATOM 160 O GLN C 11 49.059 -12.290 1.160 1.00 0.00 O ATOM 161 CB GLN C 11 49.181 -12.547 4.200 1.00 0.00 C ATOM 162 CG GLN C 11 48.098 -13.349 4.925 1.00 0.00 C ATOM 163 CD GLN C 11 48.678 -14.686 5.391 1.00 0.00 C ATOM 164 OE1 GLN C 11 48.111 -15.730 5.135 1.00 0.00 O ATOM 165 NE2 GLN C 11 49.793 -14.699 6.069 1.00 0.00 N ATOM 0 H GLN C 11 51.511 -13.195 4.427 1.00 0.00 H new ATOM 0 HA GLN C 11 49.220 -14.291 2.885 1.00 0.00 H new ATOM 0 HB2 GLN C 11 49.933 -12.205 4.911 1.00 0.00 H new ATOM 0 HB3 GLN C 11 48.746 -11.657 3.744 1.00 0.00 H new ATOM 0 HG2 GLN C 11 47.724 -12.785 5.780 1.00 0.00 H new ATOM 0 HG3 GLN C 11 47.251 -13.520 4.261 1.00 0.00 H new ATOM 0 HE21 GLN C 11 50.269 -13.823 6.284 1.00 0.00 H new ATOM 0 HE22 GLN C 11 50.188 -15.585 6.384 1.00 0.00 H new ATOM 174 N LEU C 12 51.232 -12.344 1.464 1.00 0.00 N ATOM 175 CA LEU C 12 51.477 -11.579 0.206 1.00 0.00 C ATOM 176 C LEU C 12 50.860 -12.312 -0.989 1.00 0.00 C ATOM 177 O LEU C 12 51.533 -13.038 -1.695 1.00 0.00 O ATOM 178 CB LEU C 12 53.002 -11.526 0.068 1.00 0.00 C ATOM 179 CG LEU C 12 53.537 -10.185 0.587 1.00 0.00 C ATOM 180 CD1 LEU C 12 53.338 -9.109 -0.481 1.00 0.00 C ATOM 181 CD2 LEU C 12 52.791 -9.780 1.861 1.00 0.00 C ATOM 0 H LEU C 12 52.071 -12.604 1.983 1.00 0.00 H new ATOM 0 HA LEU C 12 51.032 -10.585 0.235 1.00 0.00 H new ATOM 0 HB2 LEU C 12 53.453 -12.346 0.627 1.00 0.00 H new ATOM 0 HB3 LEU C 12 53.284 -11.658 -0.976 1.00 0.00 H new ATOM 0 HG LEU C 12 54.599 -10.289 0.812 1.00 0.00 H new ATOM 0 HD11 LEU C 12 53.718 -8.156 -0.113 1.00 0.00 H new ATOM 0 HD12 LEU C 12 53.878 -9.390 -1.385 1.00 0.00 H new ATOM 0 HD13 LEU C 12 52.276 -9.013 -0.707 1.00 0.00 H new ATOM 0 HD21 LEU C 12 53.178 -8.827 2.222 1.00 0.00 H new ATOM 0 HD22 LEU C 12 51.727 -9.681 1.644 1.00 0.00 H new ATOM 0 HD23 LEU C 12 52.936 -10.543 2.626 1.00 0.00 H new ATOM 193 N THR C 13 49.589 -12.129 -1.228 1.00 0.00 N ATOM 194 CA THR C 13 48.950 -12.823 -2.384 1.00 0.00 C ATOM 195 C THR C 13 49.739 -12.533 -3.664 1.00 0.00 C ATOM 196 O THR C 13 50.731 -11.832 -3.647 1.00 0.00 O ATOM 197 CB THR C 13 47.537 -12.241 -2.479 1.00 0.00 C ATOM 198 OG1 THR C 13 47.598 -10.827 -2.377 1.00 0.00 O ATOM 199 CG2 THR C 13 46.675 -12.800 -1.346 1.00 0.00 C ATOM 0 H THR C 13 48.970 -11.534 -0.678 1.00 0.00 H new ATOM 0 HA THR C 13 48.928 -13.905 -2.255 1.00 0.00 H new ATOM 0 HB THR C 13 47.096 -12.516 -3.437 1.00 0.00 H new ATOM 0 HG1 THR C 13 46.693 -10.455 -2.440 1.00 0.00 H new ATOM 0 HG21 THR C 13 45.670 -12.385 -1.415 1.00 0.00 H new ATOM 0 HG22 THR C 13 46.626 -13.886 -1.428 1.00 0.00 H new ATOM 0 HG23 THR C 13 47.115 -12.528 -0.386 1.00 0.00 H new ATOM 207 N GLU C 14 49.308 -13.070 -4.772 1.00 0.00 N ATOM 208 CA GLU C 14 50.038 -12.828 -6.049 1.00 0.00 C ATOM 209 C GLU C 14 49.929 -11.355 -6.458 1.00 0.00 C ATOM 210 O GLU C 14 50.912 -10.719 -6.783 1.00 0.00 O ATOM 211 CB GLU C 14 49.344 -13.724 -7.076 1.00 0.00 C ATOM 212 CG GLU C 14 50.396 -14.405 -7.955 1.00 0.00 C ATOM 213 CD GLU C 14 50.384 -15.911 -7.689 1.00 0.00 C ATOM 214 OE1 GLU C 14 49.304 -16.474 -7.625 1.00 0.00 O ATOM 215 OE2 GLU C 14 51.458 -16.477 -7.554 1.00 0.00 O ATOM 0 H GLU C 14 48.483 -13.665 -4.849 1.00 0.00 H new ATOM 0 HA GLU C 14 51.101 -13.051 -5.963 1.00 0.00 H new ATOM 0 HB2 GLU C 14 48.738 -14.475 -6.569 1.00 0.00 H new ATOM 0 HB3 GLU C 14 48.668 -13.132 -7.693 1.00 0.00 H new ATOM 0 HG2 GLU C 14 50.189 -14.209 -9.007 1.00 0.00 H new ATOM 0 HG3 GLU C 14 51.383 -13.995 -7.743 1.00 0.00 H new ATOM 222 N GLU C 15 48.744 -10.809 -6.450 1.00 0.00 N ATOM 223 CA GLU C 15 48.582 -9.379 -6.845 1.00 0.00 C ATOM 224 C GLU C 15 49.161 -8.455 -5.769 1.00 0.00 C ATOM 225 O GLU C 15 49.734 -7.426 -6.067 1.00 0.00 O ATOM 226 CB GLU C 15 47.072 -9.172 -6.974 1.00 0.00 C ATOM 227 CG GLU C 15 46.773 -8.397 -8.259 1.00 0.00 C ATOM 228 CD GLU C 15 46.296 -6.987 -7.908 1.00 0.00 C ATOM 229 OE1 GLU C 15 46.505 -6.575 -6.779 1.00 0.00 O ATOM 230 OE2 GLU C 15 45.728 -6.342 -8.775 1.00 0.00 O ATOM 0 H GLU C 15 47.883 -11.289 -6.188 1.00 0.00 H new ATOM 0 HA GLU C 15 49.108 -9.148 -7.772 1.00 0.00 H new ATOM 0 HB2 GLU C 15 46.562 -10.135 -6.990 1.00 0.00 H new ATOM 0 HB3 GLU C 15 46.694 -8.625 -6.110 1.00 0.00 H new ATOM 0 HG2 GLU C 15 47.667 -8.345 -8.881 1.00 0.00 H new ATOM 0 HG3 GLU C 15 46.010 -8.916 -8.840 1.00 0.00 H new ATOM 237 N GLN C 16 49.017 -8.809 -4.522 1.00 0.00 N ATOM 238 CA GLN C 16 49.560 -7.944 -3.434 1.00 0.00 C ATOM 239 C GLN C 16 51.085 -7.869 -3.522 1.00 0.00 C ATOM 240 O GLN C 16 51.677 -6.829 -3.311 1.00 0.00 O ATOM 241 CB GLN C 16 49.134 -8.627 -2.136 1.00 0.00 C ATOM 242 CG GLN C 16 49.923 -8.037 -0.968 1.00 0.00 C ATOM 243 CD GLN C 16 48.964 -7.691 0.173 1.00 0.00 C ATOM 244 OE1 GLN C 16 48.472 -6.583 0.253 1.00 0.00 O ATOM 245 NE2 GLN C 16 48.676 -8.600 1.063 1.00 0.00 N ATOM 0 H GLN C 16 48.548 -9.659 -4.208 1.00 0.00 H new ATOM 0 HA GLN C 16 49.189 -6.921 -3.500 1.00 0.00 H new ATOM 0 HB2 GLN C 16 48.065 -8.489 -1.974 1.00 0.00 H new ATOM 0 HB3 GLN C 16 49.310 -9.701 -2.203 1.00 0.00 H new ATOM 0 HG2 GLN C 16 50.672 -8.750 -0.624 1.00 0.00 H new ATOM 0 HG3 GLN C 16 50.458 -7.144 -1.291 1.00 0.00 H new ATOM 0 HE21 GLN C 16 49.090 -9.530 0.995 1.00 0.00 H new ATOM 0 HE22 GLN C 16 48.037 -8.381 1.827 1.00 0.00 H new ATOM 254 N LYS C 17 51.728 -8.960 -3.830 1.00 0.00 N ATOM 255 CA LYS C 17 53.212 -8.944 -3.929 1.00 0.00 C ATOM 256 C LYS C 17 53.637 -8.170 -5.182 1.00 0.00 C ATOM 257 O LYS C 17 54.703 -7.590 -5.235 1.00 0.00 O ATOM 258 CB LYS C 17 53.613 -10.421 -4.016 1.00 0.00 C ATOM 259 CG LYS C 17 54.956 -10.563 -4.732 1.00 0.00 C ATOM 260 CD LYS C 17 54.705 -10.761 -6.226 1.00 0.00 C ATOM 261 CE LYS C 17 55.649 -9.865 -7.031 1.00 0.00 C ATOM 262 NZ LYS C 17 57.018 -10.361 -6.713 1.00 0.00 N ATOM 0 H LYS C 17 51.289 -9.862 -4.017 1.00 0.00 H new ATOM 0 HA LYS C 17 53.693 -8.452 -3.083 1.00 0.00 H new ATOM 0 HB2 LYS C 17 53.680 -10.847 -3.015 1.00 0.00 H new ATOM 0 HB3 LYS C 17 52.847 -10.982 -4.551 1.00 0.00 H new ATOM 0 HG2 LYS C 17 55.566 -9.675 -4.567 1.00 0.00 H new ATOM 0 HG3 LYS C 17 55.510 -11.410 -4.328 1.00 0.00 H new ATOM 0 HD2 LYS C 17 54.861 -11.805 -6.496 1.00 0.00 H new ATOM 0 HD3 LYS C 17 53.669 -10.522 -6.465 1.00 0.00 H new ATOM 0 HE2 LYS C 17 55.443 -9.934 -8.099 1.00 0.00 H new ATOM 0 HE3 LYS C 17 55.534 -8.818 -6.751 1.00 0.00 H new ATOM 0 HZ1 LYS C 17 57.687 -10.021 -7.433 1.00 0.00 H new ATOM 0 HZ2 LYS C 17 57.307 -10.008 -5.778 1.00 0.00 H new ATOM 0 HZ3 LYS C 17 57.017 -11.401 -6.705 1.00 0.00 H new ATOM 276 N ASN C 18 52.806 -8.153 -6.189 1.00 0.00 N ATOM 277 CA ASN C 18 53.157 -7.411 -7.435 1.00 0.00 C ATOM 278 C ASN C 18 52.985 -5.906 -7.214 1.00 0.00 C ATOM 279 O ASN C 18 53.427 -5.098 -8.006 1.00 0.00 O ATOM 280 CB ASN C 18 52.165 -7.912 -8.487 1.00 0.00 C ATOM 281 CG ASN C 18 52.577 -9.308 -8.958 1.00 0.00 C ATOM 282 OD1 ASN C 18 53.733 -9.550 -9.239 1.00 0.00 O ATOM 283 ND2 ASN C 18 51.671 -10.242 -9.056 1.00 0.00 N ATOM 0 H ASN C 18 51.900 -8.620 -6.203 1.00 0.00 H new ATOM 0 HA ASN C 18 54.191 -7.576 -7.738 1.00 0.00 H new ATOM 0 HB2 ASN C 18 51.159 -7.941 -8.068 1.00 0.00 H new ATOM 0 HB3 ASN C 18 52.139 -7.225 -9.333 1.00 0.00 H new ATOM 0 HD21 ASN C 18 51.934 -11.177 -9.369 1.00 0.00 H new ATOM 0 HD22 ASN C 18 50.700 -10.038 -8.820 1.00 0.00 H new ATOM 290 N GLU C 19 52.338 -5.525 -6.147 1.00 0.00 N ATOM 291 CA GLU C 19 52.127 -4.073 -5.880 1.00 0.00 C ATOM 292 C GLU C 19 53.351 -3.468 -5.185 1.00 0.00 C ATOM 293 O GLU C 19 53.881 -2.462 -5.612 1.00 0.00 O ATOM 294 CB GLU C 19 50.905 -4.014 -4.963 1.00 0.00 C ATOM 295 CG GLU C 19 49.694 -3.522 -5.758 1.00 0.00 C ATOM 296 CD GLU C 19 49.174 -2.220 -5.144 1.00 0.00 C ATOM 297 OE1 GLU C 19 49.081 -2.158 -3.930 1.00 0.00 O ATOM 298 OE2 GLU C 19 48.878 -1.309 -5.899 1.00 0.00 O ATOM 0 H GLU C 19 51.946 -6.156 -5.448 1.00 0.00 H new ATOM 0 HA GLU C 19 51.979 -3.505 -6.799 1.00 0.00 H new ATOM 0 HB2 GLU C 19 50.703 -5.000 -4.545 1.00 0.00 H new ATOM 0 HB3 GLU C 19 51.099 -3.346 -4.124 1.00 0.00 H new ATOM 0 HG2 GLU C 19 49.971 -3.360 -6.800 1.00 0.00 H new ATOM 0 HG3 GLU C 19 48.909 -4.279 -5.751 1.00 0.00 H new ATOM 305 N PHE C 20 53.802 -4.064 -4.114 1.00 0.00 N ATOM 306 CA PHE C 20 54.988 -3.505 -3.401 1.00 0.00 C ATOM 307 C PHE C 20 56.240 -3.619 -4.280 1.00 0.00 C ATOM 308 O PHE C 20 57.046 -2.713 -4.348 1.00 0.00 O ATOM 309 CB PHE C 20 55.123 -4.340 -2.118 1.00 0.00 C ATOM 310 CG PHE C 20 55.894 -5.614 -2.391 1.00 0.00 C ATOM 311 CD1 PHE C 20 57.282 -5.567 -2.573 1.00 0.00 C ATOM 312 CD2 PHE C 20 55.222 -6.840 -2.457 1.00 0.00 C ATOM 313 CE1 PHE C 20 57.997 -6.744 -2.823 1.00 0.00 C ATOM 314 CE2 PHE C 20 55.937 -8.018 -2.707 1.00 0.00 C ATOM 315 CZ PHE C 20 57.324 -7.970 -2.890 1.00 0.00 C ATOM 0 H PHE C 20 53.404 -4.909 -3.704 1.00 0.00 H new ATOM 0 HA PHE C 20 54.871 -2.446 -3.171 1.00 0.00 H new ATOM 0 HB2 PHE C 20 55.632 -3.758 -1.350 1.00 0.00 H new ATOM 0 HB3 PHE C 20 54.134 -4.583 -1.730 1.00 0.00 H new ATOM 0 HD1 PHE C 20 57.801 -4.621 -2.520 1.00 0.00 H new ATOM 0 HD2 PHE C 20 54.152 -6.878 -2.315 1.00 0.00 H new ATOM 0 HE1 PHE C 20 59.067 -6.707 -2.964 1.00 0.00 H new ATOM 0 HE2 PHE C 20 55.418 -8.964 -2.759 1.00 0.00 H new ATOM 0 HZ PHE C 20 57.875 -8.879 -3.083 1.00 0.00 H new ATOM 325 N LYS C 21 56.409 -4.726 -4.951 1.00 0.00 N ATOM 326 CA LYS C 21 57.608 -4.894 -5.822 1.00 0.00 C ATOM 327 C LYS C 21 57.799 -3.655 -6.700 1.00 0.00 C ATOM 328 O LYS C 21 58.894 -3.345 -7.124 1.00 0.00 O ATOM 329 CB LYS C 21 57.309 -6.124 -6.678 1.00 0.00 C ATOM 330 CG LYS C 21 56.272 -5.767 -7.745 1.00 0.00 C ATOM 331 CD LYS C 21 56.979 -5.166 -8.961 1.00 0.00 C ATOM 332 CE LYS C 21 56.672 -6.009 -10.201 1.00 0.00 C ATOM 333 NZ LYS C 21 57.980 -6.161 -10.898 1.00 0.00 N ATOM 0 H LYS C 21 55.770 -5.521 -4.934 1.00 0.00 H new ATOM 0 HA LYS C 21 58.525 -5.017 -5.246 1.00 0.00 H new ATOM 0 HB2 LYS C 21 58.224 -6.482 -7.151 1.00 0.00 H new ATOM 0 HB3 LYS C 21 56.936 -6.934 -6.051 1.00 0.00 H new ATOM 0 HG2 LYS C 21 55.715 -6.657 -8.038 1.00 0.00 H new ATOM 0 HG3 LYS C 21 55.550 -5.056 -7.343 1.00 0.00 H new ATOM 0 HD2 LYS C 21 56.648 -4.139 -9.116 1.00 0.00 H new ATOM 0 HD3 LYS C 21 58.055 -5.132 -8.789 1.00 0.00 H new ATOM 0 HE2 LYS C 21 56.256 -6.978 -9.926 1.00 0.00 H new ATOM 0 HE3 LYS C 21 55.939 -5.518 -10.841 1.00 0.00 H new ATOM 0 HZ1 LYS C 21 57.850 -6.729 -11.760 1.00 0.00 H new ATOM 0 HZ2 LYS C 21 58.348 -5.223 -11.154 1.00 0.00 H new ATOM 0 HZ3 LYS C 21 58.656 -6.638 -10.268 1.00 0.00 H new ATOM 347 N ALA C 22 56.741 -2.942 -6.975 1.00 0.00 N ATOM 348 CA ALA C 22 56.865 -1.722 -7.823 1.00 0.00 C ATOM 349 C ALA C 22 57.586 -0.616 -7.049 1.00 0.00 C ATOM 350 O ALA C 22 58.590 -0.090 -7.489 1.00 0.00 O ATOM 351 CB ALA C 22 55.427 -1.306 -8.135 1.00 0.00 C ATOM 0 H ALA C 22 55.797 -3.151 -6.650 1.00 0.00 H new ATOM 0 HA ALA C 22 57.441 -1.906 -8.730 1.00 0.00 H new ATOM 0 HB1 ALA C 22 55.434 -0.412 -8.758 1.00 0.00 H new ATOM 0 HB2 ALA C 22 54.922 -2.113 -8.665 1.00 0.00 H new ATOM 0 HB3 ALA C 22 54.899 -1.096 -7.205 1.00 0.00 H new ATOM 357 N ALA C 23 57.083 -0.260 -5.899 1.00 0.00 N ATOM 358 CA ALA C 23 57.739 0.810 -5.095 1.00 0.00 C ATOM 359 C ALA C 23 59.225 0.496 -4.910 1.00 0.00 C ATOM 360 O ALA C 23 60.072 1.359 -5.030 1.00 0.00 O ATOM 361 CB ALA C 23 57.016 0.795 -3.749 1.00 0.00 C ATOM 0 H ALA C 23 56.245 -0.664 -5.481 1.00 0.00 H new ATOM 0 HA ALA C 23 57.678 1.785 -5.578 1.00 0.00 H new ATOM 0 HB1 ALA C 23 57.443 1.558 -3.098 1.00 0.00 H new ATOM 0 HB2 ALA C 23 55.957 1.001 -3.903 1.00 0.00 H new ATOM 0 HB3 ALA C 23 57.132 -0.184 -3.285 1.00 0.00 H new ATOM 367 N PHE C 24 59.550 -0.735 -4.621 1.00 0.00 N ATOM 368 CA PHE C 24 60.982 -1.104 -4.431 1.00 0.00 C ATOM 369 C PHE C 24 61.749 -0.928 -5.745 1.00 0.00 C ATOM 370 O PHE C 24 62.911 -0.574 -5.754 1.00 0.00 O ATOM 371 CB PHE C 24 60.960 -2.575 -4.014 1.00 0.00 C ATOM 372 CG PHE C 24 62.342 -3.164 -4.160 1.00 0.00 C ATOM 373 CD1 PHE C 24 62.731 -3.743 -5.375 1.00 0.00 C ATOM 374 CD2 PHE C 24 63.236 -3.133 -3.083 1.00 0.00 C ATOM 375 CE1 PHE C 24 64.012 -4.288 -5.513 1.00 0.00 C ATOM 376 CE2 PHE C 24 64.517 -3.679 -3.221 1.00 0.00 C ATOM 377 CZ PHE C 24 64.905 -4.257 -4.436 1.00 0.00 C ATOM 0 H PHE C 24 58.886 -1.501 -4.508 1.00 0.00 H new ATOM 0 HA PHE C 24 61.476 -0.479 -3.688 1.00 0.00 H new ATOM 0 HB2 PHE C 24 60.622 -2.666 -2.982 1.00 0.00 H new ATOM 0 HB3 PHE C 24 60.251 -3.128 -4.631 1.00 0.00 H new ATOM 0 HD1 PHE C 24 62.041 -3.769 -6.206 1.00 0.00 H new ATOM 0 HD2 PHE C 24 62.937 -2.688 -2.146 1.00 0.00 H new ATOM 0 HE1 PHE C 24 64.312 -4.733 -6.451 1.00 0.00 H new ATOM 0 HE2 PHE C 24 65.207 -3.655 -2.390 1.00 0.00 H new ATOM 0 HZ PHE C 24 65.894 -4.679 -4.542 1.00 0.00 H new ATOM 387 N ASP C 25 61.107 -1.174 -6.854 1.00 0.00 N ATOM 388 CA ASP C 25 61.799 -1.023 -8.167 1.00 0.00 C ATOM 389 C ASP C 25 62.057 0.456 -8.465 1.00 0.00 C ATOM 390 O ASP C 25 63.170 0.856 -8.746 1.00 0.00 O ATOM 391 CB ASP C 25 60.833 -1.615 -9.193 1.00 0.00 C ATOM 392 CG ASP C 25 61.521 -2.760 -9.938 1.00 0.00 C ATOM 393 OD1 ASP C 25 62.439 -3.337 -9.379 1.00 0.00 O ATOM 394 OD2 ASP C 25 61.120 -3.038 -11.056 1.00 0.00 O ATOM 0 H ASP C 25 60.133 -1.473 -6.909 1.00 0.00 H new ATOM 0 HA ASP C 25 62.768 -1.522 -8.182 1.00 0.00 H new ATOM 0 HB2 ASP C 25 59.934 -1.979 -8.695 1.00 0.00 H new ATOM 0 HB3 ASP C 25 60.518 -0.846 -9.898 1.00 0.00 H new ATOM 399 N ILE C 26 61.041 1.272 -8.406 1.00 0.00 N ATOM 400 CA ILE C 26 61.238 2.722 -8.686 1.00 0.00 C ATOM 401 C ILE C 26 62.240 3.312 -7.691 1.00 0.00 C ATOM 402 O ILE C 26 62.911 4.285 -7.973 1.00 0.00 O ATOM 403 CB ILE C 26 59.861 3.356 -8.502 1.00 0.00 C ATOM 404 CG1 ILE C 26 58.970 2.988 -9.688 1.00 0.00 C ATOM 405 CG2 ILE C 26 60.006 4.877 -8.428 1.00 0.00 C ATOM 406 CD1 ILE C 26 58.140 1.754 -9.334 1.00 0.00 C ATOM 0 H ILE C 26 60.085 0.998 -8.177 1.00 0.00 H new ATOM 0 HA ILE C 26 61.633 2.902 -9.686 1.00 0.00 H new ATOM 0 HB ILE C 26 59.411 2.988 -7.580 1.00 0.00 H new ATOM 0 HG12 ILE C 26 58.314 3.822 -9.937 1.00 0.00 H new ATOM 0 HG13 ILE C 26 59.581 2.789 -10.568 1.00 0.00 H new ATOM 0 HG21 ILE C 26 59.023 5.330 -8.297 1.00 0.00 H new ATOM 0 HG22 ILE C 26 60.643 5.141 -7.584 1.00 0.00 H new ATOM 0 HG23 ILE C 26 60.455 5.245 -9.351 1.00 0.00 H new ATOM 0 HD11 ILE C 26 57.503 1.489 -10.178 1.00 0.00 H new ATOM 0 HD12 ILE C 26 58.805 0.921 -9.106 1.00 0.00 H new ATOM 0 HD13 ILE C 26 57.519 1.970 -8.465 1.00 0.00 H new ATOM 418 N PHE C 27 62.344 2.730 -6.529 1.00 0.00 N ATOM 419 CA PHE C 27 63.301 3.255 -5.514 1.00 0.00 C ATOM 420 C PHE C 27 64.741 3.100 -6.015 1.00 0.00 C ATOM 421 O PHE C 27 65.535 4.017 -5.944 1.00 0.00 O ATOM 422 CB PHE C 27 63.071 2.395 -4.271 1.00 0.00 C ATOM 423 CG PHE C 27 62.030 3.046 -3.392 1.00 0.00 C ATOM 424 CD1 PHE C 27 62.077 4.425 -3.154 1.00 0.00 C ATOM 425 CD2 PHE C 27 61.021 2.269 -2.811 1.00 0.00 C ATOM 426 CE1 PHE C 27 61.112 5.027 -2.337 1.00 0.00 C ATOM 427 CE2 PHE C 27 60.056 2.872 -1.993 1.00 0.00 C ATOM 428 CZ PHE C 27 60.102 4.251 -1.756 1.00 0.00 C ATOM 0 H PHE C 27 61.808 1.913 -6.238 1.00 0.00 H new ATOM 0 HA PHE C 27 63.147 4.315 -5.311 1.00 0.00 H new ATOM 0 HB2 PHE C 27 62.744 1.397 -4.562 1.00 0.00 H new ATOM 0 HB3 PHE C 27 64.004 2.276 -3.720 1.00 0.00 H new ATOM 0 HD1 PHE C 27 62.857 5.024 -3.600 1.00 0.00 H new ATOM 0 HD2 PHE C 27 60.986 1.205 -2.993 1.00 0.00 H new ATOM 0 HE1 PHE C 27 61.147 6.091 -2.155 1.00 0.00 H new ATOM 0 HE2 PHE C 27 59.277 2.273 -1.545 1.00 0.00 H new ATOM 0 HZ PHE C 27 59.359 4.716 -1.125 1.00 0.00 H new ATOM 438 N VAL C 28 65.082 1.945 -6.519 1.00 0.00 N ATOM 439 CA VAL C 28 66.470 1.731 -7.022 1.00 0.00 C ATOM 440 C VAL C 28 66.548 2.053 -8.517 1.00 0.00 C ATOM 441 O VAL C 28 67.509 1.725 -9.184 1.00 0.00 O ATOM 442 CB VAL C 28 66.753 0.248 -6.779 1.00 0.00 C ATOM 443 CG1 VAL C 28 66.354 -0.124 -5.349 1.00 0.00 C ATOM 444 CG2 VAL C 28 65.945 -0.594 -7.768 1.00 0.00 C ATOM 0 H VAL C 28 64.460 1.141 -6.604 1.00 0.00 H new ATOM 0 HA VAL C 28 67.194 2.373 -6.521 1.00 0.00 H new ATOM 0 HB VAL C 28 67.817 0.055 -6.920 1.00 0.00 H new ATOM 0 HG11 VAL C 28 66.557 -1.181 -5.178 1.00 0.00 H new ATOM 0 HG12 VAL C 28 66.930 0.475 -4.643 1.00 0.00 H new ATOM 0 HG13 VAL C 28 65.291 0.069 -5.206 1.00 0.00 H new ATOM 0 HG21 VAL C 28 66.146 -1.651 -7.595 1.00 0.00 H new ATOM 0 HG22 VAL C 28 64.882 -0.399 -7.628 1.00 0.00 H new ATOM 0 HG23 VAL C 28 66.230 -0.332 -8.787 1.00 0.00 H new ATOM 454 N LEU C 29 65.543 2.694 -9.048 1.00 0.00 N ATOM 455 CA LEU C 29 65.559 3.038 -10.499 1.00 0.00 C ATOM 456 C LEU C 29 66.914 3.639 -10.885 1.00 0.00 C ATOM 457 O LEU C 29 67.191 4.791 -10.617 1.00 0.00 O ATOM 458 CB LEU C 29 64.445 4.071 -10.672 1.00 0.00 C ATOM 459 CG LEU C 29 63.288 3.450 -11.454 1.00 0.00 C ATOM 460 CD1 LEU C 29 62.106 4.422 -11.472 1.00 0.00 C ATOM 461 CD2 LEU C 29 63.738 3.167 -12.888 1.00 0.00 C ATOM 0 H LEU C 29 64.711 2.995 -8.540 1.00 0.00 H new ATOM 0 HA LEU C 29 65.407 2.165 -11.133 1.00 0.00 H new ATOM 0 HB2 LEU C 29 64.097 4.412 -9.697 1.00 0.00 H new ATOM 0 HB3 LEU C 29 64.825 4.946 -11.199 1.00 0.00 H new ATOM 0 HG LEU C 29 62.984 2.518 -10.978 1.00 0.00 H new ATOM 0 HD11 LEU C 29 61.280 3.980 -12.030 1.00 0.00 H new ATOM 0 HD12 LEU C 29 61.786 4.625 -10.450 1.00 0.00 H new ATOM 0 HD13 LEU C 29 62.409 5.354 -11.949 1.00 0.00 H new ATOM 0 HD21 LEU C 29 62.914 2.724 -13.447 1.00 0.00 H new ATOM 0 HD22 LEU C 29 64.041 4.099 -13.365 1.00 0.00 H new ATOM 0 HD23 LEU C 29 64.581 2.476 -12.875 1.00 0.00 H new ATOM 473 N GLY C 30 67.759 2.870 -11.517 1.00 0.00 N ATOM 474 CA GLY C 30 69.092 3.403 -11.920 1.00 0.00 C ATOM 475 C GLY C 30 70.180 2.816 -11.017 1.00 0.00 C ATOM 476 O GLY C 30 71.354 3.071 -11.200 1.00 0.00 O ATOM 0 H GLY C 30 67.584 1.898 -11.771 1.00 0.00 H new ATOM 0 HA2 GLY C 30 69.295 3.151 -12.961 1.00 0.00 H new ATOM 0 HA3 GLY C 30 69.095 4.491 -11.849 1.00 0.00 H new ATOM 480 N ALA C 31 69.800 2.035 -10.042 1.00 0.00 N ATOM 481 CA ALA C 31 70.815 1.435 -9.127 1.00 0.00 C ATOM 482 C ALA C 31 71.645 0.383 -9.869 1.00 0.00 C ATOM 483 O ALA C 31 71.122 -0.435 -10.599 1.00 0.00 O ATOM 484 CB ALA C 31 69.999 0.782 -8.011 1.00 0.00 C ATOM 0 H ALA C 31 68.832 1.786 -9.839 1.00 0.00 H new ATOM 0 HA ALA C 31 71.515 2.177 -8.744 1.00 0.00 H new ATOM 0 HB1 ALA C 31 70.673 0.316 -7.293 1.00 0.00 H new ATOM 0 HB2 ALA C 31 69.400 1.540 -7.507 1.00 0.00 H new ATOM 0 HB3 ALA C 31 69.342 0.024 -8.437 1.00 0.00 H new ATOM 490 N GLU C 32 72.938 0.398 -9.688 1.00 0.00 N ATOM 491 CA GLU C 32 73.800 -0.602 -10.382 1.00 0.00 C ATOM 492 C GLU C 32 73.489 -2.013 -9.875 1.00 0.00 C ATOM 493 O GLU C 32 73.705 -2.991 -10.563 1.00 0.00 O ATOM 494 CB GLU C 32 75.233 -0.207 -10.028 1.00 0.00 C ATOM 495 CG GLU C 32 76.019 0.070 -11.311 1.00 0.00 C ATOM 496 CD GLU C 32 76.836 -1.168 -11.689 1.00 0.00 C ATOM 497 OE1 GLU C 32 76.292 -2.257 -11.618 1.00 0.00 O ATOM 498 OE2 GLU C 32 77.992 -1.004 -12.044 1.00 0.00 O ATOM 0 H GLU C 32 73.434 1.059 -9.090 1.00 0.00 H new ATOM 0 HA GLU C 32 73.636 -0.610 -11.460 1.00 0.00 H new ATOM 0 HB2 GLU C 32 75.231 0.678 -9.392 1.00 0.00 H new ATOM 0 HB3 GLU C 32 75.712 -1.005 -9.461 1.00 0.00 H new ATOM 0 HG2 GLU C 32 75.335 0.328 -12.120 1.00 0.00 H new ATOM 0 HG3 GLU C 32 76.680 0.925 -11.167 1.00 0.00 H new ATOM 505 N ASP C 33 72.982 -2.128 -8.677 1.00 0.00 N ATOM 506 CA ASP C 33 72.658 -3.477 -8.131 1.00 0.00 C ATOM 507 C ASP C 33 71.149 -3.607 -7.899 1.00 0.00 C ATOM 508 O ASP C 33 70.548 -4.613 -8.218 1.00 0.00 O ATOM 509 CB ASP C 33 73.416 -3.561 -6.805 1.00 0.00 C ATOM 510 CG ASP C 33 74.292 -4.816 -6.797 1.00 0.00 C ATOM 511 OD1 ASP C 33 75.274 -4.833 -7.522 1.00 0.00 O ATOM 512 OD2 ASP C 33 73.966 -5.738 -6.068 1.00 0.00 O ATOM 0 H ASP C 33 72.778 -1.347 -8.054 1.00 0.00 H new ATOM 0 HA ASP C 33 72.943 -4.278 -8.814 1.00 0.00 H new ATOM 0 HB2 ASP C 33 74.033 -2.673 -6.670 1.00 0.00 H new ATOM 0 HB3 ASP C 33 72.713 -3.590 -5.973 1.00 0.00 H new ATOM 517 N GLY C 34 70.534 -2.596 -7.349 1.00 0.00 N ATOM 518 CA GLY C 34 69.066 -2.663 -7.099 1.00 0.00 C ATOM 519 C GLY C 34 68.787 -2.438 -5.612 1.00 0.00 C ATOM 520 O GLY C 34 67.676 -2.599 -5.147 1.00 0.00 O ATOM 0 H GLY C 34 70.984 -1.727 -7.062 1.00 0.00 H new ATOM 0 HA2 GLY C 34 68.551 -1.909 -7.694 1.00 0.00 H new ATOM 0 HA3 GLY C 34 68.678 -3.633 -7.409 1.00 0.00 H new ATOM 524 N CYS C 35 69.788 -2.065 -4.861 1.00 0.00 N ATOM 525 CA CYS C 35 69.581 -1.828 -3.404 1.00 0.00 C ATOM 526 C CYS C 35 69.168 -0.374 -3.159 1.00 0.00 C ATOM 527 O CYS C 35 69.038 0.406 -4.080 1.00 0.00 O ATOM 528 CB CYS C 35 70.938 -2.114 -2.762 1.00 0.00 C ATOM 529 SG CYS C 35 71.046 -3.869 -2.330 1.00 0.00 S ATOM 0 H CYS C 35 70.740 -1.914 -5.194 1.00 0.00 H new ATOM 0 HA CYS C 35 68.792 -2.456 -2.990 1.00 0.00 H new ATOM 0 HB2 CYS C 35 71.741 -1.848 -3.450 1.00 0.00 H new ATOM 0 HB3 CYS C 35 71.066 -1.501 -1.870 1.00 0.00 H new ATOM 0 HG CYS C 35 69.951 -4.472 -2.686 1.00 0.00 H new ATOM 535 N ILE C 36 68.963 -0.005 -1.925 1.00 0.00 N ATOM 536 CA ILE C 36 68.561 1.400 -1.626 1.00 0.00 C ATOM 537 C ILE C 36 69.453 1.985 -0.529 1.00 0.00 C ATOM 538 O ILE C 36 69.892 1.292 0.368 1.00 0.00 O ATOM 539 CB ILE C 36 67.113 1.307 -1.145 1.00 0.00 C ATOM 540 CG1 ILE C 36 66.199 0.982 -2.329 1.00 0.00 C ATOM 541 CG2 ILE C 36 66.693 2.644 -0.533 1.00 0.00 C ATOM 542 CD1 ILE C 36 64.762 0.807 -1.834 1.00 0.00 C ATOM 0 H ILE C 36 69.056 -0.613 -1.112 1.00 0.00 H new ATOM 0 HA ILE C 36 68.660 2.049 -2.496 1.00 0.00 H new ATOM 0 HB ILE C 36 67.031 0.520 -0.396 1.00 0.00 H new ATOM 0 HG12 ILE C 36 66.245 1.782 -3.068 1.00 0.00 H new ATOM 0 HG13 ILE C 36 66.537 0.072 -2.824 1.00 0.00 H new ATOM 0 HG21 ILE C 36 65.661 2.579 -0.190 1.00 0.00 H new ATOM 0 HG22 ILE C 36 67.342 2.878 0.311 1.00 0.00 H new ATOM 0 HG23 ILE C 36 66.777 3.430 -1.284 1.00 0.00 H new ATOM 0 HD11 ILE C 36 64.112 0.576 -2.678 1.00 0.00 H new ATOM 0 HD12 ILE C 36 64.723 -0.008 -1.112 1.00 0.00 H new ATOM 0 HD13 ILE C 36 64.426 1.729 -1.359 1.00 0.00 H new ATOM 554 N SER C 37 69.724 3.258 -0.597 1.00 0.00 N ATOM 555 CA SER C 37 70.587 3.904 0.433 1.00 0.00 C ATOM 556 C SER C 37 70.320 5.405 0.453 1.00 0.00 C ATOM 557 O SER C 37 71.227 6.209 0.483 1.00 0.00 O ATOM 558 CB SER C 37 72.005 3.639 -0.029 1.00 0.00 C ATOM 559 OG SER C 37 72.685 2.858 0.945 1.00 0.00 O ATOM 0 H SER C 37 69.383 3.884 -1.327 1.00 0.00 H new ATOM 0 HA SER C 37 70.401 3.520 1.436 1.00 0.00 H new ATOM 0 HB2 SER C 37 71.995 3.117 -0.986 1.00 0.00 H new ATOM 0 HB3 SER C 37 72.530 4.582 -0.185 1.00 0.00 H new ATOM 0 HG SER C 37 72.033 2.464 1.562 1.00 0.00 H new ATOM 565 N THR C 38 69.075 5.769 0.410 1.00 0.00 N ATOM 566 CA THR C 38 68.682 7.215 0.396 1.00 0.00 C ATOM 567 C THR C 38 68.991 7.811 -0.980 1.00 0.00 C ATOM 568 O THR C 38 68.132 8.378 -1.625 1.00 0.00 O ATOM 569 CB THR C 38 69.494 7.922 1.497 1.00 0.00 C ATOM 570 OG1 THR C 38 70.732 8.375 0.967 1.00 0.00 O ATOM 571 CG2 THR C 38 69.749 6.968 2.669 1.00 0.00 C ATOM 0 H THR C 38 68.291 5.118 0.383 1.00 0.00 H new ATOM 0 HA THR C 38 67.616 7.340 0.584 1.00 0.00 H new ATOM 0 HB THR C 38 68.922 8.776 1.859 1.00 0.00 H new ATOM 0 HG1 THR C 38 71.376 7.637 0.964 1.00 0.00 H new ATOM 0 HG21 THR C 38 70.324 7.483 3.439 1.00 0.00 H new ATOM 0 HG22 THR C 38 68.796 6.641 3.086 1.00 0.00 H new ATOM 0 HG23 THR C 38 70.308 6.101 2.317 1.00 0.00 H new ATOM 579 N LYS C 39 70.201 7.670 -1.450 1.00 0.00 N ATOM 580 CA LYS C 39 70.532 8.213 -2.798 1.00 0.00 C ATOM 581 C LYS C 39 69.462 7.754 -3.793 1.00 0.00 C ATOM 582 O LYS C 39 69.070 8.481 -4.684 1.00 0.00 O ATOM 583 CB LYS C 39 71.893 7.608 -3.151 1.00 0.00 C ATOM 584 CG LYS C 39 72.631 8.536 -4.118 1.00 0.00 C ATOM 585 CD LYS C 39 72.664 7.903 -5.511 1.00 0.00 C ATOM 586 CE LYS C 39 73.780 6.857 -5.572 1.00 0.00 C ATOM 587 NZ LYS C 39 73.616 6.198 -6.898 1.00 0.00 N ATOM 0 H LYS C 39 70.968 7.206 -0.964 1.00 0.00 H new ATOM 0 HA LYS C 39 70.564 9.302 -2.823 1.00 0.00 H new ATOM 0 HB2 LYS C 39 72.484 7.464 -2.247 1.00 0.00 H new ATOM 0 HB3 LYS C 39 71.759 6.626 -3.604 1.00 0.00 H new ATOM 0 HG2 LYS C 39 72.134 9.505 -4.159 1.00 0.00 H new ATOM 0 HG3 LYS C 39 73.646 8.714 -3.764 1.00 0.00 H new ATOM 0 HD2 LYS C 39 71.703 7.438 -5.733 1.00 0.00 H new ATOM 0 HD3 LYS C 39 72.829 8.671 -6.267 1.00 0.00 H new ATOM 0 HE2 LYS C 39 74.762 7.321 -5.480 1.00 0.00 H new ATOM 0 HE3 LYS C 39 73.691 6.136 -4.759 1.00 0.00 H new ATOM 0 HZ1 LYS C 39 74.346 5.467 -7.015 1.00 0.00 H new ATOM 0 HZ2 LYS C 39 72.675 5.759 -6.954 1.00 0.00 H new ATOM 0 HZ3 LYS C 39 73.713 6.907 -7.652 1.00 0.00 H new ATOM 601 N GLU C 40 68.981 6.552 -3.628 1.00 0.00 N ATOM 602 CA GLU C 40 67.923 6.032 -4.541 1.00 0.00 C ATOM 603 C GLU C 40 66.544 6.293 -3.929 1.00 0.00 C ATOM 604 O GLU C 40 65.582 6.559 -4.622 1.00 0.00 O ATOM 605 CB GLU C 40 68.177 4.525 -4.633 1.00 0.00 C ATOM 606 CG GLU C 40 69.653 4.262 -4.944 1.00 0.00 C ATOM 607 CD GLU C 40 70.433 4.093 -3.639 1.00 0.00 C ATOM 608 OE1 GLU C 40 69.961 4.574 -2.622 1.00 0.00 O ATOM 609 OE2 GLU C 40 71.491 3.486 -3.679 1.00 0.00 O ATOM 0 H GLU C 40 69.276 5.905 -2.897 1.00 0.00 H new ATOM 0 HA GLU C 40 67.949 6.510 -5.520 1.00 0.00 H new ATOM 0 HB2 GLU C 40 67.903 4.043 -3.694 1.00 0.00 H new ATOM 0 HB3 GLU C 40 67.549 4.089 -5.410 1.00 0.00 H new ATOM 0 HG2 GLU C 40 69.751 3.366 -5.556 1.00 0.00 H new ATOM 0 HG3 GLU C 40 70.066 5.089 -5.521 1.00 0.00 H new ATOM 616 N LEU C 41 66.450 6.209 -2.630 1.00 0.00 N ATOM 617 CA LEU C 41 65.143 6.439 -1.948 1.00 0.00 C ATOM 618 C LEU C 41 64.809 7.934 -1.918 1.00 0.00 C ATOM 619 O LEU C 41 63.710 8.342 -2.240 1.00 0.00 O ATOM 620 CB LEU C 41 65.358 5.908 -0.529 1.00 0.00 C ATOM 621 CG LEU C 41 64.016 5.511 0.084 1.00 0.00 C ATOM 622 CD1 LEU C 41 63.008 6.636 -0.133 1.00 0.00 C ATOM 623 CD2 LEU C 41 63.505 4.232 -0.582 1.00 0.00 C ATOM 0 H LEU C 41 67.227 5.989 -2.007 1.00 0.00 H new ATOM 0 HA LEU C 41 64.314 5.946 -2.456 1.00 0.00 H new ATOM 0 HB2 LEU C 41 66.027 5.048 -0.550 1.00 0.00 H new ATOM 0 HB3 LEU C 41 65.838 6.670 0.085 1.00 0.00 H new ATOM 0 HG LEU C 41 64.143 5.335 1.152 1.00 0.00 H new ATOM 0 HD11 LEU C 41 62.050 6.355 0.304 1.00 0.00 H new ATOM 0 HD12 LEU C 41 63.371 7.547 0.344 1.00 0.00 H new ATOM 0 HD13 LEU C 41 62.883 6.811 -1.202 1.00 0.00 H new ATOM 0 HD21 LEU C 41 62.548 3.951 -0.143 1.00 0.00 H new ATOM 0 HD22 LEU C 41 63.378 4.404 -1.651 1.00 0.00 H new ATOM 0 HD23 LEU C 41 64.225 3.429 -0.427 1.00 0.00 H new ATOM 635 N GLY C 42 65.746 8.753 -1.528 1.00 0.00 N ATOM 636 CA GLY C 42 65.483 10.220 -1.469 1.00 0.00 C ATOM 637 C GLY C 42 64.935 10.708 -2.813 1.00 0.00 C ATOM 638 O GLY C 42 64.110 11.599 -2.868 1.00 0.00 O ATOM 0 H GLY C 42 66.685 8.470 -1.247 1.00 0.00 H new ATOM 0 HA2 GLY C 42 64.769 10.438 -0.675 1.00 0.00 H new ATOM 0 HA3 GLY C 42 66.402 10.753 -1.226 1.00 0.00 H new ATOM 642 N LYS C 43 65.388 10.139 -3.895 1.00 0.00 N ATOM 643 CA LYS C 43 64.893 10.581 -5.232 1.00 0.00 C ATOM 644 C LYS C 43 63.362 10.647 -5.241 1.00 0.00 C ATOM 645 O LYS C 43 62.769 11.381 -6.007 1.00 0.00 O ATOM 646 CB LYS C 43 65.390 9.518 -6.212 1.00 0.00 C ATOM 647 CG LYS C 43 66.571 10.073 -7.010 1.00 0.00 C ATOM 648 CD LYS C 43 66.834 9.179 -8.222 1.00 0.00 C ATOM 649 CE LYS C 43 65.850 9.530 -9.340 1.00 0.00 C ATOM 650 NZ LYS C 43 65.134 8.258 -9.634 1.00 0.00 N ATOM 0 H LYS C 43 66.078 9.388 -3.913 1.00 0.00 H new ATOM 0 HA LYS C 43 65.252 11.576 -5.493 1.00 0.00 H new ATOM 0 HB2 LYS C 43 65.692 8.622 -5.670 1.00 0.00 H new ATOM 0 HB3 LYS C 43 64.586 9.226 -6.887 1.00 0.00 H new ATOM 0 HG2 LYS C 43 66.357 11.091 -7.336 1.00 0.00 H new ATOM 0 HG3 LYS C 43 67.459 10.120 -6.380 1.00 0.00 H new ATOM 0 HD2 LYS C 43 67.858 9.312 -8.570 1.00 0.00 H new ATOM 0 HD3 LYS C 43 66.726 8.131 -7.944 1.00 0.00 H new ATOM 0 HE2 LYS C 43 65.157 10.310 -9.025 1.00 0.00 H new ATOM 0 HE3 LYS C 43 66.371 9.903 -10.222 1.00 0.00 H new ATOM 0 HZ1 LYS C 43 64.440 8.417 -10.392 1.00 0.00 H new ATOM 0 HZ2 LYS C 43 65.819 7.536 -9.937 1.00 0.00 H new ATOM 0 HZ3 LYS C 43 64.642 7.931 -8.778 1.00 0.00 H new ATOM 664 N VAL C 44 62.719 9.885 -4.399 1.00 0.00 N ATOM 665 CA VAL C 44 61.227 9.907 -4.363 1.00 0.00 C ATOM 666 C VAL C 44 60.739 11.035 -3.448 1.00 0.00 C ATOM 667 O VAL C 44 59.806 11.744 -3.766 1.00 0.00 O ATOM 668 CB VAL C 44 60.830 8.533 -3.807 1.00 0.00 C ATOM 669 CG1 VAL C 44 59.454 8.612 -3.134 1.00 0.00 C ATOM 670 CG2 VAL C 44 60.774 7.519 -4.953 1.00 0.00 C ATOM 0 H VAL C 44 63.160 9.249 -3.735 1.00 0.00 H new ATOM 0 HA VAL C 44 60.785 10.089 -5.342 1.00 0.00 H new ATOM 0 HB VAL C 44 61.570 8.221 -3.070 1.00 0.00 H new ATOM 0 HG11 VAL C 44 59.183 7.631 -2.743 1.00 0.00 H new ATOM 0 HG12 VAL C 44 59.490 9.331 -2.316 1.00 0.00 H new ATOM 0 HG13 VAL C 44 58.710 8.930 -3.864 1.00 0.00 H new ATOM 0 HG21 VAL C 44 60.492 6.542 -4.561 1.00 0.00 H new ATOM 0 HG22 VAL C 44 60.037 7.841 -5.688 1.00 0.00 H new ATOM 0 HG23 VAL C 44 61.753 7.451 -5.427 1.00 0.00 H new ATOM 680 N MET C 45 61.360 11.200 -2.312 1.00 0.00 N ATOM 681 CA MET C 45 60.929 12.276 -1.372 1.00 0.00 C ATOM 682 C MET C 45 60.604 13.556 -2.146 1.00 0.00 C ATOM 683 O MET C 45 59.559 14.150 -1.969 1.00 0.00 O ATOM 684 CB MET C 45 62.122 12.493 -0.441 1.00 0.00 C ATOM 685 CG MET C 45 62.009 11.551 0.762 1.00 0.00 C ATOM 686 SD MET C 45 62.498 9.876 0.275 1.00 0.00 S ATOM 687 CE MET C 45 60.860 9.287 -0.226 1.00 0.00 C ATOM 0 H MET C 45 62.148 10.636 -1.993 1.00 0.00 H new ATOM 0 HA MET C 45 60.029 12.006 -0.819 1.00 0.00 H new ATOM 0 HB2 MET C 45 63.053 12.307 -0.976 1.00 0.00 H new ATOM 0 HB3 MET C 45 62.150 13.529 -0.104 1.00 0.00 H new ATOM 0 HG2 MET C 45 62.645 11.904 1.574 1.00 0.00 H new ATOM 0 HG3 MET C 45 60.986 11.547 1.138 1.00 0.00 H new ATOM 0 HE1 MET C 45 60.966 8.555 -1.026 1.00 0.00 H new ATOM 0 HE2 MET C 45 60.364 8.824 0.627 1.00 0.00 H new ATOM 0 HE3 MET C 45 60.264 10.128 -0.580 1.00 0.00 H new ATOM 697 N ARG C 46 61.487 13.984 -3.006 1.00 0.00 N ATOM 698 CA ARG C 46 61.218 15.221 -3.791 1.00 0.00 C ATOM 699 C ARG C 46 60.215 14.923 -4.908 1.00 0.00 C ATOM 700 O ARG C 46 59.620 15.817 -5.476 1.00 0.00 O ATOM 701 CB ARG C 46 62.570 15.625 -4.376 1.00 0.00 C ATOM 702 CG ARG C 46 63.011 14.586 -5.408 1.00 0.00 C ATOM 703 CD ARG C 46 64.441 14.889 -5.859 1.00 0.00 C ATOM 704 NE ARG C 46 64.384 16.268 -6.414 1.00 0.00 N ATOM 705 CZ ARG C 46 65.474 16.979 -6.508 1.00 0.00 C ATOM 706 NH1 ARG C 46 66.278 17.078 -5.484 1.00 0.00 N ATOM 707 NH2 ARG C 46 65.761 17.592 -7.625 1.00 0.00 N ATOM 0 H ARG C 46 62.381 13.532 -3.199 1.00 0.00 H new ATOM 0 HA ARG C 46 60.790 16.015 -3.179 1.00 0.00 H new ATOM 0 HB2 ARG C 46 62.497 16.608 -4.842 1.00 0.00 H new ATOM 0 HB3 ARG C 46 63.313 15.703 -3.582 1.00 0.00 H new ATOM 0 HG2 ARG C 46 62.958 13.586 -4.978 1.00 0.00 H new ATOM 0 HG3 ARG C 46 62.337 14.600 -6.265 1.00 0.00 H new ATOM 0 HD2 ARG C 46 65.140 14.828 -5.025 1.00 0.00 H new ATOM 0 HD3 ARG C 46 64.778 14.175 -6.610 1.00 0.00 H new ATOM 0 HE ARG C 46 63.493 16.658 -6.721 1.00 0.00 H new ATOM 0 HH11 ARG C 46 66.054 16.600 -4.611 1.00 0.00 H new ATOM 0 HH12 ARG C 46 67.130 17.634 -5.557 1.00 0.00 H new ATOM 0 HH21 ARG C 46 65.133 17.515 -8.425 1.00 0.00 H new ATOM 0 HH22 ARG C 46 66.613 18.148 -7.697 1.00 0.00 H new ATOM 721 N MET C 47 60.021 13.671 -5.225 1.00 0.00 N ATOM 722 CA MET C 47 59.053 13.318 -6.302 1.00 0.00 C ATOM 723 C MET C 47 57.640 13.209 -5.725 1.00 0.00 C ATOM 724 O MET C 47 56.673 13.597 -6.351 1.00 0.00 O ATOM 725 CB MET C 47 59.523 11.965 -6.834 1.00 0.00 C ATOM 726 CG MET C 47 59.739 12.062 -8.344 1.00 0.00 C ATOM 727 SD MET C 47 60.641 10.604 -8.921 1.00 0.00 S ATOM 728 CE MET C 47 59.203 9.536 -9.169 1.00 0.00 C ATOM 0 H MET C 47 60.490 12.879 -4.785 1.00 0.00 H new ATOM 0 HA MET C 47 59.018 14.072 -7.089 1.00 0.00 H new ATOM 0 HB2 MET C 47 60.449 11.670 -6.341 1.00 0.00 H new ATOM 0 HB3 MET C 47 58.783 11.196 -6.610 1.00 0.00 H new ATOM 0 HG2 MET C 47 58.779 12.134 -8.855 1.00 0.00 H new ATOM 0 HG3 MET C 47 60.297 12.967 -8.585 1.00 0.00 H new ATOM 0 HE1 MET C 47 59.514 8.492 -9.128 1.00 0.00 H new ATOM 0 HE2 MET C 47 58.469 9.727 -8.386 1.00 0.00 H new ATOM 0 HE3 MET C 47 58.758 9.744 -10.142 1.00 0.00 H new ATOM 738 N LEU C 48 57.509 12.691 -4.532 1.00 0.00 N ATOM 739 CA LEU C 48 56.152 12.572 -3.924 1.00 0.00 C ATOM 740 C LEU C 48 55.580 13.972 -3.669 1.00 0.00 C ATOM 741 O LEU C 48 54.386 14.188 -3.725 1.00 0.00 O ATOM 742 CB LEU C 48 56.358 11.829 -2.599 1.00 0.00 C ATOM 743 CG LEU C 48 57.098 10.508 -2.838 1.00 0.00 C ATOM 744 CD1 LEU C 48 57.297 9.790 -1.502 1.00 0.00 C ATOM 745 CD2 LEU C 48 56.278 9.616 -3.775 1.00 0.00 C ATOM 0 H LEU C 48 58.278 12.347 -3.956 1.00 0.00 H new ATOM 0 HA LEU C 48 55.453 12.043 -4.573 1.00 0.00 H new ATOM 0 HB2 LEU C 48 56.927 12.453 -1.909 1.00 0.00 H new ATOM 0 HB3 LEU C 48 55.394 11.634 -2.130 1.00 0.00 H new ATOM 0 HG LEU C 48 58.066 10.715 -3.293 1.00 0.00 H new ATOM 0 HD11 LEU C 48 57.823 8.850 -1.669 1.00 0.00 H new ATOM 0 HD12 LEU C 48 57.884 10.421 -0.834 1.00 0.00 H new ATOM 0 HD13 LEU C 48 56.326 9.587 -1.050 1.00 0.00 H new ATOM 0 HD21 LEU C 48 56.809 8.678 -3.942 1.00 0.00 H new ATOM 0 HD22 LEU C 48 55.308 9.409 -3.323 1.00 0.00 H new ATOM 0 HD23 LEU C 48 56.133 10.125 -4.728 1.00 0.00 H new ATOM 757 N GLY C 49 56.424 14.925 -3.391 1.00 0.00 N ATOM 758 CA GLY C 49 55.928 16.308 -3.136 1.00 0.00 C ATOM 759 C GLY C 49 56.378 16.769 -1.748 1.00 0.00 C ATOM 760 O GLY C 49 55.778 17.636 -1.146 1.00 0.00 O ATOM 0 H GLY C 49 57.435 14.808 -3.329 1.00 0.00 H new ATOM 0 HA2 GLY C 49 56.310 16.988 -3.897 1.00 0.00 H new ATOM 0 HA3 GLY C 49 54.840 16.333 -3.203 1.00 0.00 H new ATOM 764 N GLN C 50 57.433 16.196 -1.235 1.00 0.00 N ATOM 765 CA GLN C 50 57.920 16.604 0.112 1.00 0.00 C ATOM 766 C GLN C 50 59.441 16.461 0.186 1.00 0.00 C ATOM 767 O GLN C 50 60.085 16.081 -0.772 1.00 0.00 O ATOM 768 CB GLN C 50 57.241 15.642 1.088 1.00 0.00 C ATOM 769 CG GLN C 50 56.624 16.436 2.239 1.00 0.00 C ATOM 770 CD GLN C 50 55.099 16.414 2.117 1.00 0.00 C ATOM 771 OE1 GLN C 50 54.463 17.448 2.097 1.00 0.00 O ATOM 772 NE2 GLN C 50 54.481 15.267 2.032 1.00 0.00 N ATOM 0 H GLN C 50 57.978 15.464 -1.691 1.00 0.00 H new ATOM 0 HA GLN C 50 57.687 17.644 0.339 1.00 0.00 H new ATOM 0 HB2 GLN C 50 56.470 15.069 0.573 1.00 0.00 H new ATOM 0 HB3 GLN C 50 57.967 14.926 1.474 1.00 0.00 H new ATOM 0 HG2 GLN C 50 56.929 16.008 3.194 1.00 0.00 H new ATOM 0 HG3 GLN C 50 56.986 17.464 2.220 1.00 0.00 H new ATOM 0 HE21 GLN C 50 55.014 14.398 2.049 1.00 0.00 H new ATOM 0 HE22 GLN C 50 53.465 15.240 1.949 1.00 0.00 H new ATOM 781 N ASN C 51 60.022 16.765 1.313 1.00 0.00 N ATOM 782 CA ASN C 51 61.501 16.644 1.439 1.00 0.00 C ATOM 783 C ASN C 51 61.915 16.665 2.912 1.00 0.00 C ATOM 784 O ASN C 51 62.157 17.714 3.476 1.00 0.00 O ATOM 785 CB ASN C 51 62.061 17.866 0.709 1.00 0.00 C ATOM 786 CG ASN C 51 61.447 19.138 1.298 1.00 0.00 C ATOM 787 OD1 ASN C 51 60.248 19.327 1.250 1.00 0.00 O ATOM 788 ND2 ASN C 51 62.227 20.025 1.856 1.00 0.00 N ATOM 0 H ASN C 51 59.538 17.091 2.150 1.00 0.00 H new ATOM 0 HA ASN C 51 61.874 15.709 1.020 1.00 0.00 H new ATOM 0 HB2 ASN C 51 63.146 17.895 0.806 1.00 0.00 H new ATOM 0 HB3 ASN C 51 61.837 17.801 -0.356 1.00 0.00 H new ATOM 0 HD21 ASN C 51 61.829 20.877 2.252 1.00 0.00 H new ATOM 0 HD22 ASN C 51 63.234 19.866 1.896 1.00 0.00 H new ATOM 795 N PRO C 52 61.987 15.495 3.486 1.00 0.00 N ATOM 796 CA PRO C 52 62.383 15.369 4.908 1.00 0.00 C ATOM 797 C PRO C 52 63.885 15.625 5.061 1.00 0.00 C ATOM 798 O PRO C 52 64.532 16.129 4.164 1.00 0.00 O ATOM 799 CB PRO C 52 62.036 13.923 5.248 1.00 0.00 C ATOM 800 CG PRO C 52 62.064 13.196 3.940 1.00 0.00 C ATOM 801 CD PRO C 52 61.708 14.194 2.868 1.00 0.00 C ATOM 0 HA PRO C 52 61.884 16.084 5.562 1.00 0.00 H new ATOM 0 HB2 PRO C 52 62.755 13.500 5.949 1.00 0.00 H new ATOM 0 HB3 PRO C 52 61.054 13.853 5.717 1.00 0.00 H new ATOM 0 HG2 PRO C 52 63.051 12.771 3.757 1.00 0.00 H new ATOM 0 HG3 PRO C 52 61.356 12.368 3.945 1.00 0.00 H new ATOM 0 HD2 PRO C 52 62.305 14.043 1.969 1.00 0.00 H new ATOM 0 HD3 PRO C 52 60.662 14.108 2.574 1.00 0.00 H new ATOM 809 N THR C 53 64.446 15.284 6.188 1.00 0.00 N ATOM 810 CA THR C 53 65.906 15.510 6.389 1.00 0.00 C ATOM 811 C THR C 53 66.701 14.303 5.884 1.00 0.00 C ATOM 812 O THR C 53 66.166 13.220 5.752 1.00 0.00 O ATOM 813 CB THR C 53 66.079 15.671 7.901 1.00 0.00 C ATOM 814 OG1 THR C 53 65.269 14.717 8.572 1.00 0.00 O ATOM 815 CG2 THR C 53 65.661 17.082 8.318 1.00 0.00 C ATOM 0 H THR C 53 63.959 14.860 6.977 1.00 0.00 H new ATOM 0 HA THR C 53 66.268 16.381 5.843 1.00 0.00 H new ATOM 0 HB THR C 53 67.124 15.512 8.166 1.00 0.00 H new ATOM 0 HG1 THR C 53 64.428 15.138 8.847 1.00 0.00 H new ATOM 0 HG21 THR C 53 65.785 17.195 9.395 1.00 0.00 H new ATOM 0 HG22 THR C 53 66.284 17.813 7.803 1.00 0.00 H new ATOM 0 HG23 THR C 53 64.616 17.245 8.054 1.00 0.00 H new ATOM 823 N PRO C 54 67.959 14.532 5.621 1.00 0.00 N ATOM 824 CA PRO C 54 68.845 13.450 5.127 1.00 0.00 C ATOM 825 C PRO C 54 69.137 12.453 6.252 1.00 0.00 C ATOM 826 O PRO C 54 69.197 11.259 6.036 1.00 0.00 O ATOM 827 CB PRO C 54 70.112 14.188 4.705 1.00 0.00 C ATOM 828 CG PRO C 54 70.112 15.447 5.511 1.00 0.00 C ATOM 829 CD PRO C 54 68.670 15.808 5.758 1.00 0.00 C ATOM 0 HA PRO C 54 68.409 12.871 4.313 1.00 0.00 H new ATOM 0 HB2 PRO C 54 71.002 13.591 4.905 1.00 0.00 H new ATOM 0 HB3 PRO C 54 70.106 14.403 3.636 1.00 0.00 H new ATOM 0 HG2 PRO C 54 70.641 15.302 6.453 1.00 0.00 H new ATOM 0 HG3 PRO C 54 70.625 16.247 4.977 1.00 0.00 H new ATOM 0 HD2 PRO C 54 68.530 16.239 6.749 1.00 0.00 H new ATOM 0 HD3 PRO C 54 68.313 16.544 5.037 1.00 0.00 H new ATOM 837 N GLU C 55 69.313 12.935 7.452 1.00 0.00 N ATOM 838 CA GLU C 55 69.594 12.014 8.590 1.00 0.00 C ATOM 839 C GLU C 55 68.385 11.108 8.837 1.00 0.00 C ATOM 840 O GLU C 55 68.519 9.985 9.278 1.00 0.00 O ATOM 841 CB GLU C 55 69.838 12.927 9.793 1.00 0.00 C ATOM 842 CG GLU C 55 71.160 12.547 10.463 1.00 0.00 C ATOM 843 CD GLU C 55 72.327 13.038 9.606 1.00 0.00 C ATOM 844 OE1 GLU C 55 72.095 13.866 8.740 1.00 0.00 O ATOM 845 OE2 GLU C 55 73.435 12.576 9.828 1.00 0.00 O ATOM 0 H GLU C 55 69.274 13.925 7.694 1.00 0.00 H new ATOM 0 HA GLU C 55 70.448 11.364 8.398 1.00 0.00 H new ATOM 0 HB2 GLU C 55 69.867 13.968 9.473 1.00 0.00 H new ATOM 0 HB3 GLU C 55 69.018 12.835 10.505 1.00 0.00 H new ATOM 0 HG2 GLU C 55 71.215 12.988 11.458 1.00 0.00 H new ATOM 0 HG3 GLU C 55 71.218 11.466 10.590 1.00 0.00 H new ATOM 852 N GLU C 56 67.205 11.589 8.553 1.00 0.00 N ATOM 853 CA GLU C 56 65.989 10.754 8.768 1.00 0.00 C ATOM 854 C GLU C 56 65.833 9.751 7.623 1.00 0.00 C ATOM 855 O GLU C 56 65.245 8.699 7.781 1.00 0.00 O ATOM 856 CB GLU C 56 64.822 11.743 8.773 1.00 0.00 C ATOM 857 CG GLU C 56 64.563 12.220 10.202 1.00 0.00 C ATOM 858 CD GLU C 56 63.188 12.885 10.275 1.00 0.00 C ATOM 859 OE1 GLU C 56 63.052 13.978 9.750 1.00 0.00 O ATOM 860 OE2 GLU C 56 62.292 12.290 10.852 1.00 0.00 O ATOM 0 H GLU C 56 67.031 12.523 8.182 1.00 0.00 H new ATOM 0 HA GLU C 56 66.040 10.180 9.693 1.00 0.00 H new ATOM 0 HB2 GLU C 56 65.050 12.593 8.130 1.00 0.00 H new ATOM 0 HB3 GLU C 56 63.928 11.268 8.369 1.00 0.00 H new ATOM 0 HG2 GLU C 56 64.609 11.377 10.892 1.00 0.00 H new ATOM 0 HG3 GLU C 56 65.336 12.925 10.508 1.00 0.00 H new ATOM 867 N LEU C 57 66.357 10.068 6.470 1.00 0.00 N ATOM 868 CA LEU C 57 66.241 9.131 5.316 1.00 0.00 C ATOM 869 C LEU C 57 66.792 7.757 5.704 1.00 0.00 C ATOM 870 O LEU C 57 66.080 6.772 5.715 1.00 0.00 O ATOM 871 CB LEU C 57 67.090 9.756 4.209 1.00 0.00 C ATOM 872 CG LEU C 57 66.227 9.976 2.967 1.00 0.00 C ATOM 873 CD1 LEU C 57 67.082 10.573 1.848 1.00 0.00 C ATOM 874 CD2 LEU C 57 65.648 8.636 2.506 1.00 0.00 C ATOM 0 H LEU C 57 66.860 10.934 6.277 1.00 0.00 H new ATOM 0 HA LEU C 57 65.208 8.986 5.000 1.00 0.00 H new ATOM 0 HB2 LEU C 57 67.507 10.704 4.548 1.00 0.00 H new ATOM 0 HB3 LEU C 57 67.931 9.105 3.970 1.00 0.00 H new ATOM 0 HG LEU C 57 65.414 10.662 3.207 1.00 0.00 H new ATOM 0 HD11 LEU C 57 66.465 10.729 0.963 1.00 0.00 H new ATOM 0 HD12 LEU C 57 67.495 11.527 2.175 1.00 0.00 H new ATOM 0 HD13 LEU C 57 67.895 9.889 1.607 1.00 0.00 H new ATOM 0 HD21 LEU C 57 65.032 8.791 1.620 1.00 0.00 H new ATOM 0 HD22 LEU C 57 66.462 7.951 2.267 1.00 0.00 H new ATOM 0 HD23 LEU C 57 65.037 8.210 3.302 1.00 0.00 H new ATOM 886 N GLN C 58 68.055 7.685 6.025 1.00 0.00 N ATOM 887 CA GLN C 58 68.652 6.376 6.416 1.00 0.00 C ATOM 888 C GLN C 58 67.699 5.623 7.348 1.00 0.00 C ATOM 889 O GLN C 58 67.540 4.423 7.249 1.00 0.00 O ATOM 890 CB GLN C 58 69.947 6.735 7.145 1.00 0.00 C ATOM 891 CG GLN C 58 71.092 5.872 6.611 1.00 0.00 C ATOM 892 CD GLN C 58 71.416 4.772 7.623 1.00 0.00 C ATOM 893 OE1 GLN C 58 71.338 4.988 8.817 1.00 0.00 O ATOM 894 NE2 GLN C 58 71.778 3.592 7.197 1.00 0.00 N ATOM 0 H GLN C 58 68.699 8.476 6.033 1.00 0.00 H new ATOM 0 HA GLN C 58 68.835 5.729 5.558 1.00 0.00 H new ATOM 0 HB2 GLN C 58 70.176 7.791 7.002 1.00 0.00 H new ATOM 0 HB3 GLN C 58 69.829 6.577 8.217 1.00 0.00 H new ATOM 0 HG2 GLN C 58 70.813 5.430 5.654 1.00 0.00 H new ATOM 0 HG3 GLN C 58 71.973 6.488 6.433 1.00 0.00 H new ATOM 0 HE21 GLN C 58 71.844 3.409 6.196 1.00 0.00 H new ATOM 0 HE22 GLN C 58 71.995 2.853 7.866 1.00 0.00 H new ATOM 903 N GLU C 59 67.059 6.319 8.249 1.00 0.00 N ATOM 904 CA GLU C 59 66.114 5.637 9.177 1.00 0.00 C ATOM 905 C GLU C 59 65.234 4.664 8.392 1.00 0.00 C ATOM 906 O GLU C 59 65.129 3.500 8.724 1.00 0.00 O ATOM 907 CB GLU C 59 65.269 6.758 9.784 1.00 0.00 C ATOM 908 CG GLU C 59 64.462 6.208 10.961 1.00 0.00 C ATOM 909 CD GLU C 59 65.067 6.707 12.274 1.00 0.00 C ATOM 910 OE1 GLU C 59 66.222 6.404 12.525 1.00 0.00 O ATOM 911 OE2 GLU C 59 64.365 7.384 13.007 1.00 0.00 O ATOM 0 H GLU C 59 67.150 7.326 8.382 1.00 0.00 H new ATOM 0 HA GLU C 59 66.628 5.060 9.946 1.00 0.00 H new ATOM 0 HB2 GLU C 59 65.912 7.572 10.119 1.00 0.00 H new ATOM 0 HB3 GLU C 59 64.598 7.171 9.031 1.00 0.00 H new ATOM 0 HG2 GLU C 59 63.423 6.527 10.883 1.00 0.00 H new ATOM 0 HG3 GLU C 59 64.464 5.118 10.939 1.00 0.00 H new ATOM 918 N MET C 60 64.608 5.130 7.346 1.00 0.00 N ATOM 919 CA MET C 60 63.744 4.228 6.535 1.00 0.00 C ATOM 920 C MET C 60 64.513 2.950 6.194 1.00 0.00 C ATOM 921 O MET C 60 63.957 1.870 6.150 1.00 0.00 O ATOM 922 CB MET C 60 63.424 5.020 5.266 1.00 0.00 C ATOM 923 CG MET C 60 62.408 6.116 5.592 1.00 0.00 C ATOM 924 SD MET C 60 62.486 7.406 4.322 1.00 0.00 S ATOM 925 CE MET C 60 60.701 7.643 4.131 1.00 0.00 C ATOM 0 H MET C 60 64.658 6.095 7.019 1.00 0.00 H new ATOM 0 HA MET C 60 62.838 3.929 7.062 1.00 0.00 H new ATOM 0 HB2 MET C 60 64.334 5.462 4.861 1.00 0.00 H new ATOM 0 HB3 MET C 60 63.025 4.355 4.500 1.00 0.00 H new ATOM 0 HG2 MET C 60 61.404 5.695 5.637 1.00 0.00 H new ATOM 0 HG3 MET C 60 62.619 6.543 6.573 1.00 0.00 H new ATOM 0 HE1 MET C 60 60.424 7.496 3.087 1.00 0.00 H new ATOM 0 HE2 MET C 60 60.170 6.922 4.752 1.00 0.00 H new ATOM 0 HE3 MET C 60 60.433 8.654 4.439 1.00 0.00 H new ATOM 935 N ILE C 61 65.792 3.065 5.960 1.00 0.00 N ATOM 936 CA ILE C 61 66.603 1.859 5.633 1.00 0.00 C ATOM 937 C ILE C 61 66.903 1.074 6.910 1.00 0.00 C ATOM 938 O ILE C 61 66.706 -0.124 6.978 1.00 0.00 O ATOM 939 CB ILE C 61 67.895 2.402 5.022 1.00 0.00 C ATOM 940 CG1 ILE C 61 67.609 2.935 3.615 1.00 0.00 C ATOM 941 CG2 ILE C 61 68.932 1.280 4.937 1.00 0.00 C ATOM 942 CD1 ILE C 61 67.015 4.340 3.711 1.00 0.00 C ATOM 0 H ILE C 61 66.310 3.943 5.981 1.00 0.00 H new ATOM 0 HA ILE C 61 66.087 1.182 4.952 1.00 0.00 H new ATOM 0 HB ILE C 61 68.280 3.208 5.647 1.00 0.00 H new ATOM 0 HG12 ILE C 61 68.528 2.957 3.029 1.00 0.00 H new ATOM 0 HG13 ILE C 61 66.917 2.271 3.097 1.00 0.00 H new ATOM 0 HG21 ILE C 61 69.853 1.668 4.501 1.00 0.00 H new ATOM 0 HG22 ILE C 61 69.137 0.897 5.937 1.00 0.00 H new ATOM 0 HG23 ILE C 61 68.546 0.475 4.312 1.00 0.00 H new ATOM 0 HD11 ILE C 61 66.812 4.718 2.709 1.00 0.00 H new ATOM 0 HD12 ILE C 61 66.086 4.304 4.281 1.00 0.00 H new ATOM 0 HD13 ILE C 61 67.723 5.001 4.212 1.00 0.00 H new ATOM 954 N ASP C 62 67.376 1.743 7.927 1.00 0.00 N ATOM 955 CA ASP C 62 67.686 1.041 9.205 1.00 0.00 C ATOM 956 C ASP C 62 66.415 0.407 9.776 1.00 0.00 C ATOM 957 O ASP C 62 66.469 -0.479 10.606 1.00 0.00 O ATOM 958 CB ASP C 62 68.206 2.134 10.139 1.00 0.00 C ATOM 959 CG ASP C 62 68.654 1.509 11.461 1.00 0.00 C ATOM 960 OD1 ASP C 62 69.772 1.024 11.515 1.00 0.00 O ATOM 961 OD2 ASP C 62 67.871 1.526 12.396 1.00 0.00 O ATOM 0 H ASP C 62 67.561 2.746 7.928 1.00 0.00 H new ATOM 0 HA ASP C 62 68.412 0.239 9.073 1.00 0.00 H new ATOM 0 HB2 ASP C 62 69.040 2.659 9.672 1.00 0.00 H new ATOM 0 HB3 ASP C 62 67.426 2.873 10.321 1.00 0.00 H new ATOM 966 N GLU C 63 65.271 0.855 9.335 1.00 0.00 N ATOM 967 CA GLU C 63 63.994 0.281 9.849 1.00 0.00 C ATOM 968 C GLU C 63 63.854 -1.176 9.399 1.00 0.00 C ATOM 969 O GLU C 63 63.070 -1.930 9.941 1.00 0.00 O ATOM 970 CB GLU C 63 62.896 1.143 9.225 1.00 0.00 C ATOM 971 CG GLU C 63 62.005 1.717 10.329 1.00 0.00 C ATOM 972 CD GLU C 63 60.962 2.649 9.709 1.00 0.00 C ATOM 973 OE1 GLU C 63 60.459 2.321 8.647 1.00 0.00 O ATOM 974 OE2 GLU C 63 60.684 3.675 10.307 1.00 0.00 O ATOM 0 H GLU C 63 65.165 1.594 8.640 1.00 0.00 H new ATOM 0 HA GLU C 63 63.945 0.284 10.938 1.00 0.00 H new ATOM 0 HB2 GLU C 63 63.340 1.952 8.645 1.00 0.00 H new ATOM 0 HB3 GLU C 63 62.299 0.546 8.535 1.00 0.00 H new ATOM 0 HG2 GLU C 63 61.511 0.909 10.869 1.00 0.00 H new ATOM 0 HG3 GLU C 63 62.610 2.262 11.053 1.00 0.00 H new ATOM 981 N VAL C 64 64.608 -1.576 8.413 1.00 0.00 N ATOM 982 CA VAL C 64 64.518 -2.984 7.928 1.00 0.00 C ATOM 983 C VAL C 64 65.914 -3.516 7.594 1.00 0.00 C ATOM 984 O VAL C 64 66.100 -4.249 6.644 1.00 0.00 O ATOM 985 CB VAL C 64 63.658 -2.913 6.666 1.00 0.00 C ATOM 986 CG1 VAL C 64 62.209 -2.610 7.053 1.00 0.00 C ATOM 987 CG2 VAL C 64 64.183 -1.801 5.756 1.00 0.00 C ATOM 0 H VAL C 64 65.283 -0.990 7.921 1.00 0.00 H new ATOM 0 HA VAL C 64 64.092 -3.653 8.676 1.00 0.00 H new ATOM 0 HB VAL C 64 63.703 -3.867 6.141 1.00 0.00 H new ATOM 0 HG11 VAL C 64 61.595 -2.559 6.154 1.00 0.00 H new ATOM 0 HG12 VAL C 64 61.834 -3.399 7.704 1.00 0.00 H new ATOM 0 HG13 VAL C 64 62.164 -1.655 7.577 1.00 0.00 H new ATOM 0 HG21 VAL C 64 63.571 -1.749 4.855 1.00 0.00 H new ATOM 0 HG22 VAL C 64 64.136 -0.848 6.282 1.00 0.00 H new ATOM 0 HG23 VAL C 64 65.216 -2.013 5.481 1.00 0.00 H new ATOM 997 N ASP C 65 66.899 -3.149 8.368 1.00 0.00 N ATOM 998 CA ASP C 65 68.282 -3.632 8.093 1.00 0.00 C ATOM 999 C ASP C 65 68.691 -4.687 9.125 1.00 0.00 C ATOM 1000 O ASP C 65 69.168 -4.370 10.197 1.00 0.00 O ATOM 1001 CB ASP C 65 69.167 -2.390 8.215 1.00 0.00 C ATOM 1002 CG ASP C 65 70.151 -2.349 7.046 1.00 0.00 C ATOM 1003 OD1 ASP C 65 70.588 -3.408 6.626 1.00 0.00 O ATOM 1004 OD2 ASP C 65 70.453 -1.258 6.590 1.00 0.00 O ATOM 0 H ASP C 65 66.806 -2.536 9.178 1.00 0.00 H new ATOM 0 HA ASP C 65 68.368 -4.099 7.112 1.00 0.00 H new ATOM 0 HB2 ASP C 65 68.551 -1.490 8.218 1.00 0.00 H new ATOM 0 HB3 ASP C 65 69.709 -2.408 9.160 1.00 0.00 H new ATOM 1009 N GLU C 66 68.504 -5.940 8.811 1.00 0.00 N ATOM 1010 CA GLU C 66 68.880 -7.015 9.773 1.00 0.00 C ATOM 1011 C GLU C 66 70.315 -7.482 9.517 1.00 0.00 C ATOM 1012 O GLU C 66 70.662 -8.620 9.768 1.00 0.00 O ATOM 1013 CB GLU C 66 67.890 -8.147 9.502 1.00 0.00 C ATOM 1014 CG GLU C 66 68.015 -9.208 10.596 1.00 0.00 C ATOM 1015 CD GLU C 66 66.907 -10.249 10.427 1.00 0.00 C ATOM 1016 OE1 GLU C 66 66.183 -10.161 9.449 1.00 0.00 O ATOM 1017 OE2 GLU C 66 66.800 -11.116 11.279 1.00 0.00 O ATOM 0 H GLU C 66 68.107 -6.266 7.930 1.00 0.00 H new ATOM 0 HA GLU C 66 68.841 -6.675 10.808 1.00 0.00 H new ATOM 0 HB2 GLU C 66 66.873 -7.756 9.475 1.00 0.00 H new ATOM 0 HB3 GLU C 66 68.087 -8.591 8.526 1.00 0.00 H new ATOM 0 HG2 GLU C 66 68.992 -9.689 10.541 1.00 0.00 H new ATOM 0 HG3 GLU C 66 67.944 -8.742 11.579 1.00 0.00 H new ATOM 1024 N ASP C 67 71.154 -6.615 9.019 1.00 0.00 N ATOM 1025 CA ASP C 67 72.566 -7.012 8.747 1.00 0.00 C ATOM 1026 C ASP C 67 73.511 -5.849 9.056 1.00 0.00 C ATOM 1027 O ASP C 67 74.522 -6.014 9.710 1.00 0.00 O ATOM 1028 CB ASP C 67 72.603 -7.350 7.257 1.00 0.00 C ATOM 1029 CG ASP C 67 71.874 -6.260 6.468 1.00 0.00 C ATOM 1030 OD1 ASP C 67 72.496 -5.254 6.172 1.00 0.00 O ATOM 1031 OD2 ASP C 67 70.706 -6.452 6.173 1.00 0.00 O ATOM 0 H ASP C 67 70.923 -5.649 8.788 1.00 0.00 H new ATOM 0 HA ASP C 67 72.884 -7.853 9.364 1.00 0.00 H new ATOM 0 HB2 ASP C 67 73.635 -7.431 6.917 1.00 0.00 H new ATOM 0 HB3 ASP C 67 72.133 -8.317 7.081 1.00 0.00 H new ATOM 1036 N GLY C 68 73.192 -4.673 8.591 1.00 0.00 N ATOM 1037 CA GLY C 68 74.074 -3.503 8.859 1.00 0.00 C ATOM 1038 C GLY C 68 74.739 -3.056 7.556 1.00 0.00 C ATOM 1039 O GLY C 68 75.651 -2.254 7.557 1.00 0.00 O ATOM 0 H GLY C 68 72.359 -4.472 8.037 1.00 0.00 H new ATOM 0 HA2 GLY C 68 73.492 -2.684 9.282 1.00 0.00 H new ATOM 0 HA3 GLY C 68 74.833 -3.768 9.595 1.00 0.00 H new ATOM 1043 N SER C 69 74.291 -3.570 6.443 1.00 0.00 N ATOM 1044 CA SER C 69 74.900 -3.175 5.140 1.00 0.00 C ATOM 1045 C SER C 69 74.550 -1.721 4.812 1.00 0.00 C ATOM 1046 O SER C 69 75.066 -1.145 3.876 1.00 0.00 O ATOM 1047 CB SER C 69 74.282 -4.119 4.110 1.00 0.00 C ATOM 1048 OG SER C 69 72.865 -4.054 4.202 1.00 0.00 O ATOM 0 H SER C 69 73.530 -4.246 6.379 1.00 0.00 H new ATOM 0 HA SER C 69 75.988 -3.245 5.156 1.00 0.00 H new ATOM 0 HB2 SER C 69 74.606 -3.843 3.107 1.00 0.00 H new ATOM 0 HB3 SER C 69 74.623 -5.140 4.285 1.00 0.00 H new ATOM 0 HG SER C 69 72.542 -4.768 4.790 1.00 0.00 H new ATOM 1054 N GLY C 70 73.676 -1.125 5.575 1.00 0.00 N ATOM 1055 CA GLY C 70 73.295 0.290 5.305 1.00 0.00 C ATOM 1056 C GLY C 70 72.496 0.367 4.002 1.00 0.00 C ATOM 1057 O GLY C 70 72.308 1.428 3.440 1.00 0.00 O ATOM 0 H GLY C 70 73.209 -1.556 6.373 1.00 0.00 H new ATOM 0 HA2 GLY C 70 72.701 0.681 6.131 1.00 0.00 H new ATOM 0 HA3 GLY C 70 74.188 0.910 5.233 1.00 0.00 H new ATOM 1061 N THR C 71 72.025 -0.750 3.517 1.00 0.00 N ATOM 1062 CA THR C 71 71.238 -0.740 2.249 1.00 0.00 C ATOM 1063 C THR C 71 70.040 -1.687 2.363 1.00 0.00 C ATOM 1064 O THR C 71 69.952 -2.482 3.276 1.00 0.00 O ATOM 1065 CB THR C 71 72.210 -1.230 1.175 1.00 0.00 C ATOM 1066 OG1 THR C 71 73.083 -2.199 1.738 1.00 0.00 O ATOM 1067 CG2 THR C 71 73.028 -0.050 0.648 1.00 0.00 C ATOM 0 H THR C 71 72.151 -1.668 3.943 1.00 0.00 H new ATOM 0 HA THR C 71 70.840 0.248 2.017 1.00 0.00 H new ATOM 0 HB THR C 71 71.650 -1.677 0.353 1.00 0.00 H new ATOM 0 HG1 THR C 71 73.706 -2.516 1.051 1.00 0.00 H new ATOM 0 HG21 THR C 71 73.720 -0.400 -0.117 1.00 0.00 H new ATOM 0 HG22 THR C 71 72.358 0.694 0.218 1.00 0.00 H new ATOM 0 HG23 THR C 71 73.590 0.398 1.468 1.00 0.00 H new ATOM 1075 N VAL C 72 69.119 -1.606 1.443 1.00 0.00 N ATOM 1076 CA VAL C 72 67.927 -2.502 1.502 1.00 0.00 C ATOM 1077 C VAL C 72 67.801 -3.307 0.206 1.00 0.00 C ATOM 1078 O VAL C 72 68.295 -2.914 -0.833 1.00 0.00 O ATOM 1079 CB VAL C 72 66.734 -1.561 1.665 1.00 0.00 C ATOM 1080 CG1 VAL C 72 65.434 -2.351 1.500 1.00 0.00 C ATOM 1081 CG2 VAL C 72 66.771 -0.928 3.056 1.00 0.00 C ATOM 0 H VAL C 72 69.139 -0.960 0.654 1.00 0.00 H new ATOM 0 HA VAL C 72 67.994 -3.223 2.316 1.00 0.00 H new ATOM 0 HB VAL C 72 66.783 -0.779 0.907 1.00 0.00 H new ATOM 0 HG11 VAL C 72 64.583 -1.680 1.616 1.00 0.00 H new ATOM 0 HG12 VAL C 72 65.406 -2.803 0.509 1.00 0.00 H new ATOM 0 HG13 VAL C 72 65.385 -3.133 2.257 1.00 0.00 H new ATOM 0 HG21 VAL C 72 65.920 -0.257 3.173 1.00 0.00 H new ATOM 0 HG22 VAL C 72 66.723 -1.711 3.813 1.00 0.00 H new ATOM 0 HG23 VAL C 72 67.697 -0.365 3.175 1.00 0.00 H new ATOM 1091 N ASP C 73 67.140 -4.432 0.260 1.00 0.00 N ATOM 1092 CA ASP C 73 66.977 -5.264 -0.966 1.00 0.00 C ATOM 1093 C ASP C 73 65.501 -5.625 -1.161 1.00 0.00 C ATOM 1094 O ASP C 73 64.666 -5.332 -0.329 1.00 0.00 O ATOM 1095 CB ASP C 73 67.807 -6.522 -0.707 1.00 0.00 C ATOM 1096 CG ASP C 73 68.864 -6.674 -1.803 1.00 0.00 C ATOM 1097 OD1 ASP C 73 68.698 -6.065 -2.848 1.00 0.00 O ATOM 1098 OD2 ASP C 73 69.822 -7.395 -1.579 1.00 0.00 O ATOM 0 H ASP C 73 66.706 -4.811 1.101 1.00 0.00 H new ATOM 0 HA ASP C 73 67.301 -4.743 -1.867 1.00 0.00 H new ATOM 0 HB2 ASP C 73 68.287 -6.458 0.269 1.00 0.00 H new ATOM 0 HB3 ASP C 73 67.160 -7.399 -0.687 1.00 0.00 H new ATOM 1103 N PHE C 74 65.173 -6.259 -2.253 1.00 0.00 N ATOM 1104 CA PHE C 74 63.751 -6.636 -2.497 1.00 0.00 C ATOM 1105 C PHE C 74 63.252 -7.562 -1.385 1.00 0.00 C ATOM 1106 O PHE C 74 62.069 -7.801 -1.247 1.00 0.00 O ATOM 1107 CB PHE C 74 63.756 -7.366 -3.839 1.00 0.00 C ATOM 1108 CG PHE C 74 62.374 -7.904 -4.124 1.00 0.00 C ATOM 1109 CD1 PHE C 74 61.401 -7.071 -4.690 1.00 0.00 C ATOM 1110 CD2 PHE C 74 62.066 -9.236 -3.824 1.00 0.00 C ATOM 1111 CE1 PHE C 74 60.120 -7.570 -4.953 1.00 0.00 C ATOM 1112 CE2 PHE C 74 60.784 -9.735 -4.088 1.00 0.00 C ATOM 1113 CZ PHE C 74 59.811 -8.902 -4.652 1.00 0.00 C ATOM 0 H PHE C 74 65.827 -6.532 -2.987 1.00 0.00 H new ATOM 0 HA PHE C 74 63.091 -5.768 -2.509 1.00 0.00 H new ATOM 0 HB2 PHE C 74 64.064 -6.687 -4.634 1.00 0.00 H new ATOM 0 HB3 PHE C 74 64.479 -8.182 -3.819 1.00 0.00 H new ATOM 0 HD1 PHE C 74 61.639 -6.044 -4.924 1.00 0.00 H new ATOM 0 HD2 PHE C 74 62.817 -9.879 -3.389 1.00 0.00 H new ATOM 0 HE1 PHE C 74 59.369 -6.927 -5.388 1.00 0.00 H new ATOM 0 HE2 PHE C 74 60.546 -10.763 -3.856 1.00 0.00 H new ATOM 0 HZ PHE C 74 58.822 -9.286 -4.855 1.00 0.00 H new ATOM 1123 N ASP C 75 64.145 -8.090 -0.593 1.00 0.00 N ATOM 1124 CA ASP C 75 63.720 -9.002 0.505 1.00 0.00 C ATOM 1125 C ASP C 75 63.391 -8.197 1.766 1.00 0.00 C ATOM 1126 O ASP C 75 62.299 -8.271 2.295 1.00 0.00 O ATOM 1127 CB ASP C 75 64.923 -9.913 0.749 1.00 0.00 C ATOM 1128 CG ASP C 75 64.687 -10.743 2.011 1.00 0.00 C ATOM 1129 OD1 ASP C 75 63.538 -11.034 2.299 1.00 0.00 O ATOM 1130 OD2 ASP C 75 65.660 -11.076 2.668 1.00 0.00 O ATOM 0 H ASP C 75 65.150 -7.929 -0.659 1.00 0.00 H new ATOM 0 HA ASP C 75 62.824 -9.568 0.249 1.00 0.00 H new ATOM 0 HB2 ASP C 75 65.075 -10.570 -0.108 1.00 0.00 H new ATOM 0 HB3 ASP C 75 65.828 -9.316 0.858 1.00 0.00 H new ATOM 1135 N GLU C 76 64.327 -7.428 2.252 1.00 0.00 N ATOM 1136 CA GLU C 76 64.069 -6.620 3.477 1.00 0.00 C ATOM 1137 C GLU C 76 63.016 -5.544 3.193 1.00 0.00 C ATOM 1138 O GLU C 76 62.310 -5.105 4.078 1.00 0.00 O ATOM 1139 CB GLU C 76 65.416 -5.977 3.819 1.00 0.00 C ATOM 1140 CG GLU C 76 66.452 -7.074 4.077 1.00 0.00 C ATOM 1141 CD GLU C 76 67.822 -6.438 4.318 1.00 0.00 C ATOM 1142 OE1 GLU C 76 67.885 -5.485 5.078 1.00 0.00 O ATOM 1143 OE2 GLU C 76 68.784 -6.915 3.740 1.00 0.00 O ATOM 0 H GLU C 76 65.260 -7.325 1.853 1.00 0.00 H new ATOM 0 HA GLU C 76 63.686 -7.227 4.298 1.00 0.00 H new ATOM 0 HB2 GLU C 76 65.744 -5.337 3.000 1.00 0.00 H new ATOM 0 HB3 GLU C 76 65.315 -5.342 4.699 1.00 0.00 H new ATOM 0 HG2 GLU C 76 66.159 -7.669 4.942 1.00 0.00 H new ATOM 0 HG3 GLU C 76 66.499 -7.752 3.225 1.00 0.00 H new ATOM 1150 N PHE C 77 62.905 -5.119 1.964 1.00 0.00 N ATOM 1151 CA PHE C 77 61.896 -4.073 1.625 1.00 0.00 C ATOM 1152 C PHE C 77 60.493 -4.539 2.027 1.00 0.00 C ATOM 1153 O PHE C 77 59.694 -3.774 2.531 1.00 0.00 O ATOM 1154 CB PHE C 77 61.991 -3.907 0.109 1.00 0.00 C ATOM 1155 CG PHE C 77 60.865 -3.022 -0.372 1.00 0.00 C ATOM 1156 CD1 PHE C 77 59.566 -3.532 -0.466 1.00 0.00 C ATOM 1157 CD2 PHE C 77 61.122 -1.691 -0.725 1.00 0.00 C ATOM 1158 CE1 PHE C 77 58.522 -2.713 -0.914 1.00 0.00 C ATOM 1159 CE2 PHE C 77 60.079 -0.872 -1.172 1.00 0.00 C ATOM 1160 CZ PHE C 77 58.778 -1.382 -1.267 1.00 0.00 C ATOM 0 H PHE C 77 63.468 -5.450 1.180 1.00 0.00 H new ATOM 0 HA PHE C 77 62.081 -3.136 2.150 1.00 0.00 H new ATOM 0 HB2 PHE C 77 62.952 -3.469 -0.160 1.00 0.00 H new ATOM 0 HB3 PHE C 77 61.936 -4.880 -0.378 1.00 0.00 H new ATOM 0 HD1 PHE C 77 59.368 -4.558 -0.193 1.00 0.00 H new ATOM 0 HD2 PHE C 77 62.125 -1.297 -0.652 1.00 0.00 H new ATOM 0 HE1 PHE C 77 57.519 -3.108 -0.987 1.00 0.00 H new ATOM 0 HE2 PHE C 77 60.277 0.154 -1.444 1.00 0.00 H new ATOM 0 HZ PHE C 77 57.973 -0.750 -1.612 1.00 0.00 H new ATOM 1170 N LEU C 78 60.185 -5.789 1.807 1.00 0.00 N ATOM 1171 CA LEU C 78 58.833 -6.299 2.176 1.00 0.00 C ATOM 1172 C LEU C 78 58.532 -5.989 3.646 1.00 0.00 C ATOM 1173 O LEU C 78 57.454 -5.548 3.988 1.00 0.00 O ATOM 1174 CB LEU C 78 58.902 -7.809 1.950 1.00 0.00 C ATOM 1175 CG LEU C 78 58.364 -8.139 0.557 1.00 0.00 C ATOM 1176 CD1 LEU C 78 58.732 -9.579 0.195 1.00 0.00 C ATOM 1177 CD2 LEU C 78 56.843 -7.985 0.550 1.00 0.00 C ATOM 0 H LEU C 78 60.810 -6.478 1.388 1.00 0.00 H new ATOM 0 HA LEU C 78 58.043 -5.835 1.586 1.00 0.00 H new ATOM 0 HB2 LEU C 78 59.931 -8.156 2.046 1.00 0.00 H new ATOM 0 HB3 LEU C 78 58.318 -8.329 2.710 1.00 0.00 H new ATOM 0 HG LEU C 78 58.803 -7.458 -0.173 1.00 0.00 H new ATOM 0 HD11 LEU C 78 58.348 -9.814 -0.798 1.00 0.00 H new ATOM 0 HD12 LEU C 78 59.816 -9.690 0.201 1.00 0.00 H new ATOM 0 HD13 LEU C 78 58.294 -10.261 0.924 1.00 0.00 H new ATOM 0 HD21 LEU C 78 56.458 -8.220 -0.442 1.00 0.00 H new ATOM 0 HD22 LEU C 78 56.405 -8.666 1.280 1.00 0.00 H new ATOM 0 HD23 LEU C 78 56.580 -6.959 0.808 1.00 0.00 H new ATOM 1189 N VAL C 79 59.477 -6.217 4.515 1.00 0.00 N ATOM 1190 CA VAL C 79 59.243 -5.933 5.962 1.00 0.00 C ATOM 1191 C VAL C 79 58.816 -4.476 6.151 1.00 0.00 C ATOM 1192 O VAL C 79 57.829 -4.187 6.798 1.00 0.00 O ATOM 1193 CB VAL C 79 60.590 -6.188 6.638 1.00 0.00 C ATOM 1194 CG1 VAL C 79 60.553 -5.655 8.071 1.00 0.00 C ATOM 1195 CG2 VAL C 79 60.872 -7.692 6.661 1.00 0.00 C ATOM 0 H VAL C 79 60.400 -6.587 4.288 1.00 0.00 H new ATOM 0 HA VAL C 79 58.452 -6.554 6.383 1.00 0.00 H new ATOM 0 HB VAL C 79 61.377 -5.678 6.082 1.00 0.00 H new ATOM 0 HG11 VAL C 79 61.514 -5.837 8.552 1.00 0.00 H new ATOM 0 HG12 VAL C 79 60.352 -4.584 8.056 1.00 0.00 H new ATOM 0 HG13 VAL C 79 59.766 -6.163 8.628 1.00 0.00 H new ATOM 0 HG21 VAL C 79 61.832 -7.875 7.143 1.00 0.00 H new ATOM 0 HG22 VAL C 79 60.085 -8.201 7.216 1.00 0.00 H new ATOM 0 HG23 VAL C 79 60.900 -8.073 5.640 1.00 0.00 H new ATOM 1205 N MET C 80 59.551 -3.556 5.589 1.00 0.00 N ATOM 1206 CA MET C 80 59.188 -2.118 5.736 1.00 0.00 C ATOM 1207 C MET C 80 57.703 -1.912 5.428 1.00 0.00 C ATOM 1208 O MET C 80 57.098 -0.949 5.856 1.00 0.00 O ATOM 1209 CB MET C 80 60.055 -1.385 4.712 1.00 0.00 C ATOM 1210 CG MET C 80 60.302 0.048 5.187 1.00 0.00 C ATOM 1211 SD MET C 80 61.889 0.632 4.542 1.00 0.00 S ATOM 1212 CE MET C 80 61.469 0.530 2.784 1.00 0.00 C ATOM 0 H MET C 80 60.387 -3.738 5.034 1.00 0.00 H new ATOM 0 HA MET C 80 59.355 -1.752 6.749 1.00 0.00 H new ATOM 0 HB2 MET C 80 61.004 -1.906 4.584 1.00 0.00 H new ATOM 0 HB3 MET C 80 59.561 -1.378 3.740 1.00 0.00 H new ATOM 0 HG2 MET C 80 59.497 0.699 4.846 1.00 0.00 H new ATOM 0 HG3 MET C 80 60.304 0.086 6.276 1.00 0.00 H new ATOM 0 HE1 MET C 80 62.024 1.289 2.233 1.00 0.00 H new ATOM 0 HE2 MET C 80 61.730 -0.458 2.404 1.00 0.00 H new ATOM 0 HE3 MET C 80 60.400 0.698 2.655 1.00 0.00 H new ATOM 1222 N MET C 81 57.110 -2.809 4.687 1.00 0.00 N ATOM 1223 CA MET C 81 55.664 -2.662 4.351 1.00 0.00 C ATOM 1224 C MET C 81 54.804 -3.368 5.403 1.00 0.00 C ATOM 1225 O MET C 81 53.607 -3.167 5.478 1.00 0.00 O ATOM 1226 CB MET C 81 55.502 -3.334 2.988 1.00 0.00 C ATOM 1227 CG MET C 81 56.261 -2.531 1.928 1.00 0.00 C ATOM 1228 SD MET C 81 55.325 -1.034 1.525 1.00 0.00 S ATOM 1229 CE MET C 81 56.746 0.044 1.217 1.00 0.00 C ATOM 0 H MET C 81 57.564 -3.637 4.300 1.00 0.00 H new ATOM 0 HA MET C 81 55.349 -1.619 4.330 1.00 0.00 H new ATOM 0 HB2 MET C 81 55.882 -4.355 3.027 1.00 0.00 H new ATOM 0 HB3 MET C 81 54.446 -3.397 2.725 1.00 0.00 H new ATOM 0 HG2 MET C 81 57.252 -2.266 2.297 1.00 0.00 H new ATOM 0 HG3 MET C 81 56.406 -3.135 1.032 1.00 0.00 H new ATOM 0 HE1 MET C 81 56.760 0.847 1.954 1.00 0.00 H new ATOM 0 HE2 MET C 81 57.666 -0.536 1.294 1.00 0.00 H new ATOM 0 HE3 MET C 81 56.669 0.471 0.217 1.00 0.00 H new ATOM 1239 N VAL C 82 55.404 -4.194 6.215 1.00 0.00 N ATOM 1240 CA VAL C 82 54.621 -4.913 7.261 1.00 0.00 C ATOM 1241 C VAL C 82 54.371 -3.992 8.458 1.00 0.00 C ATOM 1242 O VAL C 82 53.281 -3.932 8.992 1.00 0.00 O ATOM 1243 CB VAL C 82 55.501 -6.097 7.669 1.00 0.00 C ATOM 1244 CG1 VAL C 82 54.711 -7.029 8.591 1.00 0.00 C ATOM 1245 CG2 VAL C 82 55.934 -6.867 6.420 1.00 0.00 C ATOM 0 H VAL C 82 56.402 -4.403 6.200 1.00 0.00 H new ATOM 0 HA VAL C 82 53.645 -5.236 6.899 1.00 0.00 H new ATOM 0 HB VAL C 82 56.382 -5.728 8.193 1.00 0.00 H new ATOM 0 HG11 VAL C 82 55.339 -7.872 8.881 1.00 0.00 H new ATOM 0 HG12 VAL C 82 54.402 -6.483 9.482 1.00 0.00 H new ATOM 0 HG13 VAL C 82 53.829 -7.397 8.067 1.00 0.00 H new ATOM 0 HG21 VAL C 82 56.561 -7.710 6.711 1.00 0.00 H new ATOM 0 HG22 VAL C 82 55.052 -7.235 5.895 1.00 0.00 H new ATOM 0 HG23 VAL C 82 56.498 -6.206 5.762 1.00 0.00 H new ATOM 1255 N ARG C 83 55.374 -3.275 8.884 1.00 0.00 N ATOM 1256 CA ARG C 83 55.198 -2.357 10.047 1.00 0.00 C ATOM 1257 C ARG C 83 53.903 -1.553 9.899 1.00 0.00 C ATOM 1258 O ARG C 83 53.280 -1.180 10.873 1.00 0.00 O ATOM 1259 CB ARG C 83 56.411 -1.429 10.003 1.00 0.00 C ATOM 1260 CG ARG C 83 57.647 -2.183 10.497 1.00 0.00 C ATOM 1261 CD ARG C 83 58.867 -1.262 10.430 1.00 0.00 C ATOM 1262 NE ARG C 83 58.920 -0.600 11.763 1.00 0.00 N ATOM 1263 CZ ARG C 83 59.136 -1.311 12.835 1.00 0.00 C ATOM 1264 NH1 ARG C 83 60.358 -1.592 13.197 1.00 0.00 N ATOM 1265 NH2 ARG C 83 58.129 -1.739 13.549 1.00 0.00 N ATOM 0 H ARG C 83 56.309 -3.284 8.477 1.00 0.00 H new ATOM 0 HA ARG C 83 55.129 -2.897 10.991 1.00 0.00 H new ATOM 0 HB2 ARG C 83 56.572 -1.071 8.986 1.00 0.00 H new ATOM 0 HB3 ARG C 83 56.234 -0.552 10.625 1.00 0.00 H new ATOM 0 HG2 ARG C 83 57.492 -2.526 11.520 1.00 0.00 H new ATOM 0 HG3 ARG C 83 57.814 -3.070 9.886 1.00 0.00 H new ATOM 0 HD2 ARG C 83 59.778 -1.827 10.233 1.00 0.00 H new ATOM 0 HD3 ARG C 83 58.766 -0.530 9.629 1.00 0.00 H new ATOM 0 HE ARG C 83 58.787 0.409 11.838 1.00 0.00 H new ATOM 0 HH11 ARG C 83 61.145 -1.256 12.642 1.00 0.00 H new ATOM 0 HH12 ARG C 83 60.526 -2.148 14.035 1.00 0.00 H new ATOM 0 HH21 ARG C 83 57.174 -1.517 13.268 1.00 0.00 H new ATOM 0 HH22 ARG C 83 58.298 -2.295 14.387 1.00 0.00 H new ATOM 1279 N CYS C 84 53.497 -1.280 8.690 1.00 0.00 N ATOM 1280 CA CYS C 84 52.245 -0.497 8.484 1.00 0.00 C ATOM 1281 C CYS C 84 51.035 -1.434 8.422 1.00 0.00 C ATOM 1282 O CYS C 84 49.900 -1.000 8.445 1.00 0.00 O ATOM 1283 CB CYS C 84 52.440 0.218 7.146 1.00 0.00 C ATOM 1284 SG CYS C 84 54.065 1.016 7.118 1.00 0.00 S ATOM 0 H CYS C 84 53.977 -1.565 7.836 1.00 0.00 H new ATOM 0 HA CYS C 84 52.059 0.204 9.298 1.00 0.00 H new ATOM 0 HB2 CYS C 84 52.359 -0.495 6.326 1.00 0.00 H new ATOM 0 HB3 CYS C 84 51.656 0.961 7.001 1.00 0.00 H new ATOM 0 HG CYS C 84 54.231 1.622 5.980 1.00 0.00 H new ATOM 1290 N MET C 85 51.269 -2.716 8.346 1.00 0.00 N ATOM 1291 CA MET C 85 50.131 -3.679 8.285 1.00 0.00 C ATOM 1292 C MET C 85 49.730 -4.116 9.696 1.00 0.00 C ATOM 1293 O MET C 85 50.375 -4.944 10.306 1.00 0.00 O ATOM 1294 CB MET C 85 50.662 -4.870 7.486 1.00 0.00 C ATOM 1295 CG MET C 85 49.815 -5.060 6.226 1.00 0.00 C ATOM 1296 SD MET C 85 50.609 -6.276 5.146 1.00 0.00 S ATOM 1297 CE MET C 85 51.426 -5.097 4.043 1.00 0.00 C ATOM 0 H MET C 85 52.197 -3.138 8.324 1.00 0.00 H new ATOM 0 HA MET C 85 49.245 -3.241 7.825 1.00 0.00 H new ATOM 0 HB2 MET C 85 51.704 -4.703 7.214 1.00 0.00 H new ATOM 0 HB3 MET C 85 50.632 -5.773 8.096 1.00 0.00 H new ATOM 0 HG2 MET C 85 48.813 -5.395 6.495 1.00 0.00 H new ATOM 0 HG3 MET C 85 49.704 -4.110 5.703 1.00 0.00 H new ATOM 0 HE1 MET C 85 50.874 -5.033 3.105 1.00 0.00 H new ATOM 0 HE2 MET C 85 51.453 -4.115 4.516 1.00 0.00 H new ATOM 0 HE3 MET C 85 52.444 -5.431 3.843 1.00 0.00 H new ATOM 1307 N LYS C 86 48.668 -3.566 10.218 1.00 0.00 N ATOM 1308 CA LYS C 86 48.226 -3.952 11.589 1.00 0.00 C ATOM 1309 C LYS C 86 46.758 -3.571 11.799 1.00 0.00 C ATOM 1310 O LYS C 86 45.899 -4.421 11.924 1.00 0.00 O ATOM 1311 CB LYS C 86 49.127 -3.160 12.538 1.00 0.00 C ATOM 1312 CG LYS C 86 49.253 -3.909 13.866 1.00 0.00 C ATOM 1313 CD LYS C 86 50.242 -3.177 14.777 1.00 0.00 C ATOM 1314 CE LYS C 86 51.144 -4.199 15.474 1.00 0.00 C ATOM 1315 NZ LYS C 86 51.484 -3.583 16.787 1.00 0.00 N ATOM 0 H LYS C 86 48.087 -2.867 9.755 1.00 0.00 H new ATOM 0 HA LYS C 86 48.303 -5.026 11.758 1.00 0.00 H new ATOM 0 HB2 LYS C 86 50.112 -3.022 12.091 1.00 0.00 H new ATOM 0 HB3 LYS C 86 48.711 -2.167 12.707 1.00 0.00 H new ATOM 0 HG2 LYS C 86 48.279 -3.977 14.350 1.00 0.00 H new ATOM 0 HG3 LYS C 86 49.593 -4.929 13.689 1.00 0.00 H new ATOM 0 HD2 LYS C 86 50.845 -2.482 14.193 1.00 0.00 H new ATOM 0 HD3 LYS C 86 49.703 -2.587 15.518 1.00 0.00 H new ATOM 0 HE2 LYS C 86 50.632 -5.152 15.606 1.00 0.00 H new ATOM 0 HE3 LYS C 86 52.041 -4.398 14.888 1.00 0.00 H new ATOM 0 HZ1 LYS C 86 52.101 -4.226 17.323 1.00 0.00 H new ATOM 0 HZ2 LYS C 86 51.977 -2.681 16.630 1.00 0.00 H new ATOM 0 HZ3 LYS C 86 50.611 -3.411 17.326 1.00 0.00 H new ATOM 1329 N ASP C 87 46.464 -2.300 11.840 1.00 0.00 N ATOM 1330 CA ASP C 87 45.049 -1.872 12.041 1.00 0.00 C ATOM 1331 C ASP C 87 44.929 -0.350 11.919 1.00 0.00 C ATOM 1332 O ASP C 87 45.914 0.357 11.834 1.00 0.00 O ATOM 1333 CB ASP C 87 44.696 -2.326 13.458 1.00 0.00 C ATOM 1334 CG ASP C 87 43.209 -2.680 13.524 1.00 0.00 C ATOM 1335 OD1 ASP C 87 42.458 -2.150 12.721 1.00 0.00 O ATOM 1336 OD2 ASP C 87 42.847 -3.475 14.376 1.00 0.00 O ATOM 0 H ASP C 87 47.139 -1.541 11.743 1.00 0.00 H new ATOM 0 HA ASP C 87 44.380 -2.301 11.295 1.00 0.00 H new ATOM 0 HB2 ASP C 87 45.299 -3.190 13.735 1.00 0.00 H new ATOM 0 HB3 ASP C 87 44.925 -1.535 14.172 1.00 0.00 H new ATOM 1341 N ASP C 88 43.726 0.157 11.908 1.00 0.00 N ATOM 1342 CA ASP C 88 43.535 1.631 11.791 1.00 0.00 C ATOM 1343 C ASP C 88 44.497 2.371 12.724 1.00 0.00 C ATOM 1344 O ASP C 88 44.290 2.437 13.919 1.00 0.00 O ATOM 1345 CB ASP C 88 42.086 1.875 12.214 1.00 0.00 C ATOM 1346 CG ASP C 88 41.855 1.284 13.606 1.00 0.00 C ATOM 1347 OD1 ASP C 88 42.108 0.102 13.776 1.00 0.00 O ATOM 1348 OD2 ASP C 88 41.434 2.023 14.479 1.00 0.00 O ATOM 0 H ASP C 88 42.866 -0.387 11.975 1.00 0.00 H new ATOM 0 HA ASP C 88 43.735 1.993 10.782 1.00 0.00 H new ATOM 0 HB2 ASP C 88 41.873 2.944 12.221 1.00 0.00 H new ATOM 0 HB3 ASP C 88 41.405 1.419 11.496 1.00 0.00 H new ATOM 1353 N SER C 89 45.546 2.931 12.186 1.00 0.00 N ATOM 1354 CA SER C 89 46.521 3.671 13.039 1.00 0.00 C ATOM 1355 C SER C 89 46.774 2.907 14.342 1.00 0.00 C ATOM 1356 O SER C 89 46.613 1.698 14.338 1.00 0.00 O ATOM 1357 CB SER C 89 45.853 5.016 13.326 1.00 0.00 C ATOM 1358 OG SER C 89 44.919 4.860 14.385 1.00 0.00 O ATOM 1359 OXT SER C 89 47.122 3.546 15.322 1.00 0.00 O ATOM 0 H SER C 89 45.771 2.908 11.191 1.00 0.00 H new ATOM 0 HA SER C 89 47.488 3.791 12.551 1.00 0.00 H new ATOM 0 HB2 SER C 89 46.605 5.758 13.595 1.00 0.00 H new ATOM 0 HB3 SER C 89 45.349 5.383 12.432 1.00 0.00 H new ATOM 0 HG SER C 89 44.299 4.132 14.170 1.00 0.00 H new TER 1365 SER C 89 ATOM 1366 N ARG I 1 59.318 7.717 7.191 1.00 0.00 N ATOM 1367 CA ARG I 1 58.209 6.750 6.945 1.00 0.00 C ATOM 1368 C ARG I 1 57.733 6.853 5.494 1.00 0.00 C ATOM 1369 O ARG I 1 57.768 7.907 4.891 1.00 0.00 O ATOM 1370 CB ARG I 1 57.098 7.168 7.909 1.00 0.00 C ATOM 1371 CG ARG I 1 57.638 7.172 9.340 1.00 0.00 C ATOM 1372 CD ARG I 1 56.640 7.870 10.265 1.00 0.00 C ATOM 1373 NE ARG I 1 55.351 7.158 10.047 1.00 0.00 N ATOM 1374 CZ ARG I 1 54.253 7.619 10.580 1.00 0.00 C ATOM 1375 NH1 ARG I 1 54.098 8.904 10.746 1.00 0.00 N ATOM 1376 NH2 ARG I 1 53.308 6.797 10.946 1.00 0.00 N ATOM 0 H1 ARG I 1 60.126 7.218 7.614 1.00 0.00 H new ATOM 0 H2 ARG I 1 59.610 8.147 6.290 1.00 0.00 H new ATOM 0 H3 ARG I 1 58.992 8.461 7.841 1.00 0.00 H new ATOM 0 HA ARG I 1 58.516 5.717 7.105 1.00 0.00 H new ATOM 0 HB2 ARG I 1 56.728 8.159 7.646 1.00 0.00 H new ATOM 0 HB3 ARG I 1 56.255 6.481 7.829 1.00 0.00 H new ATOM 0 HG2 ARG I 1 57.808 6.150 9.678 1.00 0.00 H new ATOM 0 HG3 ARG I 1 58.600 7.683 9.375 1.00 0.00 H new ATOM 0 HD2 ARG I 1 56.955 7.806 11.306 1.00 0.00 H new ATOM 0 HD3 ARG I 1 56.552 8.929 10.023 1.00 0.00 H new ATOM 0 HE ARG I 1 55.326 6.310 9.481 1.00 0.00 H new ATOM 0 HH11 ARG I 1 54.835 9.548 10.459 1.00 0.00 H new ATOM 0 HH12 ARG I 1 53.240 9.265 11.163 1.00 0.00 H new ATOM 0 HH21 ARG I 1 53.427 5.792 10.816 1.00 0.00 H new ATOM 0 HH22 ARG I 1 52.450 7.159 11.363 1.00 0.00 H new ATOM 1392 N ILE I 2 57.290 5.763 4.927 1.00 0.00 N ATOM 1393 CA ILE I 2 56.815 5.797 3.514 1.00 0.00 C ATOM 1394 C ILE I 2 55.299 5.593 3.459 1.00 0.00 C ATOM 1395 O ILE I 2 54.818 4.512 3.181 1.00 0.00 O ATOM 1396 CB ILE I 2 57.541 4.640 2.829 1.00 0.00 C ATOM 1397 CG1 ILE I 2 59.038 4.953 2.760 1.00 0.00 C ATOM 1398 CG2 ILE I 2 56.993 4.455 1.414 1.00 0.00 C ATOM 1399 CD1 ILE I 2 59.794 3.720 2.261 1.00 0.00 C ATOM 0 H ILE I 2 57.237 4.851 5.381 1.00 0.00 H new ATOM 0 HA ILE I 2 57.021 6.752 3.030 1.00 0.00 H new ATOM 0 HB ILE I 2 57.384 3.724 3.398 1.00 0.00 H new ATOM 0 HG12 ILE I 2 59.214 5.796 2.092 1.00 0.00 H new ATOM 0 HG13 ILE I 2 59.405 5.245 3.744 1.00 0.00 H new ATOM 0 HG21 ILE I 2 57.512 3.629 0.928 1.00 0.00 H new ATOM 0 HG22 ILE I 2 55.927 4.234 1.463 1.00 0.00 H new ATOM 0 HG23 ILE I 2 57.149 5.369 0.841 1.00 0.00 H new ATOM 0 HD11 ILE I 2 60.860 3.942 2.212 1.00 0.00 H new ATOM 0 HD12 ILE I 2 59.628 2.889 2.947 1.00 0.00 H new ATOM 0 HD13 ILE I 2 59.433 3.449 1.269 1.00 0.00 H new ATOM 1411 N SER I 3 54.544 6.623 3.722 1.00 0.00 N ATOM 1412 CA SER I 3 53.059 6.489 3.686 1.00 0.00 C ATOM 1413 C SER I 3 52.623 5.772 2.405 1.00 0.00 C ATOM 1414 O SER I 3 52.732 6.302 1.317 1.00 0.00 O ATOM 1415 CB SER I 3 52.532 7.923 3.702 1.00 0.00 C ATOM 1416 OG SER I 3 51.617 8.074 4.780 1.00 0.00 O ATOM 0 H SER I 3 54.890 7.552 3.960 1.00 0.00 H new ATOM 0 HA SER I 3 52.677 5.904 4.523 1.00 0.00 H new ATOM 0 HB2 SER I 3 53.358 8.625 3.810 1.00 0.00 H new ATOM 0 HB3 SER I 3 52.040 8.153 2.757 1.00 0.00 H new ATOM 0 HG SER I 3 51.278 8.993 4.795 1.00 0.00 H new ATOM 1422 N ALA I 4 52.129 4.570 2.527 1.00 0.00 N ATOM 1423 CA ALA I 4 51.685 3.821 1.316 1.00 0.00 C ATOM 1424 C ALA I 4 50.606 4.614 0.573 1.00 0.00 C ATOM 1425 O ALA I 4 50.311 4.353 -0.576 1.00 0.00 O ATOM 1426 CB ALA I 4 51.114 2.507 1.850 1.00 0.00 C ATOM 0 H ALA I 4 52.014 4.075 3.411 1.00 0.00 H new ATOM 0 HA ALA I 4 52.499 3.653 0.611 1.00 0.00 H new ATOM 0 HB1 ALA I 4 50.764 1.897 1.017 1.00 0.00 H new ATOM 0 HB2 ALA I 4 51.889 1.968 2.394 1.00 0.00 H new ATOM 0 HB3 ALA I 4 50.281 2.718 2.520 1.00 0.00 H new ATOM 1432 N ASP I 5 50.018 5.581 1.221 1.00 0.00 N ATOM 1433 CA ASP I 5 48.961 6.392 0.553 1.00 0.00 C ATOM 1434 C ASP I 5 49.597 7.485 -0.308 1.00 0.00 C ATOM 1435 O ASP I 5 49.326 7.598 -1.486 1.00 0.00 O ATOM 1436 CB ASP I 5 48.155 7.012 1.696 1.00 0.00 C ATOM 1437 CG ASP I 5 46.719 6.490 1.650 1.00 0.00 C ATOM 1438 OD1 ASP I 5 45.983 6.916 0.775 1.00 0.00 O ATOM 1439 OD2 ASP I 5 46.379 5.673 2.491 1.00 0.00 O ATOM 0 H ASP I 5 50.224 5.845 2.185 1.00 0.00 H new ATOM 0 HA ASP I 5 48.336 5.791 -0.108 1.00 0.00 H new ATOM 0 HB2 ASP I 5 48.613 6.764 2.654 1.00 0.00 H new ATOM 0 HB3 ASP I 5 48.161 8.099 1.611 1.00 0.00 H new ATOM 1444 N ALA I 6 50.443 8.292 0.273 1.00 0.00 N ATOM 1445 CA ALA I 6 51.095 9.380 -0.512 1.00 0.00 C ATOM 1446 C ALA I 6 52.159 8.802 -1.448 1.00 0.00 C ATOM 1447 O ALA I 6 52.281 9.205 -2.586 1.00 0.00 O ATOM 1448 CB ALA I 6 51.739 10.290 0.534 1.00 0.00 C ATOM 0 H ALA I 6 50.711 8.245 1.256 1.00 0.00 H new ATOM 0 HA ALA I 6 50.383 9.916 -1.140 1.00 0.00 H new ATOM 0 HB1 ALA I 6 52.241 11.119 0.035 1.00 0.00 H new ATOM 0 HB2 ALA I 6 50.969 10.680 1.200 1.00 0.00 H new ATOM 0 HB3 ALA I 6 52.466 9.721 1.113 1.00 0.00 H new ATOM 1454 N MET I 7 52.935 7.864 -0.980 1.00 0.00 N ATOM 1455 CA MET I 7 53.992 7.274 -1.851 1.00 0.00 C ATOM 1456 C MET I 7 53.377 6.710 -3.136 1.00 0.00 C ATOM 1457 O MET I 7 53.785 7.044 -4.229 1.00 0.00 O ATOM 1458 CB MET I 7 54.615 6.152 -1.018 1.00 0.00 C ATOM 1459 CG MET I 7 56.035 5.878 -1.515 1.00 0.00 C ATOM 1460 SD MET I 7 56.326 4.091 -1.568 1.00 0.00 S ATOM 1461 CE MET I 7 57.098 4.033 -3.205 1.00 0.00 C ATOM 0 H MET I 7 52.884 7.481 -0.036 1.00 0.00 H new ATOM 0 HA MET I 7 54.731 8.016 -2.155 1.00 0.00 H new ATOM 0 HB2 MET I 7 54.635 6.434 0.035 1.00 0.00 H new ATOM 0 HB3 MET I 7 54.010 5.248 -1.095 1.00 0.00 H new ATOM 0 HG2 MET I 7 56.173 6.309 -2.507 1.00 0.00 H new ATOM 0 HG3 MET I 7 56.760 6.355 -0.856 1.00 0.00 H new ATOM 0 HE1 MET I 7 57.153 2.999 -3.545 1.00 0.00 H new ATOM 0 HE2 MET I 7 56.503 4.615 -3.909 1.00 0.00 H new ATOM 0 HE3 MET I 7 58.103 4.450 -3.148 1.00 0.00 H new ATOM 1471 N MET I 8 52.403 5.852 -3.016 1.00 0.00 N ATOM 1472 CA MET I 8 51.774 5.262 -4.233 1.00 0.00 C ATOM 1473 C MET I 8 51.032 6.330 -5.044 1.00 0.00 C ATOM 1474 O MET I 8 50.969 6.264 -6.254 1.00 0.00 O ATOM 1475 CB MET I 8 50.799 4.213 -3.703 1.00 0.00 C ATOM 1476 CG MET I 8 51.585 3.062 -3.072 1.00 0.00 C ATOM 1477 SD MET I 8 52.698 2.346 -4.307 1.00 0.00 S ATOM 1478 CE MET I 8 54.199 3.223 -3.799 1.00 0.00 C ATOM 0 H MET I 8 52.014 5.533 -2.128 1.00 0.00 H new ATOM 0 HA MET I 8 52.517 4.832 -4.905 1.00 0.00 H new ATOM 0 HB2 MET I 8 50.132 4.660 -2.966 1.00 0.00 H new ATOM 0 HB3 MET I 8 50.173 3.839 -4.514 1.00 0.00 H new ATOM 0 HG2 MET I 8 52.157 3.423 -2.217 1.00 0.00 H new ATOM 0 HG3 MET I 8 50.900 2.301 -2.699 1.00 0.00 H new ATOM 0 HE1 MET I 8 54.666 3.681 -4.671 1.00 0.00 H new ATOM 0 HE2 MET I 8 53.941 3.998 -3.077 1.00 0.00 H new ATOM 0 HE3 MET I 8 54.895 2.519 -3.342 1.00 0.00 H new ATOM 1488 N GLN I 9 50.463 7.307 -4.395 1.00 0.00 N ATOM 1489 CA GLN I 9 49.721 8.362 -5.147 1.00 0.00 C ATOM 1490 C GLN I 9 50.678 9.458 -5.629 1.00 0.00 C ATOM 1491 O GLN I 9 50.486 10.045 -6.676 1.00 0.00 O ATOM 1492 CB GLN I 9 48.715 8.931 -4.148 1.00 0.00 C ATOM 1493 CG GLN I 9 47.380 9.173 -4.854 1.00 0.00 C ATOM 1494 CD GLN I 9 46.423 9.894 -3.905 1.00 0.00 C ATOM 1495 OE1 GLN I 9 46.250 11.093 -3.993 1.00 0.00 O ATOM 1496 NE2 GLN I 9 45.789 9.209 -2.992 1.00 0.00 N ATOM 0 H GLN I 9 50.478 7.422 -3.382 1.00 0.00 H new ATOM 0 HA GLN I 9 49.233 7.961 -6.035 1.00 0.00 H new ATOM 0 HB2 GLN I 9 48.579 8.239 -3.317 1.00 0.00 H new ATOM 0 HB3 GLN I 9 49.091 9.864 -3.728 1.00 0.00 H new ATOM 0 HG2 GLN I 9 47.535 9.769 -5.753 1.00 0.00 H new ATOM 0 HG3 GLN I 9 46.948 8.224 -5.172 1.00 0.00 H new ATOM 0 HE21 GLN I 9 45.934 8.202 -2.918 1.00 0.00 H new ATOM 0 HE22 GLN I 9 45.149 9.681 -2.353 1.00 0.00 H new ATOM 1505 N ALA I 10 51.701 9.744 -4.873 1.00 0.00 N ATOM 1506 CA ALA I 10 52.660 10.807 -5.287 1.00 0.00 C ATOM 1507 C ALA I 10 53.727 10.237 -6.225 1.00 0.00 C ATOM 1508 O ALA I 10 53.931 10.723 -7.320 1.00 0.00 O ATOM 1509 CB ALA I 10 53.302 11.286 -3.986 1.00 0.00 C ATOM 0 H ALA I 10 51.915 9.288 -3.986 1.00 0.00 H new ATOM 0 HA ALA I 10 52.165 11.614 -5.827 1.00 0.00 H new ATOM 0 HB1 ALA I 10 54.024 12.073 -4.205 1.00 0.00 H new ATOM 0 HB2 ALA I 10 52.531 11.676 -3.322 1.00 0.00 H new ATOM 0 HB3 ALA I 10 53.810 10.452 -3.502 1.00 0.00 H new ATOM 1515 N LEU I 11 54.413 9.215 -5.798 1.00 0.00 N ATOM 1516 CA LEU I 11 55.474 8.616 -6.658 1.00 0.00 C ATOM 1517 C LEU I 11 54.870 8.096 -7.965 1.00 0.00 C ATOM 1518 O LEU I 11 55.065 8.667 -9.019 1.00 0.00 O ATOM 1519 CB LEU I 11 56.041 7.463 -5.831 1.00 0.00 C ATOM 1520 CG LEU I 11 57.568 7.495 -5.884 1.00 0.00 C ATOM 1521 CD1 LEU I 11 58.135 6.377 -5.007 1.00 0.00 C ATOM 1522 CD2 LEU I 11 58.033 7.293 -7.328 1.00 0.00 C ATOM 0 H LEU I 11 54.286 8.767 -4.890 1.00 0.00 H new ATOM 0 HA LEU I 11 56.241 9.339 -6.934 1.00 0.00 H new ATOM 0 HB2 LEU I 11 55.701 7.542 -4.798 1.00 0.00 H new ATOM 0 HB3 LEU I 11 55.674 6.512 -6.216 1.00 0.00 H new ATOM 0 HG LEU I 11 57.922 8.459 -5.518 1.00 0.00 H new ATOM 0 HD11 LEU I 11 59.224 6.401 -5.046 1.00 0.00 H new ATOM 0 HD12 LEU I 11 57.805 6.519 -3.978 1.00 0.00 H new ATOM 0 HD13 LEU I 11 57.780 5.413 -5.372 1.00 0.00 H new ATOM 0 HD21 LEU I 11 59.122 7.316 -7.366 1.00 0.00 H new ATOM 0 HD22 LEU I 11 57.677 6.330 -7.693 1.00 0.00 H new ATOM 0 HD23 LEU I 11 57.631 8.089 -7.954 1.00 0.00 H new ATOM 1534 N LEU I 12 54.140 7.017 -7.904 1.00 0.00 N ATOM 1535 CA LEU I 12 53.529 6.465 -9.147 1.00 0.00 C ATOM 1536 C LEU I 12 52.055 6.873 -9.240 1.00 0.00 C ATOM 1537 O LEU I 12 51.718 7.881 -9.828 1.00 0.00 O ATOM 1538 CB LEU I 12 53.665 4.943 -9.017 1.00 0.00 C ATOM 1539 CG LEU I 12 55.149 4.537 -8.987 1.00 0.00 C ATOM 1540 CD1 LEU I 12 55.971 5.453 -9.901 1.00 0.00 C ATOM 1541 CD2 LEU I 12 55.677 4.646 -7.555 1.00 0.00 C ATOM 0 H LEU I 12 53.940 6.495 -7.051 1.00 0.00 H new ATOM 0 HA LEU I 12 54.016 6.839 -10.048 1.00 0.00 H new ATOM 0 HB2 LEU I 12 53.170 4.604 -8.107 1.00 0.00 H new ATOM 0 HB3 LEU I 12 53.165 4.454 -9.853 1.00 0.00 H new ATOM 0 HG LEU I 12 55.241 3.510 -9.340 1.00 0.00 H new ATOM 0 HD11 LEU I 12 57.019 5.154 -9.869 1.00 0.00 H new ATOM 0 HD12 LEU I 12 55.602 5.373 -10.923 1.00 0.00 H new ATOM 0 HD13 LEU I 12 55.878 6.484 -9.561 1.00 0.00 H new ATOM 0 HD21 LEU I 12 56.728 4.359 -7.532 1.00 0.00 H new ATOM 0 HD22 LEU I 12 55.574 5.674 -7.206 1.00 0.00 H new ATOM 0 HD23 LEU I 12 55.105 3.983 -6.905 1.00 0.00 H new ATOM 1553 N GLY I 13 51.176 6.102 -8.662 1.00 0.00 N ATOM 1554 CA GLY I 13 49.728 6.451 -8.719 1.00 0.00 C ATOM 1555 C GLY I 13 49.145 5.995 -10.056 1.00 0.00 C ATOM 1556 O GLY I 13 49.304 6.647 -11.069 1.00 0.00 O ATOM 0 H GLY I 13 51.397 5.246 -8.153 1.00 0.00 H new ATOM 0 HA2 GLY I 13 49.196 5.974 -7.896 1.00 0.00 H new ATOM 0 HA3 GLY I 13 49.598 7.527 -8.601 1.00 0.00 H new ATOM 1560 N ALA I 14 48.469 4.879 -10.069 1.00 0.00 N ATOM 1561 CA ALA I 14 47.875 4.380 -11.343 1.00 0.00 C ATOM 1562 C ALA I 14 46.814 5.361 -11.851 1.00 0.00 C ATOM 1563 O ALA I 14 46.747 5.664 -13.025 1.00 0.00 O ATOM 1564 CB ALA I 14 47.237 3.039 -10.983 1.00 0.00 C ATOM 0 H ALA I 14 48.302 4.291 -9.253 1.00 0.00 H new ATOM 0 HA ALA I 14 48.618 4.278 -12.134 1.00 0.00 H new ATOM 0 HB1 ALA I 14 46.776 2.605 -11.871 1.00 0.00 H new ATOM 0 HB2 ALA I 14 48.003 2.362 -10.604 1.00 0.00 H new ATOM 0 HB3 ALA I 14 46.476 3.192 -10.217 1.00 0.00 H new ATOM 1570 N ARG I 15 45.982 5.858 -10.976 1.00 0.00 N ATOM 1571 CA ARG I 15 44.928 6.818 -11.412 1.00 0.00 C ATOM 1572 C ARG I 15 44.508 7.712 -10.241 1.00 0.00 C ATOM 1573 O ARG I 15 43.367 7.711 -9.826 1.00 0.00 O ATOM 1574 CB ARG I 15 43.757 5.945 -11.864 1.00 0.00 C ATOM 1575 CG ARG I 15 43.715 5.901 -13.392 1.00 0.00 C ATOM 1576 CD ARG I 15 42.735 6.957 -13.906 1.00 0.00 C ATOM 1577 NE ARG I 15 41.384 6.405 -13.609 1.00 0.00 N ATOM 1578 CZ ARG I 15 40.653 6.942 -12.671 1.00 0.00 C ATOM 1579 NH1 ARG I 15 40.565 8.240 -12.575 1.00 0.00 N ATOM 1580 NH2 ARG I 15 40.009 6.181 -11.829 1.00 0.00 N ATOM 0 H ARG I 15 45.987 5.641 -9.979 1.00 0.00 H new ATOM 0 HA ARG I 15 45.276 7.477 -12.207 1.00 0.00 H new ATOM 0 HB2 ARG I 15 43.865 4.937 -11.463 1.00 0.00 H new ATOM 0 HB3 ARG I 15 42.820 6.344 -11.475 1.00 0.00 H new ATOM 0 HG2 ARG I 15 44.709 6.084 -13.799 1.00 0.00 H new ATOM 0 HG3 ARG I 15 43.409 4.911 -13.730 1.00 0.00 H new ATOM 0 HD2 ARG I 15 42.889 7.914 -13.408 1.00 0.00 H new ATOM 0 HD3 ARG I 15 42.865 7.129 -14.974 1.00 0.00 H new ATOM 0 HE ARG I 15 41.031 5.608 -14.138 1.00 0.00 H new ATOM 0 HH11 ARG I 15 41.068 8.835 -13.233 1.00 0.00 H new ATOM 0 HH12 ARG I 15 39.993 8.660 -11.842 1.00 0.00 H new ATOM 0 HH21 ARG I 15 40.077 5.166 -11.904 1.00 0.00 H new ATOM 0 HH22 ARG I 15 39.438 6.601 -11.096 1.00 0.00 H new ATOM 1594 N ALA I 16 45.423 8.474 -9.708 1.00 0.00 N ATOM 1595 CA ALA I 16 45.075 9.368 -8.567 1.00 0.00 C ATOM 1596 C ALA I 16 46.038 10.557 -8.516 1.00 0.00 C ATOM 1597 O ALA I 16 47.219 10.402 -8.277 1.00 0.00 O ATOM 1598 CB ALA I 16 45.232 8.497 -7.319 1.00 0.00 C ATOM 0 H ALA I 16 46.396 8.517 -10.013 1.00 0.00 H new ATOM 0 HA ALA I 16 44.068 9.777 -8.654 1.00 0.00 H new ATOM 0 HB1 ALA I 16 44.993 9.085 -6.433 1.00 0.00 H new ATOM 0 HB2 ALA I 16 44.556 7.645 -7.383 1.00 0.00 H new ATOM 0 HB3 ALA I 16 46.260 8.140 -7.251 1.00 0.00 H new ATOM 1604 N LYS I 17 45.542 11.743 -8.738 1.00 0.00 N ATOM 1605 CA LYS I 17 46.430 12.940 -8.703 1.00 0.00 C ATOM 1606 C LYS I 17 45.597 14.221 -8.797 1.00 0.00 C ATOM 1607 O LYS I 17 44.384 14.112 -8.864 1.00 0.00 O ATOM 1608 CB LYS I 17 47.340 12.799 -9.925 1.00 0.00 C ATOM 1609 CG LYS I 17 46.490 12.546 -11.171 1.00 0.00 C ATOM 1610 CD LYS I 17 46.876 13.544 -12.264 1.00 0.00 C ATOM 1611 CE LYS I 17 45.750 14.563 -12.446 1.00 0.00 C ATOM 1612 NZ LYS I 17 45.089 14.180 -13.724 1.00 0.00 N ATOM 1613 OXT LYS I 17 46.187 15.289 -8.799 1.00 0.00 O ATOM 0 H LYS I 17 44.561 11.935 -8.942 1.00 0.00 H new ATOM 0 HA LYS I 17 47.001 13.001 -7.777 1.00 0.00 H new ATOM 0 HB2 LYS I 17 47.934 13.704 -10.055 1.00 0.00 H new ATOM 0 HB3 LYS I 17 48.040 11.977 -9.777 1.00 0.00 H new ATOM 0 HG2 LYS I 17 46.640 11.526 -11.526 1.00 0.00 H new ATOM 0 HG3 LYS I 17 45.432 12.647 -10.929 1.00 0.00 H new ATOM 0 HD2 LYS I 17 47.802 14.053 -11.996 1.00 0.00 H new ATOM 0 HD3 LYS I 17 47.061 13.019 -13.201 1.00 0.00 H new ATOM 0 HE2 LYS I 17 45.048 14.529 -11.613 1.00 0.00 H new ATOM 0 HE3 LYS I 17 46.141 15.579 -12.493 1.00 0.00 H new ATOM 0 HZ1 LYS I 17 44.304 14.834 -13.918 1.00 0.00 H new ATOM 0 HZ2 LYS I 17 45.780 14.228 -14.500 1.00 0.00 H new ATOM 0 HZ3 LYS I 17 44.721 13.210 -13.647 1.00 0.00 H new TER 1627 LYS I 17 HETATM 1628 CA CA C 90 70.384 -4.857 4.643 1.00 0.00 CA