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 157:sc= -4.52! (180deg=-7.12!) USER MOD Set 1.2: I 8 MET CE :methyl -135:sc= -7.46! (180deg=-12.3!) USER MOD Set 2.1: C 69 SER OG : rot 118:sc= 1.94 USER MOD Set 2.2: C 71 THR OG1 : rot 180:sc= 1 USER MOD Set 3.1: C 13 THR OG1 : rot 180:sc= 0.0195 USER MOD Set 3.2: C 16 GLN : amide:sc= -1.29 K(o=-1.3,f=-2.2!) USER MOD Single : C 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 1 MET N :NH3+ 180:sc= 0 (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= -0.0106 X(o=-0.011,f=-0.37) USER MOD Single : C 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 18 ASN : amide:sc= -0.325 K(o=-0.32,f=-3.1!) USER MOD Single : C 21 LYS NZ :NH3+ 173:sc=-0.00563 (180deg=-0.013) USER MOD Single : C 35 CYS SG : rot 180:sc= 0.0239 USER MOD Single : C 37 SER OG : rot 180:sc= -0.825 USER MOD Single : C 38 THR OG1 : rot -77:sc= -0.218! USER MOD Single : C 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 43 LYS NZ :NH3+ -146:sc=-0.00775 (180deg=-1.4!) USER MOD Single : C 45 MET CE :methyl 167:sc= -10.3! (180deg=-10.6!) USER MOD Single : C 47 MET CE :methyl -131:sc= -1.37 (180deg=-3.54!) USER MOD Single : C 50 GLN : amide:sc= -0.999 K(o=-1,f=-5.7!) USER MOD Single : C 51 ASN :FLIP amide:sc= -0.803! C(o=-1.9!,f=-0.8!) USER MOD Single : C 53 THR OG1 : rot 180:sc= 0.063 USER MOD Single : C 58 GLN : amide:sc= 0 X(o=0,f=-0.013) USER MOD Single : C 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 80 MET CE :methyl -154:sc= -0.0496 (180deg=-0.49) USER MOD Single : C 81 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 84 CYS SG : rot -68:sc= 0.0792 USER MOD Single : C 85 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 86 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.151) USER MOD Single : C 89 SER OG : rot -69:sc= 1.16 USER MOD Single : I 1 ARG N :NH3+ -154:sc= 0 (180deg=-0.633) 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+ -150:sc= -0.101 (180deg=-0.902) USER MOD ----------------------------------------------------------------- ATOM 1 N MET C 1 64.956 -12.809 17.587 1.00 0.00 N ATOM 2 CA MET C 1 64.063 -13.372 16.534 1.00 0.00 C ATOM 3 C MET C 1 62.755 -12.577 16.470 1.00 0.00 C ATOM 4 O MET C 1 62.523 -11.682 17.257 1.00 0.00 O ATOM 5 CB MET C 1 63.792 -14.812 16.972 1.00 0.00 C ATOM 6 CG MET C 1 64.046 -15.760 15.799 1.00 0.00 C ATOM 7 SD MET C 1 62.975 -17.210 15.956 1.00 0.00 S ATOM 8 CE MET C 1 64.261 -18.397 16.419 1.00 0.00 C ATOM 0 H1 MET C 1 65.840 -13.356 17.621 1.00 0.00 H new ATOM 0 H2 MET C 1 65.172 -11.816 17.365 1.00 0.00 H new ATOM 0 H3 MET C 1 64.480 -12.862 18.510 1.00 0.00 H new ATOM 0 HA MET C 1 64.514 -13.325 15.543 1.00 0.00 H new ATOM 0 HB2 MET C 1 64.436 -15.075 17.811 1.00 0.00 H new ATOM 0 HB3 MET C 1 62.763 -14.911 17.316 1.00 0.00 H new ATOM 0 HG2 MET C 1 63.850 -15.250 14.856 1.00 0.00 H new ATOM 0 HG3 MET C 1 65.092 -16.066 15.785 1.00 0.00 H new ATOM 0 HE1 MET C 1 63.813 -19.379 16.568 1.00 0.00 H new ATOM 0 HE2 MET C 1 65.006 -18.455 15.625 1.00 0.00 H new ATOM 0 HE3 MET C 1 64.740 -18.073 17.343 1.00 0.00 H new ATOM 20 N ASP C 2 61.900 -12.897 15.537 1.00 0.00 N ATOM 21 CA ASP C 2 60.609 -12.159 15.425 1.00 0.00 C ATOM 22 C ASP C 2 59.576 -13.009 14.680 1.00 0.00 C ATOM 23 O ASP C 2 59.449 -12.935 13.473 1.00 0.00 O ATOM 24 CB ASP C 2 60.942 -10.899 14.626 1.00 0.00 C ATOM 25 CG ASP C 2 61.539 -11.295 13.275 1.00 0.00 C ATOM 26 OD1 ASP C 2 62.594 -11.908 13.273 1.00 0.00 O ATOM 27 OD2 ASP C 2 60.932 -10.980 12.265 1.00 0.00 O ATOM 0 H ASP C 2 62.039 -13.636 14.848 1.00 0.00 H new ATOM 0 HA ASP C 2 60.182 -11.923 16.400 1.00 0.00 H new ATOM 0 HB2 ASP C 2 60.043 -10.302 14.477 1.00 0.00 H new ATOM 0 HB3 ASP C 2 61.648 -10.280 15.180 1.00 0.00 H new ATOM 32 N ASP C 3 58.834 -13.817 15.389 1.00 0.00 N ATOM 33 CA ASP C 3 57.811 -14.670 14.719 1.00 0.00 C ATOM 34 C ASP C 3 56.503 -13.893 14.548 1.00 0.00 C ATOM 35 O ASP C 3 55.476 -14.260 15.084 1.00 0.00 O ATOM 36 CB ASP C 3 57.609 -15.860 15.658 1.00 0.00 C ATOM 37 CG ASP C 3 57.637 -17.158 14.848 1.00 0.00 C ATOM 38 OD1 ASP C 3 58.697 -17.497 14.345 1.00 0.00 O ATOM 39 OD2 ASP C 3 56.600 -17.791 14.744 1.00 0.00 O ATOM 0 H ASP C 3 58.892 -13.923 16.402 1.00 0.00 H new ATOM 0 HA ASP C 3 58.125 -14.985 13.724 1.00 0.00 H new ATOM 0 HB2 ASP C 3 58.391 -15.875 16.417 1.00 0.00 H new ATOM 0 HB3 ASP C 3 56.658 -15.766 16.182 1.00 0.00 H new ATOM 44 N ILE C 4 56.534 -12.821 13.804 1.00 0.00 N ATOM 45 CA ILE C 4 55.294 -12.020 13.595 1.00 0.00 C ATOM 46 C ILE C 4 55.248 -11.492 12.158 1.00 0.00 C ATOM 47 O ILE C 4 54.284 -11.687 11.445 1.00 0.00 O ATOM 48 CB ILE C 4 55.397 -10.866 14.593 1.00 0.00 C ATOM 49 CG1 ILE C 4 55.049 -11.373 15.994 1.00 0.00 C ATOM 50 CG2 ILE C 4 54.420 -9.756 14.200 1.00 0.00 C ATOM 51 CD1 ILE C 4 56.255 -11.192 16.918 1.00 0.00 C ATOM 0 H ILE C 4 57.365 -12.465 13.332 1.00 0.00 H new ATOM 0 HA ILE C 4 54.388 -12.606 13.747 1.00 0.00 H new ATOM 0 HB ILE C 4 56.414 -10.473 14.586 1.00 0.00 H new ATOM 0 HG12 ILE C 4 54.191 -10.827 16.387 1.00 0.00 H new ATOM 0 HG13 ILE C 4 54.765 -12.424 15.951 1.00 0.00 H new ATOM 0 HG21 ILE C 4 54.496 -8.935 14.913 1.00 0.00 H new ATOM 0 HG22 ILE C 4 54.664 -9.393 13.202 1.00 0.00 H new ATOM 0 HG23 ILE C 4 53.403 -10.148 14.205 1.00 0.00 H new ATOM 0 HD11 ILE C 4 56.006 -11.553 17.916 1.00 0.00 H new ATOM 0 HD12 ILE C 4 57.101 -11.758 16.527 1.00 0.00 H new ATOM 0 HD13 ILE C 4 56.518 -10.136 16.970 1.00 0.00 H new ATOM 63 N TYR C 5 56.287 -10.830 11.728 1.00 0.00 N ATOM 64 CA TYR C 5 56.304 -10.294 10.338 1.00 0.00 C ATOM 65 C TYR C 5 56.375 -11.444 9.331 1.00 0.00 C ATOM 66 O TYR C 5 55.598 -11.516 8.399 1.00 0.00 O ATOM 67 CB TYR C 5 57.565 -9.431 10.260 1.00 0.00 C ATOM 68 CG TYR C 5 57.449 -8.284 11.234 1.00 0.00 C ATOM 69 CD1 TYR C 5 56.692 -7.155 10.899 1.00 0.00 C ATOM 70 CD2 TYR C 5 58.101 -8.347 12.472 1.00 0.00 C ATOM 71 CE1 TYR C 5 56.583 -6.091 11.802 1.00 0.00 C ATOM 72 CE2 TYR C 5 57.993 -7.283 13.374 1.00 0.00 C ATOM 73 CZ TYR C 5 57.235 -6.155 13.039 1.00 0.00 C ATOM 74 OH TYR C 5 57.129 -5.106 13.930 1.00 0.00 O ATOM 0 H TYR C 5 57.124 -10.637 12.278 1.00 0.00 H new ATOM 0 HA TYR C 5 55.406 -9.722 10.104 1.00 0.00 H new ATOM 0 HB2 TYR C 5 58.445 -10.031 10.492 1.00 0.00 H new ATOM 0 HB3 TYR C 5 57.696 -9.050 9.247 1.00 0.00 H new ATOM 0 HD1 TYR C 5 56.192 -7.105 9.943 1.00 0.00 H new ATOM 0 HD2 TYR C 5 58.687 -9.217 12.730 1.00 0.00 H new ATOM 0 HE1 TYR C 5 55.996 -5.222 11.545 1.00 0.00 H new ATOM 0 HE2 TYR C 5 58.495 -7.332 14.329 1.00 0.00 H new ATOM 0 HH TYR C 5 57.641 -5.312 14.740 1.00 0.00 H new ATOM 84 N LYS C 6 57.301 -12.348 9.510 1.00 0.00 N ATOM 85 CA LYS C 6 57.416 -13.492 8.561 1.00 0.00 C ATOM 86 C LYS C 6 56.033 -14.089 8.288 1.00 0.00 C ATOM 87 O LYS C 6 55.790 -14.664 7.246 1.00 0.00 O ATOM 88 CB LYS C 6 58.312 -14.510 9.270 1.00 0.00 C ATOM 89 CG LYS C 6 59.599 -14.702 8.465 1.00 0.00 C ATOM 90 CD LYS C 6 60.527 -15.665 9.208 1.00 0.00 C ATOM 91 CE LYS C 6 61.072 -14.982 10.464 1.00 0.00 C ATOM 92 NZ LYS C 6 60.693 -15.885 11.587 1.00 0.00 N ATOM 0 H LYS C 6 57.981 -12.343 10.270 1.00 0.00 H new ATOM 0 HA LYS C 6 57.829 -13.191 7.598 1.00 0.00 H new ATOM 0 HB2 LYS C 6 58.548 -14.165 10.277 1.00 0.00 H new ATOM 0 HB3 LYS C 6 57.789 -15.461 9.374 1.00 0.00 H new ATOM 0 HG2 LYS C 6 59.366 -15.095 7.475 1.00 0.00 H new ATOM 0 HG3 LYS C 6 60.095 -13.743 8.318 1.00 0.00 H new ATOM 0 HD2 LYS C 6 59.986 -16.571 9.480 1.00 0.00 H new ATOM 0 HD3 LYS C 6 61.349 -15.967 8.560 1.00 0.00 H new ATOM 0 HE2 LYS C 6 62.153 -14.855 10.407 1.00 0.00 H new ATOM 0 HE3 LYS C 6 60.641 -13.989 10.593 1.00 0.00 H new ATOM 0 HZ1 LYS C 6 61.033 -15.484 12.485 1.00 0.00 H new ATOM 0 HZ2 LYS C 6 59.658 -15.982 11.621 1.00 0.00 H new ATOM 0 HZ3 LYS C 6 61.124 -16.820 11.441 1.00 0.00 H new ATOM 106 N ALA C 7 55.124 -13.955 9.215 1.00 0.00 N ATOM 107 CA ALA C 7 53.757 -14.512 9.004 1.00 0.00 C ATOM 108 C ALA C 7 52.959 -13.602 8.067 1.00 0.00 C ATOM 109 O ALA C 7 51.987 -14.014 7.464 1.00 0.00 O ATOM 110 CB ALA C 7 53.121 -14.543 10.396 1.00 0.00 C ATOM 0 H ALA C 7 55.268 -13.485 10.108 1.00 0.00 H new ATOM 0 HA ALA C 7 53.778 -15.501 8.546 1.00 0.00 H new ATOM 0 HB1 ALA C 7 52.109 -14.942 10.325 1.00 0.00 H new ATOM 0 HB2 ALA C 7 53.716 -15.177 11.054 1.00 0.00 H new ATOM 0 HB3 ALA C 7 53.084 -13.532 10.802 1.00 0.00 H new ATOM 116 N ALA C 8 53.363 -12.368 7.940 1.00 0.00 N ATOM 117 CA ALA C 8 52.630 -11.430 7.040 1.00 0.00 C ATOM 118 C ALA C 8 53.091 -11.619 5.592 1.00 0.00 C ATOM 119 O ALA C 8 52.293 -11.678 4.678 1.00 0.00 O ATOM 120 CB ALA C 8 52.997 -10.034 7.542 1.00 0.00 C ATOM 0 H ALA C 8 54.169 -11.968 8.420 1.00 0.00 H new ATOM 0 HA ALA C 8 51.553 -11.598 7.055 1.00 0.00 H new ATOM 0 HB1 ALA C 8 52.496 -9.284 6.930 1.00 0.00 H new ATOM 0 HB2 ALA C 8 52.681 -9.926 8.580 1.00 0.00 H new ATOM 0 HB3 ALA C 8 54.076 -9.895 7.475 1.00 0.00 H new ATOM 126 N VAL C 9 54.375 -11.718 5.377 1.00 0.00 N ATOM 127 CA VAL C 9 54.889 -11.905 3.989 1.00 0.00 C ATOM 128 C VAL C 9 54.435 -13.258 3.438 1.00 0.00 C ATOM 129 O VAL C 9 54.036 -13.376 2.297 1.00 0.00 O ATOM 130 CB VAL C 9 56.411 -11.869 4.125 1.00 0.00 C ATOM 131 CG1 VAL C 9 57.048 -11.773 2.737 1.00 0.00 C ATOM 132 CG2 VAL C 9 56.817 -10.653 4.959 1.00 0.00 C ATOM 0 H VAL C 9 55.091 -11.677 6.103 1.00 0.00 H new ATOM 0 HA VAL C 9 54.521 -11.141 3.304 1.00 0.00 H new ATOM 0 HB VAL C 9 56.754 -12.779 4.617 1.00 0.00 H new ATOM 0 HG11 VAL C 9 58.133 -11.747 2.836 1.00 0.00 H new ATOM 0 HG12 VAL C 9 56.758 -12.640 2.143 1.00 0.00 H new ATOM 0 HG13 VAL C 9 56.707 -10.863 2.242 1.00 0.00 H new ATOM 0 HG21 VAL C 9 57.902 -10.625 5.057 1.00 0.00 H new ATOM 0 HG22 VAL C 9 56.474 -9.743 4.467 1.00 0.00 H new ATOM 0 HG23 VAL C 9 56.365 -10.723 5.948 1.00 0.00 H new ATOM 142 N GLU C 10 54.501 -14.281 4.243 1.00 0.00 N ATOM 143 CA GLU C 10 54.080 -15.632 3.774 1.00 0.00 C ATOM 144 C GLU C 10 52.566 -15.671 3.537 1.00 0.00 C ATOM 145 O GLU C 10 52.030 -16.653 3.062 1.00 0.00 O ATOM 146 CB GLU C 10 54.469 -16.582 4.907 1.00 0.00 C ATOM 147 CG GLU C 10 55.892 -17.095 4.677 1.00 0.00 C ATOM 148 CD GLU C 10 56.660 -17.081 6.000 1.00 0.00 C ATOM 149 OE1 GLU C 10 56.433 -17.970 6.804 1.00 0.00 O ATOM 150 OE2 GLU C 10 57.461 -16.180 6.188 1.00 0.00 O ATOM 0 H GLU C 10 54.829 -14.241 5.208 1.00 0.00 H new ATOM 0 HA GLU C 10 54.552 -15.904 2.830 1.00 0.00 H new ATOM 0 HB2 GLU C 10 54.407 -16.066 5.865 1.00 0.00 H new ATOM 0 HB3 GLU C 10 53.772 -17.419 4.950 1.00 0.00 H new ATOM 0 HG2 GLU C 10 55.864 -18.106 4.271 1.00 0.00 H new ATOM 0 HG3 GLU C 10 56.401 -16.471 3.942 1.00 0.00 H new ATOM 157 N GLN C 11 51.873 -14.616 3.866 1.00 0.00 N ATOM 158 CA GLN C 11 50.396 -14.605 3.658 1.00 0.00 C ATOM 159 C GLN C 11 50.012 -13.585 2.581 1.00 0.00 C ATOM 160 O GLN C 11 48.858 -13.233 2.431 1.00 0.00 O ATOM 161 CB GLN C 11 49.810 -14.201 5.011 1.00 0.00 C ATOM 162 CG GLN C 11 49.584 -15.452 5.862 1.00 0.00 C ATOM 163 CD GLN C 11 48.742 -15.089 7.087 1.00 0.00 C ATOM 164 OE1 GLN C 11 47.708 -14.463 6.964 1.00 0.00 O ATOM 165 NE2 GLN C 11 49.143 -15.459 8.272 1.00 0.00 N ATOM 0 H GLN C 11 52.263 -13.764 4.268 1.00 0.00 H new ATOM 0 HA GLN C 11 50.023 -15.572 3.321 1.00 0.00 H new ATOM 0 HB2 GLN C 11 50.487 -13.517 5.523 1.00 0.00 H new ATOM 0 HB3 GLN C 11 48.869 -13.670 4.868 1.00 0.00 H new ATOM 0 HG2 GLN C 11 49.079 -16.219 5.274 1.00 0.00 H new ATOM 0 HG3 GLN C 11 50.541 -15.870 6.176 1.00 0.00 H new ATOM 0 HE21 GLN C 11 50.011 -15.985 8.376 1.00 0.00 H new ATOM 0 HE22 GLN C 11 48.588 -15.223 9.095 1.00 0.00 H new ATOM 174 N LEU C 12 50.966 -13.109 1.829 1.00 0.00 N ATOM 175 CA LEU C 12 50.646 -12.115 0.763 1.00 0.00 C ATOM 176 C LEU C 12 50.190 -12.831 -0.511 1.00 0.00 C ATOM 177 O LEU C 12 50.424 -14.010 -0.687 1.00 0.00 O ATOM 178 CB LEU C 12 51.954 -11.362 0.510 1.00 0.00 C ATOM 179 CG LEU C 12 52.413 -10.681 1.800 1.00 0.00 C ATOM 180 CD1 LEU C 12 53.704 -9.905 1.534 1.00 0.00 C ATOM 181 CD2 LEU C 12 51.330 -9.712 2.283 1.00 0.00 C ATOM 0 H LEU C 12 51.951 -13.364 1.905 1.00 0.00 H new ATOM 0 HA LEU C 12 49.840 -11.444 1.059 1.00 0.00 H new ATOM 0 HB2 LEU C 12 52.721 -12.053 0.159 1.00 0.00 H new ATOM 0 HB3 LEU C 12 51.811 -10.619 -0.274 1.00 0.00 H new ATOM 0 HG LEU C 12 52.591 -11.437 2.564 1.00 0.00 H new ATOM 0 HD11 LEU C 12 54.032 -9.419 2.453 1.00 0.00 H new ATOM 0 HD12 LEU C 12 54.477 -10.592 1.191 1.00 0.00 H new ATOM 0 HD13 LEU C 12 53.524 -9.150 0.769 1.00 0.00 H new ATOM 0 HD21 LEU C 12 51.659 -9.228 3.202 1.00 0.00 H new ATOM 0 HD22 LEU C 12 51.151 -8.956 1.519 1.00 0.00 H new ATOM 0 HD23 LEU C 12 50.408 -10.262 2.472 1.00 0.00 H new ATOM 193 N THR C 13 49.543 -12.129 -1.399 1.00 0.00 N ATOM 194 CA THR C 13 49.078 -12.772 -2.660 1.00 0.00 C ATOM 195 C THR C 13 49.884 -12.241 -3.848 1.00 0.00 C ATOM 196 O THR C 13 50.328 -11.110 -3.851 1.00 0.00 O ATOM 197 CB THR C 13 47.605 -12.377 -2.788 1.00 0.00 C ATOM 198 OG1 THR C 13 47.471 -10.979 -2.568 1.00 0.00 O ATOM 199 CG2 THR C 13 46.779 -13.140 -1.752 1.00 0.00 C ATOM 0 H THR C 13 49.316 -11.139 -1.307 1.00 0.00 H new ATOM 0 HA THR C 13 49.207 -13.854 -2.646 1.00 0.00 H new ATOM 0 HB THR C 13 47.247 -12.624 -3.788 1.00 0.00 H new ATOM 0 HG1 THR C 13 46.529 -10.724 -2.651 1.00 0.00 H new ATOM 0 HG21 THR C 13 45.730 -12.858 -1.844 1.00 0.00 H new ATOM 0 HG22 THR C 13 46.883 -14.212 -1.921 1.00 0.00 H new ATOM 0 HG23 THR C 13 47.134 -12.895 -0.751 1.00 0.00 H new ATOM 207 N GLU C 14 50.080 -13.049 -4.855 1.00 0.00 N ATOM 208 CA GLU C 14 50.862 -12.590 -6.039 1.00 0.00 C ATOM 209 C GLU C 14 50.465 -11.159 -6.415 1.00 0.00 C ATOM 210 O GLU C 14 51.287 -10.264 -6.443 1.00 0.00 O ATOM 211 CB GLU C 14 50.492 -13.560 -7.161 1.00 0.00 C ATOM 212 CG GLU C 14 51.762 -14.010 -7.886 1.00 0.00 C ATOM 213 CD GLU C 14 51.397 -14.559 -9.266 1.00 0.00 C ATOM 214 OE1 GLU C 14 50.898 -15.671 -9.326 1.00 0.00 O ATOM 215 OE2 GLU C 14 51.623 -13.859 -10.239 1.00 0.00 O ATOM 0 H GLU C 14 49.733 -14.007 -4.909 1.00 0.00 H new ATOM 0 HA GLU C 14 51.935 -12.581 -5.845 1.00 0.00 H new ATOM 0 HB2 GLU C 14 49.969 -14.424 -6.751 1.00 0.00 H new ATOM 0 HB3 GLU C 14 49.811 -13.078 -7.863 1.00 0.00 H new ATOM 0 HG2 GLU C 14 52.451 -13.172 -7.988 1.00 0.00 H new ATOM 0 HG3 GLU C 14 52.274 -14.775 -7.303 1.00 0.00 H new ATOM 222 N GLU C 15 49.212 -10.934 -6.701 1.00 0.00 N ATOM 223 CA GLU C 15 48.767 -9.560 -7.072 1.00 0.00 C ATOM 224 C GLU C 15 49.345 -8.537 -6.089 1.00 0.00 C ATOM 225 O GLU C 15 49.966 -7.568 -6.480 1.00 0.00 O ATOM 226 CB GLU C 15 47.242 -9.595 -6.977 1.00 0.00 C ATOM 227 CG GLU C 15 46.654 -8.402 -7.733 1.00 0.00 C ATOM 228 CD GLU C 15 46.560 -8.738 -9.222 1.00 0.00 C ATOM 229 OE1 GLU C 15 47.575 -8.648 -9.894 1.00 0.00 O ATOM 230 OE2 GLU C 15 45.477 -9.079 -9.666 1.00 0.00 O ATOM 0 H GLU C 15 48.477 -11.641 -6.694 1.00 0.00 H new ATOM 0 HA GLU C 15 49.104 -9.271 -8.068 1.00 0.00 H new ATOM 0 HB2 GLU C 15 46.863 -10.527 -7.396 1.00 0.00 H new ATOM 0 HB3 GLU C 15 46.932 -9.566 -5.933 1.00 0.00 H new ATOM 0 HG2 GLU C 15 45.666 -8.160 -7.341 1.00 0.00 H new ATOM 0 HG3 GLU C 15 47.279 -7.521 -7.587 1.00 0.00 H new ATOM 237 N GLN C 16 49.147 -8.745 -4.815 1.00 0.00 N ATOM 238 CA GLN C 16 49.687 -7.785 -3.809 1.00 0.00 C ATOM 239 C GLN C 16 51.203 -7.652 -3.969 1.00 0.00 C ATOM 240 O GLN C 16 51.733 -6.563 -4.069 1.00 0.00 O ATOM 241 CB GLN C 16 49.341 -8.394 -2.451 1.00 0.00 C ATOM 242 CG GLN C 16 49.896 -7.503 -1.337 1.00 0.00 C ATOM 243 CD GLN C 16 49.322 -7.949 0.009 1.00 0.00 C ATOM 244 OE1 GLN C 16 48.695 -8.985 0.102 1.00 0.00 O ATOM 245 NE2 GLN C 16 49.513 -7.204 1.064 1.00 0.00 N ATOM 0 H GLN C 16 48.635 -9.538 -4.427 1.00 0.00 H new ATOM 0 HA GLN C 16 49.266 -6.786 -3.924 1.00 0.00 H new ATOM 0 HB2 GLN C 16 48.260 -8.492 -2.349 1.00 0.00 H new ATOM 0 HB3 GLN C 16 49.761 -9.397 -2.372 1.00 0.00 H new ATOM 0 HG2 GLN C 16 50.984 -7.563 -1.318 1.00 0.00 H new ATOM 0 HG3 GLN C 16 49.637 -6.461 -1.527 1.00 0.00 H new ATOM 0 HE21 GLN C 16 50.040 -6.334 0.985 1.00 0.00 H new ATOM 0 HE22 GLN C 16 49.136 -7.492 1.967 1.00 0.00 H new ATOM 254 N LYS C 17 51.905 -8.751 -4.002 1.00 0.00 N ATOM 255 CA LYS C 17 53.384 -8.682 -4.165 1.00 0.00 C ATOM 256 C LYS C 17 53.718 -7.912 -5.449 1.00 0.00 C ATOM 257 O LYS C 17 54.762 -7.305 -5.568 1.00 0.00 O ATOM 258 CB LYS C 17 53.833 -10.150 -4.246 1.00 0.00 C ATOM 259 CG LYS C 17 55.066 -10.282 -5.145 1.00 0.00 C ATOM 260 CD LYS C 17 54.614 -10.366 -6.603 1.00 0.00 C ATOM 261 CE LYS C 17 54.944 -11.753 -7.162 1.00 0.00 C ATOM 262 NZ LYS C 17 55.621 -11.493 -8.463 1.00 0.00 N ATOM 0 H LYS C 17 51.519 -9.692 -3.923 1.00 0.00 H new ATOM 0 HA LYS C 17 53.888 -8.161 -3.351 1.00 0.00 H new ATOM 0 HB2 LYS C 17 54.061 -10.523 -3.248 1.00 0.00 H new ATOM 0 HB3 LYS C 17 53.022 -10.764 -4.638 1.00 0.00 H new ATOM 0 HG2 LYS C 17 55.727 -9.427 -5.005 1.00 0.00 H new ATOM 0 HG3 LYS C 17 55.635 -11.172 -4.875 1.00 0.00 H new ATOM 0 HD2 LYS C 17 53.542 -10.179 -6.674 1.00 0.00 H new ATOM 0 HD3 LYS C 17 55.111 -9.597 -7.194 1.00 0.00 H new ATOM 0 HE2 LYS C 17 55.592 -12.308 -6.484 1.00 0.00 H new ATOM 0 HE3 LYS C 17 54.041 -12.348 -7.299 1.00 0.00 H new ATOM 0 HZ1 LYS C 17 55.878 -12.397 -8.907 1.00 0.00 H new ATOM 0 HZ2 LYS C 17 54.978 -10.969 -9.091 1.00 0.00 H new ATOM 0 HZ3 LYS C 17 56.480 -10.930 -8.301 1.00 0.00 H new ATOM 276 N ASN C 18 52.830 -7.930 -6.405 1.00 0.00 N ATOM 277 CA ASN C 18 53.085 -7.197 -7.678 1.00 0.00 C ATOM 278 C ASN C 18 52.967 -5.689 -7.444 1.00 0.00 C ATOM 279 O ASN C 18 53.606 -4.895 -8.106 1.00 0.00 O ATOM 280 CB ASN C 18 51.992 -7.677 -8.632 1.00 0.00 C ATOM 281 CG ASN C 18 52.627 -8.442 -9.795 1.00 0.00 C ATOM 282 OD1 ASN C 18 53.815 -8.343 -10.026 1.00 0.00 O ATOM 283 ND2 ASN C 18 51.879 -9.208 -10.540 1.00 0.00 N ATOM 0 H ASN C 18 51.937 -8.421 -6.360 1.00 0.00 H new ATOM 0 HA ASN C 18 54.083 -7.383 -8.074 1.00 0.00 H new ATOM 0 HB2 ASN C 18 51.289 -8.319 -8.102 1.00 0.00 H new ATOM 0 HB3 ASN C 18 51.425 -6.826 -9.009 1.00 0.00 H new ATOM 0 HD21 ASN C 18 52.292 -9.724 -11.317 1.00 0.00 H new ATOM 0 HD22 ASN C 18 50.881 -9.291 -10.346 1.00 0.00 H new ATOM 290 N GLU C 19 52.153 -5.290 -6.507 1.00 0.00 N ATOM 291 CA GLU C 19 51.988 -3.835 -6.227 1.00 0.00 C ATOM 292 C GLU C 19 53.202 -3.303 -5.459 1.00 0.00 C ATOM 293 O GLU C 19 53.555 -2.145 -5.564 1.00 0.00 O ATOM 294 CB GLU C 19 50.728 -3.737 -5.369 1.00 0.00 C ATOM 295 CG GLU C 19 50.638 -2.342 -4.749 1.00 0.00 C ATOM 296 CD GLU C 19 49.168 -1.961 -4.561 1.00 0.00 C ATOM 297 OE1 GLU C 19 48.521 -2.569 -3.724 1.00 0.00 O ATOM 298 OE2 GLU C 19 48.714 -1.067 -5.257 1.00 0.00 O ATOM 0 H GLU C 19 51.593 -5.910 -5.921 1.00 0.00 H new ATOM 0 HA GLU C 19 51.906 -3.246 -7.140 1.00 0.00 H new ATOM 0 HB2 GLU C 19 49.845 -3.933 -5.977 1.00 0.00 H new ATOM 0 HB3 GLU C 19 50.750 -4.494 -4.585 1.00 0.00 H new ATOM 0 HG2 GLU C 19 51.155 -2.325 -3.789 1.00 0.00 H new ATOM 0 HG3 GLU C 19 51.134 -1.614 -5.391 1.00 0.00 H new ATOM 305 N PHE C 20 53.840 -4.139 -4.686 1.00 0.00 N ATOM 306 CA PHE C 20 55.026 -3.676 -3.911 1.00 0.00 C ATOM 307 C PHE C 20 56.272 -3.665 -4.801 1.00 0.00 C ATOM 308 O PHE C 20 57.061 -2.742 -4.766 1.00 0.00 O ATOM 309 CB PHE C 20 55.184 -4.694 -2.781 1.00 0.00 C ATOM 310 CG PHE C 20 54.004 -4.598 -1.843 1.00 0.00 C ATOM 311 CD1 PHE C 20 53.475 -3.345 -1.508 1.00 0.00 C ATOM 312 CD2 PHE C 20 53.438 -5.763 -1.310 1.00 0.00 C ATOM 313 CE1 PHE C 20 52.382 -3.258 -0.640 1.00 0.00 C ATOM 314 CE2 PHE C 20 52.344 -5.674 -0.442 1.00 0.00 C ATOM 315 CZ PHE C 20 51.816 -4.422 -0.107 1.00 0.00 C ATOM 0 H PHE C 20 53.592 -5.120 -4.558 1.00 0.00 H new ATOM 0 HA PHE C 20 54.899 -2.662 -3.532 1.00 0.00 H new ATOM 0 HB2 PHE C 20 55.253 -5.701 -3.192 1.00 0.00 H new ATOM 0 HB3 PHE C 20 56.110 -4.508 -2.237 1.00 0.00 H new ATOM 0 HD1 PHE C 20 53.911 -2.447 -1.920 1.00 0.00 H new ATOM 0 HD2 PHE C 20 53.846 -6.729 -1.569 1.00 0.00 H new ATOM 0 HE1 PHE C 20 51.974 -2.292 -0.381 1.00 0.00 H new ATOM 0 HE2 PHE C 20 51.907 -6.572 -0.030 1.00 0.00 H new ATOM 0 HZ PHE C 20 50.972 -4.354 0.563 1.00 0.00 H new ATOM 325 N LYS C 21 56.458 -4.683 -5.596 1.00 0.00 N ATOM 326 CA LYS C 21 57.656 -4.723 -6.481 1.00 0.00 C ATOM 327 C LYS C 21 57.767 -3.416 -7.278 1.00 0.00 C ATOM 328 O LYS C 21 58.826 -3.052 -7.748 1.00 0.00 O ATOM 329 CB LYS C 21 57.432 -5.935 -7.402 1.00 0.00 C ATOM 330 CG LYS C 21 56.720 -5.511 -8.691 1.00 0.00 C ATOM 331 CD LYS C 21 57.759 -5.049 -9.715 1.00 0.00 C ATOM 332 CE LYS C 21 58.044 -6.182 -10.703 1.00 0.00 C ATOM 333 NZ LYS C 21 56.938 -6.109 -11.698 1.00 0.00 N ATOM 0 H LYS C 21 55.834 -5.486 -5.671 1.00 0.00 H new ATOM 0 HA LYS C 21 58.588 -4.819 -5.924 1.00 0.00 H new ATOM 0 HB2 LYS C 21 58.390 -6.396 -7.644 1.00 0.00 H new ATOM 0 HB3 LYS C 21 56.838 -6.688 -6.883 1.00 0.00 H new ATOM 0 HG2 LYS C 21 56.143 -6.344 -9.092 1.00 0.00 H new ATOM 0 HG3 LYS C 21 56.015 -4.706 -8.483 1.00 0.00 H new ATOM 0 HD2 LYS C 21 57.394 -4.171 -10.248 1.00 0.00 H new ATOM 0 HD3 LYS C 21 58.678 -4.755 -9.208 1.00 0.00 H new ATOM 0 HE2 LYS C 21 59.015 -6.054 -11.181 1.00 0.00 H new ATOM 0 HE3 LYS C 21 58.061 -7.149 -10.201 1.00 0.00 H new ATOM 0 HZ1 LYS C 21 57.125 -6.776 -12.474 1.00 0.00 H new ATOM 0 HZ2 LYS C 21 56.039 -6.357 -11.237 1.00 0.00 H new ATOM 0 HZ3 LYS C 21 56.877 -5.143 -12.078 1.00 0.00 H new ATOM 347 N ALA C 22 56.678 -2.712 -7.432 1.00 0.00 N ATOM 348 CA ALA C 22 56.719 -1.433 -8.197 1.00 0.00 C ATOM 349 C ALA C 22 57.541 -0.390 -7.435 1.00 0.00 C ATOM 350 O ALA C 22 58.573 0.058 -7.897 1.00 0.00 O ATOM 351 CB ALA C 22 55.259 -0.991 -8.309 1.00 0.00 C ATOM 0 H ALA C 22 55.763 -2.967 -7.061 1.00 0.00 H new ATOM 0 HA ALA C 22 57.184 -1.550 -9.176 1.00 0.00 H new ATOM 0 HB1 ALA C 22 55.204 -0.053 -8.861 1.00 0.00 H new ATOM 0 HB2 ALA C 22 54.687 -1.755 -8.835 1.00 0.00 H new ATOM 0 HB3 ALA C 22 54.844 -0.849 -7.311 1.00 0.00 H new ATOM 357 N ALA C 23 57.096 -0.001 -6.271 1.00 0.00 N ATOM 358 CA ALA C 23 57.857 1.010 -5.484 1.00 0.00 C ATOM 359 C ALA C 23 59.271 0.495 -5.201 1.00 0.00 C ATOM 360 O ALA C 23 60.231 1.239 -5.223 1.00 0.00 O ATOM 361 CB ALA C 23 57.073 1.170 -4.181 1.00 0.00 C ATOM 0 H ALA C 23 56.240 -0.339 -5.832 1.00 0.00 H new ATOM 0 HA ALA C 23 57.961 1.957 -6.013 1.00 0.00 H new ATOM 0 HB1 ALA C 23 57.571 1.901 -3.544 1.00 0.00 H new ATOM 0 HB2 ALA C 23 56.062 1.512 -4.404 1.00 0.00 H new ATOM 0 HB3 ALA C 23 57.026 0.211 -3.665 1.00 0.00 H new ATOM 367 N PHE C 24 59.403 -0.777 -4.938 1.00 0.00 N ATOM 368 CA PHE C 24 60.753 -1.346 -4.657 1.00 0.00 C ATOM 369 C PHE C 24 61.713 -1.008 -5.800 1.00 0.00 C ATOM 370 O PHE C 24 62.796 -0.501 -5.585 1.00 0.00 O ATOM 371 CB PHE C 24 60.532 -2.857 -4.564 1.00 0.00 C ATOM 372 CG PHE C 24 61.826 -3.537 -4.186 1.00 0.00 C ATOM 373 CD1 PHE C 24 62.460 -3.217 -2.980 1.00 0.00 C ATOM 374 CD2 PHE C 24 62.390 -4.490 -5.041 1.00 0.00 C ATOM 375 CE1 PHE C 24 63.658 -3.850 -2.628 1.00 0.00 C ATOM 376 CE2 PHE C 24 63.588 -5.124 -4.691 1.00 0.00 C ATOM 377 CZ PHE C 24 64.223 -4.803 -3.485 1.00 0.00 C ATOM 0 H PHE C 24 58.635 -1.447 -4.905 1.00 0.00 H new ATOM 0 HA PHE C 24 61.194 -0.944 -3.745 1.00 0.00 H new ATOM 0 HB2 PHE C 24 59.764 -3.077 -3.823 1.00 0.00 H new ATOM 0 HB3 PHE C 24 60.173 -3.241 -5.519 1.00 0.00 H new ATOM 0 HD1 PHE C 24 62.025 -2.481 -2.320 1.00 0.00 H new ATOM 0 HD2 PHE C 24 61.901 -4.737 -5.972 1.00 0.00 H new ATOM 0 HE1 PHE C 24 64.146 -3.604 -1.697 1.00 0.00 H new ATOM 0 HE2 PHE C 24 64.022 -5.860 -5.351 1.00 0.00 H new ATOM 0 HZ PHE C 24 65.148 -5.290 -3.216 1.00 0.00 H new ATOM 387 N ASP C 25 61.325 -1.280 -7.017 1.00 0.00 N ATOM 388 CA ASP C 25 62.217 -0.966 -8.169 1.00 0.00 C ATOM 389 C ASP C 25 62.583 0.520 -8.152 1.00 0.00 C ATOM 390 O ASP C 25 63.731 0.889 -8.297 1.00 0.00 O ATOM 391 CB ASP C 25 61.395 -1.305 -9.414 1.00 0.00 C ATOM 392 CG ASP C 25 62.190 -2.262 -10.305 1.00 0.00 C ATOM 393 OD1 ASP C 25 63.389 -2.072 -10.423 1.00 0.00 O ATOM 394 OD2 ASP C 25 61.585 -3.168 -10.854 1.00 0.00 O ATOM 0 H ASP C 25 60.431 -1.705 -7.262 1.00 0.00 H new ATOM 0 HA ASP C 25 63.151 -1.527 -8.138 1.00 0.00 H new ATOM 0 HB2 ASP C 25 60.449 -1.762 -9.125 1.00 0.00 H new ATOM 0 HB3 ASP C 25 61.155 -0.395 -9.963 1.00 0.00 H new ATOM 399 N ILE C 26 61.614 1.376 -7.971 1.00 0.00 N ATOM 400 CA ILE C 26 61.903 2.836 -7.937 1.00 0.00 C ATOM 401 C ILE C 26 62.948 3.150 -6.864 1.00 0.00 C ATOM 402 O ILE C 26 63.890 3.881 -7.095 1.00 0.00 O ATOM 403 CB ILE C 26 60.571 3.487 -7.583 1.00 0.00 C ATOM 404 CG1 ILE C 26 59.479 2.907 -8.507 1.00 0.00 C ATOM 405 CG2 ILE C 26 60.701 5.008 -7.747 1.00 0.00 C ATOM 406 CD1 ILE C 26 58.607 4.014 -9.098 1.00 0.00 C ATOM 0 H ILE C 26 60.633 1.125 -7.845 1.00 0.00 H new ATOM 0 HA ILE C 26 62.303 3.198 -8.884 1.00 0.00 H new ATOM 0 HB ILE C 26 60.294 3.280 -6.549 1.00 0.00 H new ATOM 0 HG12 ILE C 26 59.945 2.339 -9.312 1.00 0.00 H new ATOM 0 HG13 ILE C 26 58.856 2.211 -7.945 1.00 0.00 H new ATOM 0 HG21 ILE C 26 59.753 5.483 -7.496 1.00 0.00 H new ATOM 0 HG22 ILE C 26 61.481 5.380 -7.082 1.00 0.00 H new ATOM 0 HG23 ILE C 26 60.962 5.242 -8.779 1.00 0.00 H new ATOM 0 HD11 ILE C 26 57.848 3.573 -9.744 1.00 0.00 H new ATOM 0 HD12 ILE C 26 58.122 4.565 -8.292 1.00 0.00 H new ATOM 0 HD13 ILE C 26 59.228 4.695 -9.680 1.00 0.00 H new ATOM 418 N PHE C 27 62.781 2.608 -5.690 1.00 0.00 N ATOM 419 CA PHE C 27 63.757 2.877 -4.596 1.00 0.00 C ATOM 420 C PHE C 27 65.176 2.505 -5.037 1.00 0.00 C ATOM 421 O PHE C 27 66.149 2.916 -4.436 1.00 0.00 O ATOM 422 CB PHE C 27 63.302 1.987 -3.436 1.00 0.00 C ATOM 423 CG PHE C 27 62.133 2.629 -2.718 1.00 0.00 C ATOM 424 CD1 PHE C 27 61.434 3.691 -3.310 1.00 0.00 C ATOM 425 CD2 PHE C 27 61.748 2.159 -1.456 1.00 0.00 C ATOM 426 CE1 PHE C 27 60.354 4.279 -2.640 1.00 0.00 C ATOM 427 CE2 PHE C 27 60.668 2.747 -0.787 1.00 0.00 C ATOM 428 CZ PHE C 27 59.972 3.808 -1.379 1.00 0.00 C ATOM 0 H PHE C 27 62.010 1.989 -5.440 1.00 0.00 H new ATOM 0 HA PHE C 27 63.784 3.931 -4.319 1.00 0.00 H new ATOM 0 HB2 PHE C 27 63.014 1.005 -3.812 1.00 0.00 H new ATOM 0 HB3 PHE C 27 64.127 1.833 -2.740 1.00 0.00 H new ATOM 0 HD1 PHE C 27 61.729 4.055 -4.283 1.00 0.00 H new ATOM 0 HD2 PHE C 27 62.285 1.342 -0.998 1.00 0.00 H new ATOM 0 HE1 PHE C 27 59.816 5.096 -3.097 1.00 0.00 H new ATOM 0 HE2 PHE C 27 60.372 2.382 0.185 1.00 0.00 H new ATOM 0 HZ PHE C 27 59.140 4.263 -0.862 1.00 0.00 H new ATOM 438 N VAL C 28 65.305 1.732 -6.080 1.00 0.00 N ATOM 439 CA VAL C 28 66.661 1.336 -6.557 1.00 0.00 C ATOM 440 C VAL C 28 66.840 1.733 -8.023 1.00 0.00 C ATOM 441 O VAL C 28 67.638 1.162 -8.739 1.00 0.00 O ATOM 442 CB VAL C 28 66.698 -0.183 -6.413 1.00 0.00 C ATOM 443 CG1 VAL C 28 66.469 -0.567 -4.950 1.00 0.00 C ATOM 444 CG2 VAL C 28 65.599 -0.798 -7.282 1.00 0.00 C ATOM 0 H VAL C 28 64.528 1.356 -6.624 1.00 0.00 H new ATOM 0 HA VAL C 28 67.457 1.823 -5.993 1.00 0.00 H new ATOM 0 HB VAL C 28 67.671 -0.556 -6.734 1.00 0.00 H new ATOM 0 HG11 VAL C 28 66.496 -1.652 -4.850 1.00 0.00 H new ATOM 0 HG12 VAL C 28 67.251 -0.126 -4.331 1.00 0.00 H new ATOM 0 HG13 VAL C 28 65.497 -0.197 -4.625 1.00 0.00 H new ATOM 0 HG21 VAL C 28 65.621 -1.883 -7.183 1.00 0.00 H new ATOM 0 HG22 VAL C 28 64.628 -0.424 -6.959 1.00 0.00 H new ATOM 0 HG23 VAL C 28 65.764 -0.526 -8.324 1.00 0.00 H new ATOM 454 N LEU C 29 66.097 2.702 -8.477 1.00 0.00 N ATOM 455 CA LEU C 29 66.216 3.131 -9.899 1.00 0.00 C ATOM 456 C LEU C 29 67.662 3.517 -10.229 1.00 0.00 C ATOM 457 O LEU C 29 68.024 4.676 -10.207 1.00 0.00 O ATOM 458 CB LEU C 29 65.299 4.348 -10.019 1.00 0.00 C ATOM 459 CG LEU C 29 64.146 4.030 -10.972 1.00 0.00 C ATOM 460 CD1 LEU C 29 62.997 5.008 -10.726 1.00 0.00 C ATOM 461 CD2 LEU C 29 64.630 4.165 -12.418 1.00 0.00 C ATOM 0 H LEU C 29 65.411 3.217 -7.925 1.00 0.00 H new ATOM 0 HA LEU C 29 65.940 2.335 -10.591 1.00 0.00 H new ATOM 0 HB2 LEU C 29 64.909 4.620 -9.038 1.00 0.00 H new ATOM 0 HB3 LEU C 29 65.862 5.205 -10.387 1.00 0.00 H new ATOM 0 HG LEU C 29 63.799 3.011 -10.797 1.00 0.00 H new ATOM 0 HD11 LEU C 29 62.175 4.782 -11.405 1.00 0.00 H new ATOM 0 HD12 LEU C 29 62.653 4.914 -9.696 1.00 0.00 H new ATOM 0 HD13 LEU C 29 63.343 6.027 -10.901 1.00 0.00 H new ATOM 0 HD21 LEU C 29 63.810 3.939 -13.099 1.00 0.00 H new ATOM 0 HD22 LEU C 29 64.976 5.184 -12.592 1.00 0.00 H new ATOM 0 HD23 LEU C 29 65.450 3.469 -12.594 1.00 0.00 H new ATOM 473 N GLY C 30 68.490 2.557 -10.542 1.00 0.00 N ATOM 474 CA GLY C 30 69.906 2.878 -10.880 1.00 0.00 C ATOM 475 C GLY C 30 70.839 2.311 -9.808 1.00 0.00 C ATOM 476 O GLY C 30 72.042 2.269 -9.979 1.00 0.00 O ATOM 0 H GLY C 30 68.248 1.567 -10.578 1.00 0.00 H new ATOM 0 HA2 GLY C 30 70.160 2.460 -11.854 1.00 0.00 H new ATOM 0 HA3 GLY C 30 70.036 3.958 -10.953 1.00 0.00 H new ATOM 480 N ALA C 31 70.299 1.877 -8.704 1.00 0.00 N ATOM 481 CA ALA C 31 71.163 1.316 -7.624 1.00 0.00 C ATOM 482 C ALA C 31 72.124 0.275 -8.204 1.00 0.00 C ATOM 483 O ALA C 31 71.938 -0.214 -9.301 1.00 0.00 O ATOM 484 CB ALA C 31 70.192 0.662 -6.641 1.00 0.00 C ATOM 0 H ALA C 31 69.299 1.886 -8.501 1.00 0.00 H new ATOM 0 HA ALA C 31 71.775 2.080 -7.144 1.00 0.00 H new ATOM 0 HB1 ALA C 31 70.751 0.224 -5.814 1.00 0.00 H new ATOM 0 HB2 ALA C 31 69.503 1.414 -6.255 1.00 0.00 H new ATOM 0 HB3 ALA C 31 69.628 -0.119 -7.152 1.00 0.00 H new ATOM 490 N GLU C 32 73.153 -0.067 -7.478 1.00 0.00 N ATOM 491 CA GLU C 32 74.125 -1.075 -7.990 1.00 0.00 C ATOM 492 C GLU C 32 73.511 -2.477 -7.934 1.00 0.00 C ATOM 493 O GLU C 32 73.165 -3.054 -8.946 1.00 0.00 O ATOM 494 CB GLU C 32 75.329 -0.976 -7.055 1.00 0.00 C ATOM 495 CG GLU C 32 76.006 0.383 -7.239 1.00 0.00 C ATOM 496 CD GLU C 32 76.653 0.815 -5.922 1.00 0.00 C ATOM 497 OE1 GLU C 32 75.960 1.408 -5.110 1.00 0.00 O ATOM 498 OE2 GLU C 32 77.830 0.548 -5.748 1.00 0.00 O ATOM 0 H GLU C 32 73.363 0.308 -6.553 1.00 0.00 H new ATOM 0 HA GLU C 32 74.402 -0.892 -9.028 1.00 0.00 H new ATOM 0 HB2 GLU C 32 75.010 -1.098 -6.020 1.00 0.00 H new ATOM 0 HB3 GLU C 32 76.036 -1.778 -7.268 1.00 0.00 H new ATOM 0 HG2 GLU C 32 76.760 0.322 -8.024 1.00 0.00 H new ATOM 0 HG3 GLU C 32 75.274 1.125 -7.557 1.00 0.00 H new ATOM 505 N ASP C 33 73.372 -3.029 -6.760 1.00 0.00 N ATOM 506 CA ASP C 33 72.780 -4.392 -6.645 1.00 0.00 C ATOM 507 C ASP C 33 71.285 -4.294 -6.331 1.00 0.00 C ATOM 508 O ASP C 33 70.792 -4.909 -5.407 1.00 0.00 O ATOM 509 CB ASP C 33 73.530 -5.057 -5.491 1.00 0.00 C ATOM 510 CG ASP C 33 73.443 -6.576 -5.637 1.00 0.00 C ATOM 511 OD1 ASP C 33 72.348 -7.069 -5.852 1.00 0.00 O ATOM 512 OD2 ASP C 33 74.473 -7.222 -5.532 1.00 0.00 O ATOM 0 H ASP C 33 73.642 -2.596 -5.877 1.00 0.00 H new ATOM 0 HA ASP C 33 72.873 -4.961 -7.570 1.00 0.00 H new ATOM 0 HB2 ASP C 33 74.573 -4.740 -5.490 1.00 0.00 H new ATOM 0 HB3 ASP C 33 73.102 -4.747 -4.538 1.00 0.00 H new ATOM 517 N GLY C 34 70.560 -3.524 -7.096 1.00 0.00 N ATOM 518 CA GLY C 34 69.098 -3.387 -6.844 1.00 0.00 C ATOM 519 C GLY C 34 68.854 -3.151 -5.354 1.00 0.00 C ATOM 520 O GLY C 34 67.910 -3.659 -4.781 1.00 0.00 O ATOM 0 H GLY C 34 70.917 -2.984 -7.884 1.00 0.00 H new ATOM 0 HA2 GLY C 34 68.695 -2.557 -7.425 1.00 0.00 H new ATOM 0 HA3 GLY C 34 68.577 -4.287 -7.170 1.00 0.00 H new ATOM 524 N CYS C 35 69.696 -2.383 -4.718 1.00 0.00 N ATOM 525 CA CYS C 35 69.509 -2.114 -3.264 1.00 0.00 C ATOM 526 C CYS C 35 69.173 -0.638 -3.042 1.00 0.00 C ATOM 527 O CYS C 35 69.166 0.152 -3.966 1.00 0.00 O ATOM 528 CB CYS C 35 70.852 -2.461 -2.620 1.00 0.00 C ATOM 529 SG CYS C 35 72.096 -1.252 -3.135 1.00 0.00 S ATOM 0 H CYS C 35 70.505 -1.930 -5.142 1.00 0.00 H new ATOM 0 HA CYS C 35 68.692 -2.695 -2.837 1.00 0.00 H new ATOM 0 HB2 CYS C 35 70.758 -2.462 -1.534 1.00 0.00 H new ATOM 0 HB3 CYS C 35 71.160 -3.464 -2.914 1.00 0.00 H new ATOM 0 HG CYS C 35 73.238 -1.544 -2.587 1.00 0.00 H new ATOM 535 N ILE C 36 68.895 -0.256 -1.826 1.00 0.00 N ATOM 536 CA ILE C 36 68.562 1.171 -1.553 1.00 0.00 C ATOM 537 C ILE C 36 69.621 1.794 -0.641 1.00 0.00 C ATOM 538 O ILE C 36 70.263 1.117 0.137 1.00 0.00 O ATOM 539 CB ILE C 36 67.201 1.140 -0.859 1.00 0.00 C ATOM 540 CG1 ILE C 36 66.177 0.470 -1.779 1.00 0.00 C ATOM 541 CG2 ILE C 36 66.752 2.569 -0.554 1.00 0.00 C ATOM 542 CD1 ILE C 36 64.970 0.015 -0.955 1.00 0.00 C ATOM 0 H ILE C 36 68.884 -0.869 -1.011 1.00 0.00 H new ATOM 0 HA ILE C 36 68.536 1.770 -2.463 1.00 0.00 H new ATOM 0 HB ILE C 36 67.279 0.577 0.071 1.00 0.00 H new ATOM 0 HG12 ILE C 36 65.859 1.166 -2.555 1.00 0.00 H new ATOM 0 HG13 ILE C 36 66.629 -0.384 -2.283 1.00 0.00 H new ATOM 0 HG21 ILE C 36 65.781 2.547 -0.059 1.00 0.00 H new ATOM 0 HG22 ILE C 36 67.482 3.048 0.099 1.00 0.00 H new ATOM 0 HG23 ILE C 36 66.673 3.132 -1.484 1.00 0.00 H new ATOM 0 HD11 ILE C 36 64.241 -0.462 -1.610 1.00 0.00 H new ATOM 0 HD12 ILE C 36 65.295 -0.696 -0.195 1.00 0.00 H new ATOM 0 HD13 ILE C 36 64.513 0.879 -0.472 1.00 0.00 H new ATOM 554 N SER C 37 69.808 3.080 -0.735 1.00 0.00 N ATOM 555 CA SER C 37 70.827 3.757 0.118 1.00 0.00 C ATOM 556 C SER C 37 70.489 5.239 0.249 1.00 0.00 C ATOM 557 O SER C 37 71.354 6.088 0.237 1.00 0.00 O ATOM 558 CB SER C 37 72.133 3.588 -0.635 1.00 0.00 C ATOM 559 OG SER C 37 72.974 2.685 0.071 1.00 0.00 O ATOM 0 H SER C 37 69.297 3.695 -1.368 1.00 0.00 H new ATOM 0 HA SER C 37 70.872 3.341 1.125 1.00 0.00 H new ATOM 0 HB2 SER C 37 71.940 3.212 -1.640 1.00 0.00 H new ATOM 0 HB3 SER C 37 72.629 4.552 -0.746 1.00 0.00 H new ATOM 0 HG SER C 37 73.817 2.574 -0.416 1.00 0.00 H new ATOM 565 N THR C 38 69.229 5.537 0.354 1.00 0.00 N ATOM 566 CA THR C 38 68.767 6.958 0.473 1.00 0.00 C ATOM 567 C THR C 38 68.910 7.665 -0.876 1.00 0.00 C ATOM 568 O THR C 38 67.954 8.188 -1.414 1.00 0.00 O ATOM 569 CB THR C 38 69.647 7.635 1.538 1.00 0.00 C ATOM 570 OG1 THR C 38 70.807 8.182 0.927 1.00 0.00 O ATOM 571 CG2 THR C 38 70.052 6.626 2.617 1.00 0.00 C ATOM 0 H THR C 38 68.478 4.847 0.363 1.00 0.00 H new ATOM 0 HA THR C 38 67.717 7.007 0.763 1.00 0.00 H new ATOM 0 HB THR C 38 69.076 8.436 2.007 1.00 0.00 H new ATOM 0 HG1 THR C 38 71.446 7.464 0.737 1.00 0.00 H new ATOM 0 HG21 THR C 38 70.674 7.121 3.363 1.00 0.00 H new ATOM 0 HG22 THR C 38 69.158 6.228 3.097 1.00 0.00 H new ATOM 0 HG23 THR C 38 70.613 5.810 2.160 1.00 0.00 H new ATOM 579 N LYS C 39 70.089 7.680 -1.435 1.00 0.00 N ATOM 580 CA LYS C 39 70.268 8.347 -2.755 1.00 0.00 C ATOM 581 C LYS C 39 69.195 7.850 -3.727 1.00 0.00 C ATOM 582 O LYS C 39 68.709 8.588 -4.562 1.00 0.00 O ATOM 583 CB LYS C 39 71.664 7.936 -3.230 1.00 0.00 C ATOM 584 CG LYS C 39 72.331 9.123 -3.931 1.00 0.00 C ATOM 585 CD LYS C 39 73.850 8.954 -3.893 1.00 0.00 C ATOM 586 CE LYS C 39 74.234 7.619 -4.534 1.00 0.00 C ATOM 587 NZ LYS C 39 75.555 7.867 -5.174 1.00 0.00 N ATOM 0 H LYS C 39 70.931 7.262 -1.038 1.00 0.00 H new ATOM 0 HA LYS C 39 70.173 9.431 -2.693 1.00 0.00 H new ATOM 0 HB2 LYS C 39 72.268 7.613 -2.382 1.00 0.00 H new ATOM 0 HB3 LYS C 39 71.594 7.089 -3.912 1.00 0.00 H new ATOM 0 HG2 LYS C 39 71.988 9.188 -4.964 1.00 0.00 H new ATOM 0 HG3 LYS C 39 72.046 10.054 -3.441 1.00 0.00 H new ATOM 0 HD2 LYS C 39 74.331 9.776 -4.424 1.00 0.00 H new ATOM 0 HD3 LYS C 39 74.204 8.990 -2.863 1.00 0.00 H new ATOM 0 HE2 LYS C 39 74.299 6.827 -3.788 1.00 0.00 H new ATOM 0 HE3 LYS C 39 73.492 7.305 -5.268 1.00 0.00 H new ATOM 0 HZ1 LYS C 39 75.886 6.996 -5.636 1.00 0.00 H new ATOM 0 HZ2 LYS C 39 75.461 8.621 -5.884 1.00 0.00 H new ATOM 0 HZ3 LYS C 39 76.243 8.157 -4.450 1.00 0.00 H new ATOM 601 N GLU C 40 68.810 6.608 -3.611 1.00 0.00 N ATOM 602 CA GLU C 40 67.754 6.066 -4.512 1.00 0.00 C ATOM 603 C GLU C 40 66.387 6.218 -3.844 1.00 0.00 C ATOM 604 O GLU C 40 65.366 6.302 -4.498 1.00 0.00 O ATOM 605 CB GLU C 40 68.098 4.587 -4.696 1.00 0.00 C ATOM 606 CG GLU C 40 69.568 4.446 -5.090 1.00 0.00 C ATOM 607 CD GLU C 40 69.845 5.293 -6.334 1.00 0.00 C ATOM 608 OE1 GLU C 40 69.250 5.012 -7.361 1.00 0.00 O ATOM 609 OE2 GLU C 40 70.646 6.208 -6.237 1.00 0.00 O ATOM 0 H GLU C 40 69.182 5.945 -2.931 1.00 0.00 H new ATOM 0 HA GLU C 40 67.713 6.589 -5.468 1.00 0.00 H new ATOM 0 HB2 GLU C 40 67.905 4.041 -3.773 1.00 0.00 H new ATOM 0 HB3 GLU C 40 67.462 4.148 -5.465 1.00 0.00 H new ATOM 0 HG2 GLU C 40 70.208 4.767 -4.268 1.00 0.00 H new ATOM 0 HG3 GLU C 40 69.804 3.401 -5.289 1.00 0.00 H new ATOM 616 N LEU C 41 66.366 6.256 -2.539 1.00 0.00 N ATOM 617 CA LEU C 41 65.073 6.404 -1.812 1.00 0.00 C ATOM 618 C LEU C 41 64.653 7.876 -1.780 1.00 0.00 C ATOM 619 O LEU C 41 63.516 8.214 -2.048 1.00 0.00 O ATOM 620 CB LEU C 41 65.357 5.895 -0.398 1.00 0.00 C ATOM 621 CG LEU C 41 64.042 5.509 0.281 1.00 0.00 C ATOM 622 CD1 LEU C 41 63.085 6.701 0.248 1.00 0.00 C ATOM 623 CD2 LEU C 41 63.415 4.328 -0.463 1.00 0.00 C ATOM 0 H LEU C 41 67.192 6.191 -1.943 1.00 0.00 H new ATOM 0 HA LEU C 41 64.262 5.853 -2.289 1.00 0.00 H new ATOM 0 HB2 LEU C 41 66.024 5.034 -0.438 1.00 0.00 H new ATOM 0 HB3 LEU C 41 65.865 6.666 0.182 1.00 0.00 H new ATOM 0 HG LEU C 41 64.233 5.226 1.316 1.00 0.00 H new ATOM 0 HD11 LEU C 41 62.147 6.428 0.731 1.00 0.00 H new ATOM 0 HD12 LEU C 41 63.534 7.543 0.776 1.00 0.00 H new ATOM 0 HD13 LEU C 41 62.891 6.983 -0.787 1.00 0.00 H new ATOM 0 HD21 LEU C 41 62.477 4.051 0.019 1.00 0.00 H new ATOM 0 HD22 LEU C 41 63.221 4.611 -1.498 1.00 0.00 H new ATOM 0 HD23 LEU C 41 64.099 3.480 -0.441 1.00 0.00 H new ATOM 635 N GLY C 42 65.562 8.754 -1.454 1.00 0.00 N ATOM 636 CA GLY C 42 65.217 10.203 -1.405 1.00 0.00 C ATOM 637 C GLY C 42 64.624 10.632 -2.747 1.00 0.00 C ATOM 638 O GLY C 42 63.842 11.559 -2.824 1.00 0.00 O ATOM 0 H GLY C 42 66.529 8.530 -1.219 1.00 0.00 H new ATOM 0 HA2 GLY C 42 64.503 10.391 -0.603 1.00 0.00 H new ATOM 0 HA3 GLY C 42 66.107 10.792 -1.184 1.00 0.00 H new ATOM 642 N LYS C 43 64.992 9.967 -3.807 1.00 0.00 N ATOM 643 CA LYS C 43 64.450 10.339 -5.146 1.00 0.00 C ATOM 644 C LYS C 43 62.925 10.467 -5.087 1.00 0.00 C ATOM 645 O LYS C 43 62.340 11.324 -5.720 1.00 0.00 O ATOM 646 CB LYS C 43 64.857 9.191 -6.071 1.00 0.00 C ATOM 647 CG LYS C 43 65.882 9.694 -7.090 1.00 0.00 C ATOM 648 CD LYS C 43 66.933 8.610 -7.335 1.00 0.00 C ATOM 649 CE LYS C 43 66.277 7.407 -8.019 1.00 0.00 C ATOM 650 NZ LYS C 43 66.384 7.683 -9.480 1.00 0.00 N ATOM 0 H LYS C 43 65.644 9.183 -3.805 1.00 0.00 H new ATOM 0 HA LYS C 43 64.834 11.298 -5.493 1.00 0.00 H new ATOM 0 HB2 LYS C 43 65.280 8.373 -5.488 1.00 0.00 H new ATOM 0 HB3 LYS C 43 63.981 8.796 -6.585 1.00 0.00 H new ATOM 0 HG2 LYS C 43 65.385 9.951 -8.025 1.00 0.00 H new ATOM 0 HG3 LYS C 43 66.360 10.602 -6.723 1.00 0.00 H new ATOM 0 HD2 LYS C 43 67.737 9.002 -7.958 1.00 0.00 H new ATOM 0 HD3 LYS C 43 67.382 8.304 -6.390 1.00 0.00 H new ATOM 0 HE2 LYS C 43 66.784 6.479 -7.755 1.00 0.00 H new ATOM 0 HE3 LYS C 43 65.236 7.299 -7.714 1.00 0.00 H new ATOM 0 HZ1 LYS C 43 65.548 7.302 -9.967 1.00 0.00 H new ATOM 0 HZ2 LYS C 43 66.438 8.710 -9.636 1.00 0.00 H new ATOM 0 HZ3 LYS C 43 67.241 7.230 -9.857 1.00 0.00 H new ATOM 664 N VAL C 44 62.274 9.624 -4.333 1.00 0.00 N ATOM 665 CA VAL C 44 60.787 9.699 -4.237 1.00 0.00 C ATOM 666 C VAL C 44 60.372 10.840 -3.306 1.00 0.00 C ATOM 667 O VAL C 44 59.418 11.548 -3.564 1.00 0.00 O ATOM 668 CB VAL C 44 60.359 8.355 -3.652 1.00 0.00 C ATOM 669 CG1 VAL C 44 58.914 8.449 -3.156 1.00 0.00 C ATOM 670 CG2 VAL C 44 60.457 7.274 -4.730 1.00 0.00 C ATOM 0 H VAL C 44 62.707 8.886 -3.779 1.00 0.00 H new ATOM 0 HA VAL C 44 60.323 9.892 -5.204 1.00 0.00 H new ATOM 0 HB VAL C 44 61.013 8.099 -2.819 1.00 0.00 H new ATOM 0 HG11 VAL C 44 58.609 7.489 -2.739 1.00 0.00 H new ATOM 0 HG12 VAL C 44 58.843 9.218 -2.387 1.00 0.00 H new ATOM 0 HG13 VAL C 44 58.260 8.707 -3.989 1.00 0.00 H new ATOM 0 HG21 VAL C 44 60.151 6.315 -4.312 1.00 0.00 H new ATOM 0 HG22 VAL C 44 59.804 7.531 -5.564 1.00 0.00 H new ATOM 0 HG23 VAL C 44 61.486 7.205 -5.083 1.00 0.00 H new ATOM 680 N MET C 45 61.079 11.020 -2.224 1.00 0.00 N ATOM 681 CA MET C 45 60.723 12.111 -1.273 1.00 0.00 C ATOM 682 C MET C 45 60.357 13.386 -2.036 1.00 0.00 C ATOM 683 O MET C 45 59.304 13.959 -1.836 1.00 0.00 O ATOM 684 CB MET C 45 61.981 12.327 -0.433 1.00 0.00 C ATOM 685 CG MET C 45 61.924 11.433 0.808 1.00 0.00 C ATOM 686 SD MET C 45 62.277 9.721 0.338 1.00 0.00 S ATOM 687 CE MET C 45 60.604 9.273 -0.184 1.00 0.00 C ATOM 0 H MET C 45 61.888 10.459 -1.957 1.00 0.00 H new ATOM 0 HA MET C 45 59.860 11.857 -0.658 1.00 0.00 H new ATOM 0 HB2 MET C 45 62.869 12.095 -1.021 1.00 0.00 H new ATOM 0 HB3 MET C 45 62.059 13.373 -0.138 1.00 0.00 H new ATOM 0 HG2 MET C 45 62.648 11.774 1.548 1.00 0.00 H new ATOM 0 HG3 MET C 45 60.939 11.498 1.271 1.00 0.00 H new ATOM 0 HE1 MET C 45 60.633 8.329 -0.729 1.00 0.00 H new ATOM 0 HE2 MET C 45 59.966 9.166 0.693 1.00 0.00 H new ATOM 0 HE3 MET C 45 60.204 10.053 -0.831 1.00 0.00 H new ATOM 697 N ARG C 46 61.215 13.834 -2.909 1.00 0.00 N ATOM 698 CA ARG C 46 60.909 15.070 -3.683 1.00 0.00 C ATOM 699 C ARG C 46 59.672 14.853 -4.557 1.00 0.00 C ATOM 700 O ARG C 46 58.974 15.785 -4.903 1.00 0.00 O ATOM 701 CB ARG C 46 62.145 15.308 -4.553 1.00 0.00 C ATOM 702 CG ARG C 46 63.162 16.144 -3.774 1.00 0.00 C ATOM 703 CD ARG C 46 64.174 16.755 -4.746 1.00 0.00 C ATOM 704 NE ARG C 46 65.329 17.152 -3.894 1.00 0.00 N ATOM 705 CZ ARG C 46 65.910 18.306 -4.078 1.00 0.00 C ATOM 706 NH1 ARG C 46 66.295 18.660 -5.274 1.00 0.00 N ATOM 707 NH2 ARG C 46 66.109 19.106 -3.066 1.00 0.00 N ATOM 0 H ARG C 46 62.113 13.399 -3.120 1.00 0.00 H new ATOM 0 HA ARG C 46 60.696 15.921 -3.036 1.00 0.00 H new ATOM 0 HB2 ARG C 46 62.588 14.355 -4.844 1.00 0.00 H new ATOM 0 HB3 ARG C 46 61.863 15.822 -5.472 1.00 0.00 H new ATOM 0 HG2 ARG C 46 62.652 16.932 -3.220 1.00 0.00 H new ATOM 0 HG3 ARG C 46 63.676 15.521 -3.042 1.00 0.00 H new ATOM 0 HD2 ARG C 46 64.474 16.036 -5.508 1.00 0.00 H new ATOM 0 HD3 ARG C 46 63.753 17.615 -5.267 1.00 0.00 H new ATOM 0 HE ARG C 46 65.666 16.522 -3.166 1.00 0.00 H new ATOM 0 HH11 ARG C 46 66.142 18.035 -6.065 1.00 0.00 H new ATOM 0 HH12 ARG C 46 66.749 19.562 -5.417 1.00 0.00 H new ATOM 0 HH21 ARG C 46 65.810 18.829 -2.131 1.00 0.00 H new ATOM 0 HH22 ARG C 46 66.563 20.008 -3.210 1.00 0.00 H new ATOM 721 N MET C 47 59.397 13.630 -4.918 1.00 0.00 N ATOM 722 CA MET C 47 58.207 13.354 -5.771 1.00 0.00 C ATOM 723 C MET C 47 56.955 13.182 -4.907 1.00 0.00 C ATOM 724 O MET C 47 55.860 13.518 -5.314 1.00 0.00 O ATOM 725 CB MET C 47 58.545 12.058 -6.506 1.00 0.00 C ATOM 726 CG MET C 47 59.566 12.355 -7.606 1.00 0.00 C ATOM 727 SD MET C 47 60.213 10.800 -8.269 1.00 0.00 S ATOM 728 CE MET C 47 58.696 10.262 -9.092 1.00 0.00 C ATOM 0 H MET C 47 59.945 12.810 -4.659 1.00 0.00 H new ATOM 0 HA MET C 47 57.994 14.170 -6.461 1.00 0.00 H new ATOM 0 HB2 MET C 47 58.948 11.324 -5.808 1.00 0.00 H new ATOM 0 HB3 MET C 47 57.643 11.625 -6.938 1.00 0.00 H new ATOM 0 HG2 MET C 47 59.100 12.935 -8.402 1.00 0.00 H new ATOM 0 HG3 MET C 47 60.381 12.959 -7.207 1.00 0.00 H new ATOM 0 HE1 MET C 47 58.483 9.228 -8.822 1.00 0.00 H new ATOM 0 HE2 MET C 47 57.867 10.897 -8.779 1.00 0.00 H new ATOM 0 HE3 MET C 47 58.822 10.336 -10.172 1.00 0.00 H new ATOM 738 N LEU C 48 57.101 12.666 -3.716 1.00 0.00 N ATOM 739 CA LEU C 48 55.909 12.486 -2.837 1.00 0.00 C ATOM 740 C LEU C 48 55.324 13.854 -2.474 1.00 0.00 C ATOM 741 O LEU C 48 54.249 13.954 -1.918 1.00 0.00 O ATOM 742 CB LEU C 48 56.426 11.781 -1.581 1.00 0.00 C ATOM 743 CG LEU C 48 56.878 10.360 -1.927 1.00 0.00 C ATOM 744 CD1 LEU C 48 57.297 9.637 -0.646 1.00 0.00 C ATOM 745 CD2 LEU C 48 55.725 9.595 -2.579 1.00 0.00 C ATOM 0 H LEU C 48 57.989 12.363 -3.315 1.00 0.00 H new ATOM 0 HA LEU C 48 55.123 11.910 -3.325 1.00 0.00 H new ATOM 0 HB2 LEU C 48 57.258 12.342 -1.155 1.00 0.00 H new ATOM 0 HB3 LEU C 48 55.643 11.748 -0.824 1.00 0.00 H new ATOM 0 HG LEU C 48 57.719 10.408 -2.619 1.00 0.00 H new ATOM 0 HD11 LEU C 48 57.620 8.624 -0.889 1.00 0.00 H new ATOM 0 HD12 LEU C 48 58.119 10.177 -0.176 1.00 0.00 H new ATOM 0 HD13 LEU C 48 56.451 9.594 0.041 1.00 0.00 H new ATOM 0 HD21 LEU C 48 56.051 8.584 -2.824 1.00 0.00 H new ATOM 0 HD22 LEU C 48 54.883 9.547 -1.888 1.00 0.00 H new ATOM 0 HD23 LEU C 48 55.418 10.108 -3.491 1.00 0.00 H new ATOM 757 N GLY C 49 56.029 14.910 -2.784 1.00 0.00 N ATOM 758 CA GLY C 49 55.522 16.271 -2.456 1.00 0.00 C ATOM 759 C GLY C 49 56.225 16.785 -1.199 1.00 0.00 C ATOM 760 O GLY C 49 55.714 17.632 -0.494 1.00 0.00 O ATOM 0 H GLY C 49 56.935 14.887 -3.251 1.00 0.00 H new ATOM 0 HA2 GLY C 49 55.702 16.949 -3.290 1.00 0.00 H new ATOM 0 HA3 GLY C 49 54.444 16.241 -2.297 1.00 0.00 H new ATOM 764 N GLN C 50 57.393 16.277 -0.911 1.00 0.00 N ATOM 765 CA GLN C 50 58.125 16.738 0.304 1.00 0.00 C ATOM 766 C GLN C 50 59.638 16.629 0.093 1.00 0.00 C ATOM 767 O GLN C 50 60.109 16.416 -1.007 1.00 0.00 O ATOM 768 CB GLN C 50 57.671 15.793 1.417 1.00 0.00 C ATOM 769 CG GLN C 50 56.567 16.463 2.235 1.00 0.00 C ATOM 770 CD GLN C 50 55.251 15.711 2.026 1.00 0.00 C ATOM 771 OE1 GLN C 50 54.758 15.621 0.918 1.00 0.00 O ATOM 772 NE2 GLN C 50 54.657 15.163 3.050 1.00 0.00 N ATOM 0 H GLN C 50 57.871 15.565 -1.463 1.00 0.00 H new ATOM 0 HA GLN C 50 57.916 17.782 0.539 1.00 0.00 H new ATOM 0 HB2 GLN C 50 57.306 14.859 0.990 1.00 0.00 H new ATOM 0 HB3 GLN C 50 58.514 15.541 2.061 1.00 0.00 H new ATOM 0 HG2 GLN C 50 56.833 16.465 3.292 1.00 0.00 H new ATOM 0 HG3 GLN C 50 56.456 17.504 1.932 1.00 0.00 H new ATOM 0 HE21 GLN C 50 55.070 15.238 3.980 1.00 0.00 H new ATOM 0 HE22 GLN C 50 53.779 14.659 2.921 1.00 0.00 H new ATOM 781 N ASN C 51 60.401 16.775 1.142 1.00 0.00 N ATOM 782 CA ASN C 51 61.884 16.682 1.010 1.00 0.00 C ATOM 783 C ASN C 51 62.537 16.708 2.394 1.00 0.00 C ATOM 784 O ASN C 51 62.890 17.758 2.894 1.00 0.00 O ATOM 785 CB ASN C 51 62.287 17.916 0.202 1.00 0.00 C ATOM 786 CG ASN C 51 61.636 19.159 0.812 1.00 0.00 C ATOM 787 OD1 ASN C 51 60.570 19.662 0.252 1.00 0.00 O flip ATOM 788 ND2 ASN C 51 62.102 19.675 1.808 1.00 0.00 N flip ATOM 0 H ASN C 51 60.061 16.955 2.087 1.00 0.00 H new ATOM 0 HA ASN C 51 62.201 15.758 0.526 1.00 0.00 H new ATOM 0 HB2 ASN C 51 63.372 18.024 0.200 1.00 0.00 H new ATOM 0 HB3 ASN C 51 61.976 17.802 -0.836 1.00 0.00 H new ATOM 0 HD21 ASN C 51 62.935 19.281 2.244 1.00 0.00 H new ATOM 0 HD22 ASN C 51 61.660 20.503 2.208 1.00 0.00 H new ATOM 795 N PRO C 52 62.674 15.545 2.967 1.00 0.00 N ATOM 796 CA PRO C 52 63.288 15.427 4.312 1.00 0.00 C ATOM 797 C PRO C 52 64.797 15.669 4.234 1.00 0.00 C ATOM 798 O PRO C 52 65.297 16.234 3.281 1.00 0.00 O ATOM 799 CB PRO C 52 62.988 13.986 4.716 1.00 0.00 C ATOM 800 CG PRO C 52 62.805 13.252 3.427 1.00 0.00 C ATOM 801 CD PRO C 52 62.272 14.242 2.425 1.00 0.00 C ATOM 0 HA PRO C 52 62.901 16.154 5.026 1.00 0.00 H new ATOM 0 HB2 PRO C 52 63.805 13.561 5.299 1.00 0.00 H new ATOM 0 HB3 PRO C 52 62.092 13.928 5.334 1.00 0.00 H new ATOM 0 HG2 PRO C 52 63.751 12.830 3.086 1.00 0.00 H new ATOM 0 HG3 PRO C 52 62.112 12.420 3.553 1.00 0.00 H new ATOM 0 HD2 PRO C 52 62.694 14.074 1.434 1.00 0.00 H new ATOM 0 HD3 PRO C 52 61.189 14.167 2.327 1.00 0.00 H new ATOM 809 N THR C 53 65.525 15.247 5.232 1.00 0.00 N ATOM 810 CA THR C 53 67.001 15.454 5.220 1.00 0.00 C ATOM 811 C THR C 53 67.717 14.145 4.879 1.00 0.00 C ATOM 812 O THR C 53 67.215 13.072 5.153 1.00 0.00 O ATOM 813 CB THR C 53 67.349 15.897 6.641 1.00 0.00 C ATOM 814 OG1 THR C 53 66.629 15.101 7.572 1.00 0.00 O ATOM 815 CG2 THR C 53 66.972 17.368 6.825 1.00 0.00 C ATOM 0 H THR C 53 65.161 14.768 6.055 1.00 0.00 H new ATOM 0 HA THR C 53 67.308 16.188 4.475 1.00 0.00 H new ATOM 0 HB THR C 53 68.419 15.775 6.809 1.00 0.00 H new ATOM 0 HG1 THR C 53 66.852 15.382 8.484 1.00 0.00 H new ATOM 0 HG21 THR C 53 67.220 17.683 7.838 1.00 0.00 H new ATOM 0 HG22 THR C 53 67.524 17.977 6.110 1.00 0.00 H new ATOM 0 HG23 THR C 53 65.902 17.493 6.658 1.00 0.00 H new ATOM 823 N PRO C 54 68.877 14.282 4.298 1.00 0.00 N ATOM 824 CA PRO C 54 69.685 13.098 3.919 1.00 0.00 C ATOM 825 C PRO C 54 70.261 12.435 5.171 1.00 0.00 C ATOM 826 O PRO C 54 70.718 11.309 5.139 1.00 0.00 O ATOM 827 CB PRO C 54 70.793 13.684 3.049 1.00 0.00 C ATOM 828 CG PRO C 54 70.907 15.111 3.481 1.00 0.00 C ATOM 829 CD PRO C 54 69.540 15.541 3.942 1.00 0.00 C ATOM 0 HA PRO C 54 69.112 12.329 3.401 1.00 0.00 H new ATOM 0 HB2 PRO C 54 71.733 13.151 3.194 1.00 0.00 H new ATOM 0 HB3 PRO C 54 70.545 13.610 1.990 1.00 0.00 H new ATOM 0 HG2 PRO C 54 71.635 15.214 4.285 1.00 0.00 H new ATOM 0 HG3 PRO C 54 71.251 15.737 2.658 1.00 0.00 H new ATOM 0 HD2 PRO C 54 69.600 16.216 4.795 1.00 0.00 H new ATOM 0 HD3 PRO C 54 69.000 16.068 3.155 1.00 0.00 H new ATOM 837 N GLU C 55 70.239 13.127 6.278 1.00 0.00 N ATOM 838 CA GLU C 55 70.779 12.542 7.537 1.00 0.00 C ATOM 839 C GLU C 55 69.747 11.593 8.150 1.00 0.00 C ATOM 840 O GLU C 55 70.083 10.560 8.694 1.00 0.00 O ATOM 841 CB GLU C 55 71.026 13.740 8.453 1.00 0.00 C ATOM 842 CG GLU C 55 72.521 14.057 8.484 1.00 0.00 C ATOM 843 CD GLU C 55 73.260 12.955 9.247 1.00 0.00 C ATOM 844 OE1 GLU C 55 72.607 12.014 9.667 1.00 0.00 O ATOM 845 OE2 GLU C 55 74.465 13.072 9.397 1.00 0.00 O ATOM 0 H GLU C 55 69.870 14.074 6.364 1.00 0.00 H new ATOM 0 HA GLU C 55 71.689 11.964 7.376 1.00 0.00 H new ATOM 0 HB2 GLU C 55 70.467 14.605 8.097 1.00 0.00 H new ATOM 0 HB3 GLU C 55 70.669 13.522 9.459 1.00 0.00 H new ATOM 0 HG2 GLU C 55 72.909 14.134 7.468 1.00 0.00 H new ATOM 0 HG3 GLU C 55 72.689 15.022 8.963 1.00 0.00 H new ATOM 852 N GLU C 56 68.491 11.934 8.057 1.00 0.00 N ATOM 853 CA GLU C 56 67.433 11.051 8.623 1.00 0.00 C ATOM 854 C GLU C 56 67.065 9.971 7.603 1.00 0.00 C ATOM 855 O GLU C 56 66.534 8.934 7.944 1.00 0.00 O ATOM 856 CB GLU C 56 66.242 11.974 8.884 1.00 0.00 C ATOM 857 CG GLU C 56 65.402 11.416 10.034 1.00 0.00 C ATOM 858 CD GLU C 56 64.139 10.763 9.471 1.00 0.00 C ATOM 859 OE1 GLU C 56 64.267 9.942 8.578 1.00 0.00 O ATOM 860 OE2 GLU C 56 63.063 11.096 9.943 1.00 0.00 O ATOM 0 H GLU C 56 68.152 12.787 7.613 1.00 0.00 H new ATOM 0 HA GLU C 56 67.754 10.542 9.532 1.00 0.00 H new ATOM 0 HB2 GLU C 56 66.593 12.976 9.130 1.00 0.00 H new ATOM 0 HB3 GLU C 56 65.633 12.061 7.984 1.00 0.00 H new ATOM 0 HG2 GLU C 56 65.980 10.686 10.600 1.00 0.00 H new ATOM 0 HG3 GLU C 56 65.134 12.216 10.725 1.00 0.00 H new ATOM 867 N LEU C 57 67.348 10.209 6.352 1.00 0.00 N ATOM 868 CA LEU C 57 67.021 9.198 5.306 1.00 0.00 C ATOM 869 C LEU C 57 67.494 7.811 5.750 1.00 0.00 C ATOM 870 O LEU C 57 66.746 6.854 5.731 1.00 0.00 O ATOM 871 CB LEU C 57 67.791 9.651 4.066 1.00 0.00 C ATOM 872 CG LEU C 57 66.809 10.113 2.988 1.00 0.00 C ATOM 873 CD1 LEU C 57 67.561 10.335 1.676 1.00 0.00 C ATOM 874 CD2 LEU C 57 65.735 9.042 2.783 1.00 0.00 C ATOM 0 H LEU C 57 67.792 11.061 6.008 1.00 0.00 H new ATOM 0 HA LEU C 57 65.950 9.127 5.119 1.00 0.00 H new ATOM 0 HB2 LEU C 57 68.470 10.463 4.325 1.00 0.00 H new ATOM 0 HB3 LEU C 57 68.403 8.832 3.687 1.00 0.00 H new ATOM 0 HG LEU C 57 66.339 11.045 3.301 1.00 0.00 H new ATOM 0 HD11 LEU C 57 66.862 10.664 0.907 1.00 0.00 H new ATOM 0 HD12 LEU C 57 68.327 11.097 1.820 1.00 0.00 H new ATOM 0 HD13 LEU C 57 68.031 9.402 1.364 1.00 0.00 H new ATOM 0 HD21 LEU C 57 65.035 9.371 2.015 1.00 0.00 H new ATOM 0 HD22 LEU C 57 66.206 8.110 2.470 1.00 0.00 H new ATOM 0 HD23 LEU C 57 65.198 8.881 3.718 1.00 0.00 H new ATOM 886 N GLN C 58 68.731 7.701 6.148 1.00 0.00 N ATOM 887 CA GLN C 58 69.262 6.380 6.595 1.00 0.00 C ATOM 888 C GLN C 58 68.220 5.647 7.444 1.00 0.00 C ATOM 889 O GLN C 58 67.954 4.478 7.246 1.00 0.00 O ATOM 890 CB GLN C 58 70.494 6.718 7.434 1.00 0.00 C ATOM 891 CG GLN C 58 71.684 5.882 6.958 1.00 0.00 C ATOM 892 CD GLN C 58 71.550 4.456 7.493 1.00 0.00 C ATOM 893 OE1 GLN C 58 71.828 4.198 8.647 1.00 0.00 O ATOM 894 NE2 GLN C 58 71.134 3.510 6.697 1.00 0.00 N ATOM 0 H GLN C 58 69.400 8.470 6.184 1.00 0.00 H new ATOM 0 HA GLN C 58 69.502 5.726 5.757 1.00 0.00 H new ATOM 0 HB2 GLN C 58 70.725 7.780 7.348 1.00 0.00 H new ATOM 0 HB3 GLN C 58 70.295 6.519 8.487 1.00 0.00 H new ATOM 0 HG2 GLN C 58 71.722 5.871 5.869 1.00 0.00 H new ATOM 0 HG3 GLN C 58 72.617 6.326 7.305 1.00 0.00 H new ATOM 0 HE21 GLN C 58 70.900 3.725 5.728 1.00 0.00 H new ATOM 0 HE22 GLN C 58 71.042 2.555 7.044 1.00 0.00 H new ATOM 903 N GLU C 59 67.628 6.323 8.390 1.00 0.00 N ATOM 904 CA GLU C 59 66.605 5.661 9.250 1.00 0.00 C ATOM 905 C GLU C 59 65.624 4.863 8.386 1.00 0.00 C ATOM 906 O GLU C 59 65.384 3.697 8.624 1.00 0.00 O ATOM 907 CB GLU C 59 65.885 6.804 9.966 1.00 0.00 C ATOM 908 CG GLU C 59 66.064 6.651 11.477 1.00 0.00 C ATOM 909 CD GLU C 59 65.188 7.676 12.201 1.00 0.00 C ATOM 910 OE1 GLU C 59 64.551 8.467 11.524 1.00 0.00 O ATOM 911 OE2 GLU C 59 65.171 7.654 13.421 1.00 0.00 O ATOM 0 H GLU C 59 67.808 7.304 8.605 1.00 0.00 H new ATOM 0 HA GLU C 59 67.051 4.959 9.954 1.00 0.00 H new ATOM 0 HB2 GLU C 59 66.285 7.763 9.637 1.00 0.00 H new ATOM 0 HB3 GLU C 59 64.825 6.796 9.712 1.00 0.00 H new ATOM 0 HG2 GLU C 59 65.792 5.642 11.786 1.00 0.00 H new ATOM 0 HG3 GLU C 59 67.110 6.796 11.747 1.00 0.00 H new ATOM 918 N MET C 60 65.057 5.480 7.385 1.00 0.00 N ATOM 919 CA MET C 60 64.096 4.750 6.511 1.00 0.00 C ATOM 920 C MET C 60 64.664 3.376 6.145 1.00 0.00 C ATOM 921 O MET C 60 63.972 2.378 6.177 1.00 0.00 O ATOM 922 CB MET C 60 63.953 5.622 5.261 1.00 0.00 C ATOM 923 CG MET C 60 62.643 6.413 5.335 1.00 0.00 C ATOM 924 SD MET C 60 63.010 8.171 5.559 1.00 0.00 S ATOM 925 CE MET C 60 62.329 8.749 3.985 1.00 0.00 C ATOM 0 H MET C 60 65.217 6.456 7.135 1.00 0.00 H new ATOM 0 HA MET C 60 63.136 4.581 6.999 1.00 0.00 H new ATOM 0 HB2 MET C 60 64.799 6.305 5.183 1.00 0.00 H new ATOM 0 HB3 MET C 60 63.963 4.999 4.367 1.00 0.00 H new ATOM 0 HG2 MET C 60 62.065 6.265 4.423 1.00 0.00 H new ATOM 0 HG3 MET C 60 62.033 6.050 6.162 1.00 0.00 H new ATOM 0 HE1 MET C 60 62.451 9.830 3.911 1.00 0.00 H new ATOM 0 HE2 MET C 60 62.856 8.267 3.162 1.00 0.00 H new ATOM 0 HE3 MET C 60 61.269 8.499 3.934 1.00 0.00 H new ATOM 935 N ILE C 61 65.920 3.321 5.798 1.00 0.00 N ATOM 936 CA ILE C 61 66.540 2.016 5.429 1.00 0.00 C ATOM 937 C ILE C 61 66.979 1.264 6.689 1.00 0.00 C ATOM 938 O ILE C 61 66.840 0.061 6.786 1.00 0.00 O ATOM 939 CB ILE C 61 67.750 2.393 4.573 1.00 0.00 C ATOM 940 CG1 ILE C 61 67.277 2.765 3.168 1.00 0.00 C ATOM 941 CG2 ILE C 61 68.714 1.207 4.490 1.00 0.00 C ATOM 942 CD1 ILE C 61 66.921 4.252 3.126 1.00 0.00 C ATOM 0 H ILE C 61 66.546 4.125 5.754 1.00 0.00 H new ATOM 0 HA ILE C 61 65.851 1.360 4.898 1.00 0.00 H new ATOM 0 HB ILE C 61 68.264 3.242 5.024 1.00 0.00 H new ATOM 0 HG12 ILE C 61 68.058 2.547 2.440 1.00 0.00 H new ATOM 0 HG13 ILE C 61 66.409 2.165 2.894 1.00 0.00 H new ATOM 0 HG21 ILE C 61 69.575 1.480 3.879 1.00 0.00 H new ATOM 0 HG22 ILE C 61 69.050 0.940 5.492 1.00 0.00 H new ATOM 0 HG23 ILE C 61 68.205 0.355 4.039 1.00 0.00 H new ATOM 0 HD11 ILE C 61 66.584 4.517 2.124 1.00 0.00 H new ATOM 0 HD12 ILE C 61 66.125 4.456 3.843 1.00 0.00 H new ATOM 0 HD13 ILE C 61 67.800 4.844 3.381 1.00 0.00 H new ATOM 954 N ASP C 62 67.509 1.964 7.656 1.00 0.00 N ATOM 955 CA ASP C 62 67.955 1.287 8.907 1.00 0.00 C ATOM 956 C ASP C 62 66.745 0.908 9.765 1.00 0.00 C ATOM 957 O ASP C 62 66.882 0.349 10.836 1.00 0.00 O ATOM 958 CB ASP C 62 68.821 2.322 9.626 1.00 0.00 C ATOM 959 CG ASP C 62 69.067 1.873 11.067 1.00 0.00 C ATOM 960 OD1 ASP C 62 69.530 0.759 11.249 1.00 0.00 O ATOM 961 OD2 ASP C 62 68.790 2.650 11.966 1.00 0.00 O ATOM 0 H ASP C 62 67.652 2.974 7.634 1.00 0.00 H new ATOM 0 HA ASP C 62 68.501 0.365 8.707 1.00 0.00 H new ATOM 0 HB2 ASP C 62 69.771 2.442 9.105 1.00 0.00 H new ATOM 0 HB3 ASP C 62 68.327 3.294 9.616 1.00 0.00 H new ATOM 966 N GLU C 63 65.562 1.211 9.306 1.00 0.00 N ATOM 967 CA GLU C 63 64.345 0.871 10.098 1.00 0.00 C ATOM 968 C GLU C 63 63.981 -0.605 9.912 1.00 0.00 C ATOM 969 O GLU C 63 63.561 -1.272 10.838 1.00 0.00 O ATOM 970 CB GLU C 63 63.243 1.768 9.533 1.00 0.00 C ATOM 971 CG GLU C 63 63.033 2.964 10.462 1.00 0.00 C ATOM 972 CD GLU C 63 61.896 3.835 9.927 1.00 0.00 C ATOM 973 OE1 GLU C 63 62.174 4.714 9.128 1.00 0.00 O ATOM 974 OE2 GLU C 63 60.765 3.605 10.324 1.00 0.00 O ATOM 0 H GLU C 63 65.385 1.679 8.417 1.00 0.00 H new ATOM 0 HA GLU C 63 64.494 1.027 11.166 1.00 0.00 H new ATOM 0 HB2 GLU C 63 63.515 2.112 8.535 1.00 0.00 H new ATOM 0 HB3 GLU C 63 62.316 1.204 9.433 1.00 0.00 H new ATOM 0 HG2 GLU C 63 62.797 2.619 11.469 1.00 0.00 H new ATOM 0 HG3 GLU C 63 63.950 3.548 10.532 1.00 0.00 H new ATOM 981 N VAL C 64 64.135 -1.121 8.723 1.00 0.00 N ATOM 982 CA VAL C 64 63.795 -2.553 8.482 1.00 0.00 C ATOM 983 C VAL C 64 65.067 -3.366 8.220 1.00 0.00 C ATOM 984 O VAL C 64 65.018 -4.562 8.015 1.00 0.00 O ATOM 985 CB VAL C 64 62.904 -2.545 7.240 1.00 0.00 C ATOM 986 CG1 VAL C 64 61.621 -1.767 7.535 1.00 0.00 C ATOM 987 CG2 VAL C 64 63.651 -1.877 6.084 1.00 0.00 C ATOM 0 H VAL C 64 64.481 -0.614 7.909 1.00 0.00 H new ATOM 0 HA VAL C 64 63.299 -3.007 9.340 1.00 0.00 H new ATOM 0 HB VAL C 64 62.651 -3.570 6.968 1.00 0.00 H new ATOM 0 HG11 VAL C 64 60.987 -1.762 6.649 1.00 0.00 H new ATOM 0 HG12 VAL C 64 61.089 -2.242 8.359 1.00 0.00 H new ATOM 0 HG13 VAL C 64 61.872 -0.742 7.808 1.00 0.00 H new ATOM 0 HG21 VAL C 64 63.017 -1.870 5.197 1.00 0.00 H new ATOM 0 HG22 VAL C 64 63.903 -0.853 6.358 1.00 0.00 H new ATOM 0 HG23 VAL C 64 64.565 -2.432 5.873 1.00 0.00 H new ATOM 997 N ASP C 65 66.204 -2.727 8.225 1.00 0.00 N ATOM 998 CA ASP C 65 67.475 -3.468 7.976 1.00 0.00 C ATOM 999 C ASP C 65 67.751 -4.445 9.122 1.00 0.00 C ATOM 1000 O ASP C 65 67.865 -4.056 10.268 1.00 0.00 O ATOM 1001 CB ASP C 65 68.559 -2.392 7.917 1.00 0.00 C ATOM 1002 CG ASP C 65 69.855 -3.002 7.386 1.00 0.00 C ATOM 1003 OD1 ASP C 65 69.789 -3.717 6.398 1.00 0.00 O ATOM 1004 OD2 ASP C 65 70.892 -2.748 7.975 1.00 0.00 O ATOM 0 H ASP C 65 66.309 -1.726 8.390 1.00 0.00 H new ATOM 0 HA ASP C 65 67.436 -4.056 7.059 1.00 0.00 H new ATOM 0 HB2 ASP C 65 68.239 -1.574 7.272 1.00 0.00 H new ATOM 0 HB3 ASP C 65 68.723 -1.971 8.909 1.00 0.00 H new ATOM 1009 N GLU C 66 67.858 -5.710 8.822 1.00 0.00 N ATOM 1010 CA GLU C 66 68.127 -6.712 9.894 1.00 0.00 C ATOM 1011 C GLU C 66 69.498 -7.358 9.683 1.00 0.00 C ATOM 1012 O GLU C 66 69.800 -8.394 10.241 1.00 0.00 O ATOM 1013 CB GLU C 66 67.015 -7.751 9.749 1.00 0.00 C ATOM 1014 CG GLU C 66 66.573 -8.220 11.137 1.00 0.00 C ATOM 1015 CD GLU C 66 65.847 -9.562 11.017 1.00 0.00 C ATOM 1016 OE1 GLU C 66 65.271 -9.810 9.970 1.00 0.00 O ATOM 1017 OE2 GLU C 66 65.880 -10.318 11.973 1.00 0.00 O ATOM 0 H GLU C 66 67.771 -6.094 7.881 1.00 0.00 H new ATOM 0 HA GLU C 66 68.139 -6.263 10.887 1.00 0.00 H new ATOM 0 HB2 GLU C 66 66.169 -7.322 9.212 1.00 0.00 H new ATOM 0 HB3 GLU C 66 67.369 -8.599 9.162 1.00 0.00 H new ATOM 0 HG2 GLU C 66 67.439 -8.321 11.791 1.00 0.00 H new ATOM 0 HG3 GLU C 66 65.915 -7.478 11.591 1.00 0.00 H new ATOM 1024 N ASP C 67 70.332 -6.754 8.881 1.00 0.00 N ATOM 1025 CA ASP C 67 71.684 -7.334 8.635 1.00 0.00 C ATOM 1026 C ASP C 67 72.768 -6.308 8.971 1.00 0.00 C ATOM 1027 O ASP C 67 73.925 -6.642 9.129 1.00 0.00 O ATOM 1028 CB ASP C 67 71.707 -7.670 7.143 1.00 0.00 C ATOM 1029 CG ASP C 67 71.404 -6.410 6.330 1.00 0.00 C ATOM 1030 OD1 ASP C 67 71.855 -5.347 6.728 1.00 0.00 O ATOM 1031 OD2 ASP C 67 70.726 -6.527 5.323 1.00 0.00 O ATOM 0 H ASP C 67 70.136 -5.884 8.385 1.00 0.00 H new ATOM 0 HA ASP C 67 71.875 -8.212 9.253 1.00 0.00 H new ATOM 0 HB2 ASP C 67 72.682 -8.069 6.865 1.00 0.00 H new ATOM 0 HB3 ASP C 67 70.971 -8.443 6.922 1.00 0.00 H new ATOM 1036 N GLY C 68 72.402 -5.060 9.081 1.00 0.00 N ATOM 1037 CA GLY C 68 73.409 -4.014 9.408 1.00 0.00 C ATOM 1038 C GLY C 68 74.212 -3.662 8.155 1.00 0.00 C ATOM 1039 O GLY C 68 75.410 -3.468 8.206 1.00 0.00 O ATOM 0 H GLY C 68 71.448 -4.721 8.958 1.00 0.00 H new ATOM 0 HA2 GLY C 68 72.911 -3.125 9.794 1.00 0.00 H new ATOM 0 HA3 GLY C 68 74.077 -4.371 10.192 1.00 0.00 H new ATOM 1043 N SER C 69 73.561 -3.574 7.028 1.00 0.00 N ATOM 1044 CA SER C 69 74.288 -3.232 5.772 1.00 0.00 C ATOM 1045 C SER C 69 74.064 -1.760 5.421 1.00 0.00 C ATOM 1046 O SER C 69 74.858 -1.146 4.736 1.00 0.00 O ATOM 1047 CB SER C 69 73.680 -4.135 4.702 1.00 0.00 C ATOM 1048 OG SER C 69 72.576 -3.473 4.101 1.00 0.00 O ATOM 0 H SER C 69 72.558 -3.724 6.922 1.00 0.00 H new ATOM 0 HA SER C 69 75.364 -3.379 5.864 1.00 0.00 H new ATOM 0 HB2 SER C 69 74.428 -4.378 3.947 1.00 0.00 H new ATOM 0 HB3 SER C 69 73.357 -5.077 5.145 1.00 0.00 H new ATOM 0 HG SER C 69 72.758 -3.333 3.148 1.00 0.00 H new ATOM 1054 N GLY C 70 72.987 -1.188 5.884 1.00 0.00 N ATOM 1055 CA GLY C 70 72.711 0.243 5.575 1.00 0.00 C ATOM 1056 C GLY C 70 71.840 0.336 4.322 1.00 0.00 C ATOM 1057 O GLY C 70 71.396 1.400 3.940 1.00 0.00 O ATOM 0 H GLY C 70 72.286 -1.650 6.463 1.00 0.00 H new ATOM 0 HA2 GLY C 70 72.207 0.717 6.417 1.00 0.00 H new ATOM 0 HA3 GLY C 70 73.647 0.780 5.421 1.00 0.00 H new ATOM 1061 N THR C 71 71.593 -0.773 3.677 1.00 0.00 N ATOM 1062 CA THR C 71 70.752 -0.747 2.446 1.00 0.00 C ATOM 1063 C THR C 71 69.510 -1.621 2.637 1.00 0.00 C ATOM 1064 O THR C 71 69.373 -2.317 3.623 1.00 0.00 O ATOM 1065 CB THR C 71 71.643 -1.323 1.346 1.00 0.00 C ATOM 1066 OG1 THR C 71 72.157 -2.580 1.766 1.00 0.00 O ATOM 1067 CG2 THR C 71 72.801 -0.363 1.068 1.00 0.00 C ATOM 0 H THR C 71 71.937 -1.694 3.949 1.00 0.00 H new ATOM 0 HA THR C 71 70.403 0.257 2.206 1.00 0.00 H new ATOM 0 HB THR C 71 71.058 -1.454 0.436 1.00 0.00 H new ATOM 0 HG1 THR C 71 72.728 -2.952 1.062 1.00 0.00 H new ATOM 0 HG21 THR C 71 73.435 -0.776 0.283 1.00 0.00 H new ATOM 0 HG22 THR C 71 72.406 0.600 0.746 1.00 0.00 H new ATOM 0 HG23 THR C 71 73.388 -0.229 1.976 1.00 0.00 H new ATOM 1075 N VAL C 72 68.606 -1.591 1.698 1.00 0.00 N ATOM 1076 CA VAL C 72 67.376 -2.420 1.819 1.00 0.00 C ATOM 1077 C VAL C 72 67.269 -3.377 0.630 1.00 0.00 C ATOM 1078 O VAL C 72 67.752 -3.099 -0.449 1.00 0.00 O ATOM 1079 CB VAL C 72 66.220 -1.419 1.811 1.00 0.00 C ATOM 1080 CG1 VAL C 72 64.890 -2.167 1.696 1.00 0.00 C ATOM 1081 CG2 VAL C 72 66.238 -0.615 3.113 1.00 0.00 C ATOM 0 H VAL C 72 68.667 -1.027 0.850 1.00 0.00 H new ATOM 0 HA VAL C 72 67.375 -3.032 2.721 1.00 0.00 H new ATOM 0 HB VAL C 72 66.330 -0.746 0.961 1.00 0.00 H new ATOM 0 HG11 VAL C 72 64.069 -1.450 1.691 1.00 0.00 H new ATOM 0 HG12 VAL C 72 64.875 -2.743 0.771 1.00 0.00 H new ATOM 0 HG13 VAL C 72 64.777 -2.842 2.545 1.00 0.00 H new ATOM 0 HG21 VAL C 72 65.415 0.100 3.111 1.00 0.00 H new ATOM 0 HG22 VAL C 72 66.128 -1.292 3.960 1.00 0.00 H new ATOM 0 HG23 VAL C 72 67.184 -0.079 3.197 1.00 0.00 H new ATOM 1091 N ASP C 73 66.642 -4.504 0.820 1.00 0.00 N ATOM 1092 CA ASP C 73 66.505 -5.478 -0.299 1.00 0.00 C ATOM 1093 C ASP C 73 65.041 -5.893 -0.456 1.00 0.00 C ATOM 1094 O ASP C 73 64.197 -5.539 0.344 1.00 0.00 O ATOM 1095 CB ASP C 73 67.366 -6.674 0.111 1.00 0.00 C ATOM 1096 CG ASP C 73 68.845 -6.320 -0.065 1.00 0.00 C ATOM 1097 OD1 ASP C 73 69.241 -6.053 -1.188 1.00 0.00 O ATOM 1098 OD2 ASP C 73 69.556 -6.321 0.926 1.00 0.00 O ATOM 0 H ASP C 73 66.218 -4.793 1.702 1.00 0.00 H new ATOM 0 HA ASP C 73 66.820 -5.061 -1.255 1.00 0.00 H new ATOM 0 HB2 ASP C 73 67.166 -6.942 1.148 1.00 0.00 H new ATOM 0 HB3 ASP C 73 67.114 -7.543 -0.497 1.00 0.00 H new ATOM 1103 N PHE C 74 64.731 -6.639 -1.479 1.00 0.00 N ATOM 1104 CA PHE C 74 63.319 -7.073 -1.683 1.00 0.00 C ATOM 1105 C PHE C 74 62.771 -7.716 -0.406 1.00 0.00 C ATOM 1106 O PHE C 74 61.577 -7.826 -0.218 1.00 0.00 O ATOM 1107 CB PHE C 74 63.381 -8.097 -2.816 1.00 0.00 C ATOM 1108 CG PHE C 74 61.981 -8.419 -3.282 1.00 0.00 C ATOM 1109 CD1 PHE C 74 61.124 -7.390 -3.692 1.00 0.00 C ATOM 1110 CD2 PHE C 74 61.541 -9.747 -3.306 1.00 0.00 C ATOM 1111 CE1 PHE C 74 59.826 -7.692 -4.126 1.00 0.00 C ATOM 1112 CE2 PHE C 74 60.244 -10.048 -3.738 1.00 0.00 C ATOM 1113 CZ PHE C 74 59.387 -9.020 -4.148 1.00 0.00 C ATOM 0 H PHE C 74 65.393 -6.967 -2.183 1.00 0.00 H new ATOM 0 HA PHE C 74 62.661 -6.238 -1.923 1.00 0.00 H new ATOM 0 HB2 PHE C 74 63.970 -7.703 -3.644 1.00 0.00 H new ATOM 0 HB3 PHE C 74 63.879 -9.004 -2.474 1.00 0.00 H new ATOM 0 HD1 PHE C 74 61.463 -6.365 -3.674 1.00 0.00 H new ATOM 0 HD2 PHE C 74 62.203 -10.540 -2.991 1.00 0.00 H new ATOM 0 HE1 PHE C 74 59.165 -6.899 -4.443 1.00 0.00 H new ATOM 0 HE2 PHE C 74 59.905 -11.073 -3.755 1.00 0.00 H new ATOM 0 HZ PHE C 74 58.386 -9.252 -4.481 1.00 0.00 H new ATOM 1123 N ASP C 75 63.636 -8.143 0.475 1.00 0.00 N ATOM 1124 CA ASP C 75 63.162 -8.781 1.736 1.00 0.00 C ATOM 1125 C ASP C 75 62.879 -7.714 2.797 1.00 0.00 C ATOM 1126 O ASP C 75 61.805 -7.656 3.363 1.00 0.00 O ATOM 1127 CB ASP C 75 64.311 -9.687 2.176 1.00 0.00 C ATOM 1128 CG ASP C 75 64.784 -10.523 0.985 1.00 0.00 C ATOM 1129 OD1 ASP C 75 65.349 -9.947 0.070 1.00 0.00 O ATOM 1130 OD2 ASP C 75 64.572 -11.725 1.008 1.00 0.00 O ATOM 0 H ASP C 75 64.649 -8.077 0.376 1.00 0.00 H new ATOM 0 HA ASP C 75 62.236 -9.338 1.595 1.00 0.00 H new ATOM 0 HB2 ASP C 75 65.134 -9.087 2.563 1.00 0.00 H new ATOM 0 HB3 ASP C 75 63.985 -10.340 2.986 1.00 0.00 H new ATOM 1135 N GLU C 76 63.834 -6.868 3.071 1.00 0.00 N ATOM 1136 CA GLU C 76 63.617 -5.807 4.096 1.00 0.00 C ATOM 1137 C GLU C 76 62.565 -4.807 3.605 1.00 0.00 C ATOM 1138 O GLU C 76 61.800 -4.268 4.380 1.00 0.00 O ATOM 1139 CB GLU C 76 64.977 -5.126 4.256 1.00 0.00 C ATOM 1140 CG GLU C 76 66.013 -6.156 4.711 1.00 0.00 C ATOM 1141 CD GLU C 76 67.323 -5.933 3.954 1.00 0.00 C ATOM 1142 OE1 GLU C 76 67.349 -5.065 3.097 1.00 0.00 O ATOM 1143 OE2 GLU C 76 68.278 -6.633 4.244 1.00 0.00 O ATOM 0 H GLU C 76 64.754 -6.865 2.630 1.00 0.00 H new ATOM 0 HA GLU C 76 63.253 -6.211 5.041 1.00 0.00 H new ATOM 0 HB2 GLU C 76 65.285 -4.678 3.311 1.00 0.00 H new ATOM 0 HB3 GLU C 76 64.908 -4.318 4.984 1.00 0.00 H new ATOM 0 HG2 GLU C 76 66.182 -6.068 5.784 1.00 0.00 H new ATOM 0 HG3 GLU C 76 65.643 -7.165 4.528 1.00 0.00 H new ATOM 1150 N PHE C 77 62.520 -4.555 2.325 1.00 0.00 N ATOM 1151 CA PHE C 77 61.515 -3.590 1.792 1.00 0.00 C ATOM 1152 C PHE C 77 60.097 -4.067 2.118 1.00 0.00 C ATOM 1153 O PHE C 77 59.267 -3.306 2.575 1.00 0.00 O ATOM 1154 CB PHE C 77 61.740 -3.574 0.279 1.00 0.00 C ATOM 1155 CG PHE C 77 60.617 -2.814 -0.386 1.00 0.00 C ATOM 1156 CD1 PHE C 77 60.511 -1.428 -0.211 1.00 0.00 C ATOM 1157 CD2 PHE C 77 59.681 -3.494 -1.174 1.00 0.00 C ATOM 1158 CE1 PHE C 77 59.469 -0.723 -0.826 1.00 0.00 C ATOM 1159 CE2 PHE C 77 58.639 -2.788 -1.788 1.00 0.00 C ATOM 1160 CZ PHE C 77 58.533 -1.403 -1.614 1.00 0.00 C ATOM 0 H PHE C 77 63.134 -4.974 1.626 1.00 0.00 H new ATOM 0 HA PHE C 77 61.625 -2.598 2.230 1.00 0.00 H new ATOM 0 HB2 PHE C 77 62.697 -3.107 0.047 1.00 0.00 H new ATOM 0 HB3 PHE C 77 61.781 -4.593 -0.105 1.00 0.00 H new ATOM 0 HD1 PHE C 77 61.233 -0.904 0.398 1.00 0.00 H new ATOM 0 HD2 PHE C 77 59.762 -4.563 -1.308 1.00 0.00 H new ATOM 0 HE1 PHE C 77 59.388 0.346 -0.692 1.00 0.00 H new ATOM 0 HE2 PHE C 77 57.917 -3.312 -2.396 1.00 0.00 H new ATOM 0 HZ PHE C 77 57.729 -0.859 -2.088 1.00 0.00 H new ATOM 1170 N LEU C 78 59.812 -5.320 1.889 1.00 0.00 N ATOM 1171 CA LEU C 78 58.448 -5.840 2.189 1.00 0.00 C ATOM 1172 C LEU C 78 58.104 -5.594 3.660 1.00 0.00 C ATOM 1173 O LEU C 78 57.016 -5.163 3.989 1.00 0.00 O ATOM 1174 CB LEU C 78 58.519 -7.339 1.898 1.00 0.00 C ATOM 1175 CG LEU C 78 58.247 -7.585 0.413 1.00 0.00 C ATOM 1176 CD1 LEU C 78 58.664 -9.011 0.049 1.00 0.00 C ATOM 1177 CD2 LEU C 78 56.754 -7.404 0.131 1.00 0.00 C ATOM 0 H LEU C 78 60.464 -6.005 1.508 1.00 0.00 H new ATOM 0 HA LEU C 78 57.678 -5.348 1.594 1.00 0.00 H new ATOM 0 HB2 LEU C 78 59.502 -7.726 2.167 1.00 0.00 H new ATOM 0 HB3 LEU C 78 57.788 -7.873 2.506 1.00 0.00 H new ATOM 0 HG LEU C 78 58.819 -6.874 -0.184 1.00 0.00 H new ATOM 0 HD11 LEU C 78 58.471 -9.188 -1.009 1.00 0.00 H new ATOM 0 HD12 LEU C 78 59.727 -9.142 0.250 1.00 0.00 H new ATOM 0 HD13 LEU C 78 58.092 -9.721 0.646 1.00 0.00 H new ATOM 0 HD21 LEU C 78 56.560 -7.579 -0.927 1.00 0.00 H new ATOM 0 HD22 LEU C 78 56.182 -8.115 0.727 1.00 0.00 H new ATOM 0 HD23 LEU C 78 56.455 -6.389 0.392 1.00 0.00 H new ATOM 1189 N VAL C 79 59.023 -5.861 4.547 1.00 0.00 N ATOM 1190 CA VAL C 79 58.748 -5.640 5.996 1.00 0.00 C ATOM 1191 C VAL C 79 58.378 -4.174 6.246 1.00 0.00 C ATOM 1192 O VAL C 79 57.597 -3.862 7.123 1.00 0.00 O ATOM 1193 CB VAL C 79 60.056 -5.991 6.706 1.00 0.00 C ATOM 1194 CG1 VAL C 79 59.830 -6.008 8.219 1.00 0.00 C ATOM 1195 CG2 VAL C 79 60.531 -7.373 6.248 1.00 0.00 C ATOM 0 H VAL C 79 59.952 -6.222 4.332 1.00 0.00 H new ATOM 0 HA VAL C 79 57.915 -6.244 6.355 1.00 0.00 H new ATOM 0 HB VAL C 79 60.812 -5.245 6.460 1.00 0.00 H new ATOM 0 HG11 VAL C 79 60.763 -6.258 8.723 1.00 0.00 H new ATOM 0 HG12 VAL C 79 59.492 -5.025 8.547 1.00 0.00 H new ATOM 0 HG13 VAL C 79 59.073 -6.753 8.465 1.00 0.00 H new ATOM 0 HG21 VAL C 79 61.463 -7.623 6.754 1.00 0.00 H new ATOM 0 HG22 VAL C 79 59.774 -8.118 6.493 1.00 0.00 H new ATOM 0 HG23 VAL C 79 60.694 -7.363 5.170 1.00 0.00 H new ATOM 1205 N MET C 80 58.933 -3.273 5.481 1.00 0.00 N ATOM 1206 CA MET C 80 58.612 -1.830 5.676 1.00 0.00 C ATOM 1207 C MET C 80 57.117 -1.583 5.450 1.00 0.00 C ATOM 1208 O MET C 80 56.540 -0.667 6.001 1.00 0.00 O ATOM 1209 CB MET C 80 59.443 -1.094 4.624 1.00 0.00 C ATOM 1210 CG MET C 80 60.131 0.111 5.267 1.00 0.00 C ATOM 1211 SD MET C 80 59.525 1.634 4.499 1.00 0.00 S ATOM 1212 CE MET C 80 60.281 1.381 2.874 1.00 0.00 C ATOM 0 H MET C 80 59.594 -3.473 4.730 1.00 0.00 H new ATOM 0 HA MET C 80 58.839 -1.490 6.686 1.00 0.00 H new ATOM 0 HB2 MET C 80 60.188 -1.766 4.198 1.00 0.00 H new ATOM 0 HB3 MET C 80 58.803 -0.766 3.804 1.00 0.00 H new ATOM 0 HG2 MET C 80 59.932 0.128 6.339 1.00 0.00 H new ATOM 0 HG3 MET C 80 61.211 0.034 5.144 1.00 0.00 H new ATOM 0 HE1 MET C 80 60.443 2.346 2.394 1.00 0.00 H new ATOM 0 HE2 MET C 80 61.236 0.870 2.993 1.00 0.00 H new ATOM 0 HE3 MET C 80 59.619 0.775 2.255 1.00 0.00 H new ATOM 1222 N MET C 81 56.490 -2.395 4.644 1.00 0.00 N ATOM 1223 CA MET C 81 55.033 -2.209 4.384 1.00 0.00 C ATOM 1224 C MET C 81 54.212 -3.006 5.400 1.00 0.00 C ATOM 1225 O MET C 81 53.248 -2.518 5.956 1.00 0.00 O ATOM 1226 CB MET C 81 54.810 -2.752 2.973 1.00 0.00 C ATOM 1227 CG MET C 81 55.001 -1.627 1.955 1.00 0.00 C ATOM 1228 SD MET C 81 56.697 -1.004 2.056 1.00 0.00 S ATOM 1229 CE MET C 81 56.463 0.462 1.021 1.00 0.00 C ATOM 0 H MET C 81 56.922 -3.179 4.154 1.00 0.00 H new ATOM 0 HA MET C 81 54.727 -1.167 4.473 1.00 0.00 H new ATOM 0 HB2 MET C 81 55.509 -3.563 2.770 1.00 0.00 H new ATOM 0 HB3 MET C 81 53.806 -3.168 2.887 1.00 0.00 H new ATOM 0 HG2 MET C 81 54.796 -1.994 0.949 1.00 0.00 H new ATOM 0 HG3 MET C 81 54.294 -0.821 2.151 1.00 0.00 H new ATOM 0 HE1 MET C 81 57.403 1.008 0.945 1.00 0.00 H new ATOM 0 HE2 MET C 81 56.139 0.157 0.026 1.00 0.00 H new ATOM 0 HE3 MET C 81 55.705 1.106 1.468 1.00 0.00 H new ATOM 1239 N VAL C 82 54.589 -4.230 5.647 1.00 0.00 N ATOM 1240 CA VAL C 82 53.832 -5.058 6.629 1.00 0.00 C ATOM 1241 C VAL C 82 53.540 -4.240 7.888 1.00 0.00 C ATOM 1242 O VAL C 82 52.464 -4.306 8.448 1.00 0.00 O ATOM 1243 CB VAL C 82 54.756 -6.231 6.957 1.00 0.00 C ATOM 1244 CG1 VAL C 82 53.996 -7.260 7.796 1.00 0.00 C ATOM 1245 CG2 VAL C 82 55.231 -6.884 5.658 1.00 0.00 C ATOM 0 H VAL C 82 55.387 -4.693 5.212 1.00 0.00 H new ATOM 0 HA VAL C 82 52.873 -5.394 6.234 1.00 0.00 H new ATOM 0 HB VAL C 82 55.617 -5.869 7.518 1.00 0.00 H new ATOM 0 HG11 VAL C 82 54.655 -8.096 8.030 1.00 0.00 H new ATOM 0 HG12 VAL C 82 53.657 -6.795 8.722 1.00 0.00 H new ATOM 0 HG13 VAL C 82 53.135 -7.622 7.235 1.00 0.00 H new ATOM 0 HG21 VAL C 82 55.890 -7.720 5.891 1.00 0.00 H new ATOM 0 HG22 VAL C 82 54.370 -7.246 5.097 1.00 0.00 H new ATOM 0 HG23 VAL C 82 55.772 -6.151 5.059 1.00 0.00 H new ATOM 1255 N ARG C 83 54.492 -3.469 8.336 1.00 0.00 N ATOM 1256 CA ARG C 83 54.271 -2.645 9.559 1.00 0.00 C ATOM 1257 C ARG C 83 53.040 -1.753 9.380 1.00 0.00 C ATOM 1258 O ARG C 83 52.295 -1.513 10.308 1.00 0.00 O ATOM 1259 CB ARG C 83 55.536 -1.796 9.700 1.00 0.00 C ATOM 1260 CG ARG C 83 56.569 -2.547 10.541 1.00 0.00 C ATOM 1261 CD ARG C 83 57.884 -1.764 10.552 1.00 0.00 C ATOM 1262 NE ARG C 83 57.574 -0.501 11.277 1.00 0.00 N ATOM 1263 CZ ARG C 83 58.514 0.383 11.481 1.00 0.00 C ATOM 1264 NH1 ARG C 83 59.486 0.121 12.310 1.00 0.00 N ATOM 1265 NH2 ARG C 83 58.481 1.527 10.854 1.00 0.00 N ATOM 0 H ARG C 83 55.413 -3.374 7.909 1.00 0.00 H new ATOM 0 HA ARG C 83 54.092 -3.257 10.443 1.00 0.00 H new ATOM 0 HB2 ARG C 83 55.947 -1.572 8.716 1.00 0.00 H new ATOM 0 HB3 ARG C 83 55.295 -0.842 10.169 1.00 0.00 H new ATOM 0 HG2 ARG C 83 56.201 -2.675 11.559 1.00 0.00 H new ATOM 0 HG3 ARG C 83 56.731 -3.545 10.132 1.00 0.00 H new ATOM 0 HD2 ARG C 83 58.673 -2.324 11.054 1.00 0.00 H new ATOM 0 HD3 ARG C 83 58.232 -1.562 9.539 1.00 0.00 H new ATOM 0 HE ARG C 83 56.627 -0.326 11.614 1.00 0.00 H new ATOM 0 HH11 ARG C 83 59.512 -0.774 12.799 1.00 0.00 H new ATOM 0 HH12 ARG C 83 60.220 0.811 12.470 1.00 0.00 H new ATOM 0 HH21 ARG C 83 57.721 1.731 10.205 1.00 0.00 H new ATOM 0 HH22 ARG C 83 59.215 2.217 11.013 1.00 0.00 H new ATOM 1279 N CYS C 84 52.821 -1.262 8.191 1.00 0.00 N ATOM 1280 CA CYS C 84 51.637 -0.388 7.953 1.00 0.00 C ATOM 1281 C CYS C 84 50.831 -0.906 6.761 1.00 0.00 C ATOM 1282 O CYS C 84 50.164 -0.156 6.075 1.00 0.00 O ATOM 1283 CB CYS C 84 52.221 0.991 7.646 1.00 0.00 C ATOM 1284 SG CYS C 84 53.398 0.856 6.277 1.00 0.00 S ATOM 0 H CYS C 84 53.410 -1.428 7.375 1.00 0.00 H new ATOM 0 HA CYS C 84 50.961 -0.364 8.808 1.00 0.00 H new ATOM 0 HB2 CYS C 84 51.423 1.686 7.386 1.00 0.00 H new ATOM 0 HB3 CYS C 84 52.718 1.392 8.529 1.00 0.00 H new ATOM 0 HG CYS C 84 54.442 0.186 6.667 1.00 0.00 H new ATOM 1290 N MET C 85 50.886 -2.184 6.507 1.00 0.00 N ATOM 1291 CA MET C 85 50.124 -2.749 5.356 1.00 0.00 C ATOM 1292 C MET C 85 48.638 -2.865 5.707 1.00 0.00 C ATOM 1293 O MET C 85 48.271 -3.029 6.854 1.00 0.00 O ATOM 1294 CB MET C 85 50.732 -4.133 5.119 1.00 0.00 C ATOM 1295 CG MET C 85 50.242 -5.103 6.197 1.00 0.00 C ATOM 1296 SD MET C 85 49.003 -6.216 5.486 1.00 0.00 S ATOM 1297 CE MET C 85 50.125 -7.580 5.091 1.00 0.00 C ATOM 0 H MET C 85 51.425 -2.862 7.046 1.00 0.00 H new ATOM 0 HA MET C 85 50.189 -2.119 4.469 1.00 0.00 H new ATOM 0 HB2 MET C 85 50.452 -4.500 4.132 1.00 0.00 H new ATOM 0 HB3 MET C 85 51.820 -4.071 5.139 1.00 0.00 H new ATOM 0 HG2 MET C 85 51.079 -5.678 6.592 1.00 0.00 H new ATOM 0 HG3 MET C 85 49.813 -4.549 7.032 1.00 0.00 H new ATOM 0 HE1 MET C 85 49.562 -8.393 4.633 1.00 0.00 H new ATOM 0 HE2 MET C 85 50.890 -7.232 4.397 1.00 0.00 H new ATOM 0 HE3 MET C 85 50.600 -7.937 6.005 1.00 0.00 H new ATOM 1307 N LYS C 86 47.781 -2.783 4.728 1.00 0.00 N ATOM 1308 CA LYS C 86 46.320 -2.892 5.002 1.00 0.00 C ATOM 1309 C LYS C 86 45.739 -4.105 4.270 1.00 0.00 C ATOM 1310 O LYS C 86 46.253 -4.530 3.255 1.00 0.00 O ATOM 1311 CB LYS C 86 45.718 -1.595 4.458 1.00 0.00 C ATOM 1312 CG LYS C 86 45.922 -1.534 2.944 1.00 0.00 C ATOM 1313 CD LYS C 86 46.687 -0.258 2.581 1.00 0.00 C ATOM 1314 CE LYS C 86 48.024 -0.631 1.935 1.00 0.00 C ATOM 1315 NZ LYS C 86 49.064 -0.181 2.903 1.00 0.00 N ATOM 0 H LYS C 86 48.029 -2.645 3.748 1.00 0.00 H new ATOM 0 HA LYS C 86 46.104 -3.026 6.062 1.00 0.00 H new ATOM 0 HB2 LYS C 86 44.655 -1.548 4.695 1.00 0.00 H new ATOM 0 HB3 LYS C 86 46.189 -0.735 4.934 1.00 0.00 H new ATOM 0 HG2 LYS C 86 46.475 -2.410 2.606 1.00 0.00 H new ATOM 0 HG3 LYS C 86 44.958 -1.549 2.436 1.00 0.00 H new ATOM 0 HD2 LYS C 86 46.097 0.350 1.895 1.00 0.00 H new ATOM 0 HD3 LYS C 86 46.858 0.343 3.474 1.00 0.00 H new ATOM 0 HE2 LYS C 86 48.090 -1.704 1.757 1.00 0.00 H new ATOM 0 HE3 LYS C 86 48.146 -0.140 0.970 1.00 0.00 H new ATOM 0 HZ1 LYS C 86 49.992 -0.551 2.613 1.00 0.00 H new ATOM 0 HZ2 LYS C 86 49.096 0.858 2.920 1.00 0.00 H new ATOM 0 HZ3 LYS C 86 48.831 -0.536 3.852 1.00 0.00 H new ATOM 1329 N ASP C 87 44.677 -4.668 4.777 1.00 0.00 N ATOM 1330 CA ASP C 87 44.077 -5.855 4.103 1.00 0.00 C ATOM 1331 C ASP C 87 42.716 -6.192 4.720 1.00 0.00 C ATOM 1332 O ASP C 87 42.566 -7.181 5.410 1.00 0.00 O ATOM 1333 CB ASP C 87 45.071 -6.989 4.354 1.00 0.00 C ATOM 1334 CG ASP C 87 45.050 -7.960 3.174 1.00 0.00 C ATOM 1335 OD1 ASP C 87 44.114 -7.894 2.394 1.00 0.00 O ATOM 1336 OD2 ASP C 87 45.970 -8.754 3.069 1.00 0.00 O ATOM 0 H ASP C 87 44.200 -4.360 5.624 1.00 0.00 H new ATOM 0 HA ASP C 87 43.906 -5.682 3.040 1.00 0.00 H new ATOM 0 HB2 ASP C 87 46.074 -6.584 4.487 1.00 0.00 H new ATOM 0 HB3 ASP C 87 44.815 -7.514 5.274 1.00 0.00 H new ATOM 1341 N ASP C 88 41.723 -5.383 4.474 1.00 0.00 N ATOM 1342 CA ASP C 88 40.375 -5.666 5.047 1.00 0.00 C ATOM 1343 C ASP C 88 39.408 -6.091 3.938 1.00 0.00 C ATOM 1344 O ASP C 88 38.404 -6.727 4.188 1.00 0.00 O ATOM 1345 CB ASP C 88 39.924 -4.348 5.678 1.00 0.00 C ATOM 1346 CG ASP C 88 39.488 -4.599 7.123 1.00 0.00 C ATOM 1347 OD1 ASP C 88 38.980 -5.676 7.389 1.00 0.00 O ATOM 1348 OD2 ASP C 88 39.668 -3.709 7.938 1.00 0.00 O ATOM 0 H ASP C 88 41.785 -4.540 3.903 1.00 0.00 H new ATOM 0 HA ASP C 88 40.399 -6.477 5.775 1.00 0.00 H new ATOM 0 HB2 ASP C 88 40.737 -3.623 5.653 1.00 0.00 H new ATOM 0 HB3 ASP C 88 39.099 -3.922 5.107 1.00 0.00 H new ATOM 1353 N SER C 89 39.705 -5.746 2.715 1.00 0.00 N ATOM 1354 CA SER C 89 38.803 -6.131 1.591 1.00 0.00 C ATOM 1355 C SER C 89 38.691 -7.656 1.504 1.00 0.00 C ATOM 1356 O SER C 89 37.896 -8.215 2.242 1.00 0.00 O ATOM 1357 CB SER C 89 39.470 -5.571 0.335 1.00 0.00 C ATOM 1358 OG SER C 89 39.076 -6.345 -0.790 1.00 0.00 O ATOM 1359 OXT SER C 89 39.401 -8.238 0.702 1.00 0.00 O ATOM 0 H SER C 89 40.533 -5.214 2.445 1.00 0.00 H new ATOM 0 HA SER C 89 37.793 -5.744 1.722 1.00 0.00 H new ATOM 0 HB2 SER C 89 39.185 -4.529 0.192 1.00 0.00 H new ATOM 0 HB3 SER C 89 40.554 -5.593 0.444 1.00 0.00 H new ATOM 0 HG SER C 89 39.474 -7.238 -0.728 1.00 0.00 H new TER 1365 SER C 89 ATOM 1366 N ARG I 1 59.542 6.033 7.915 1.00 0.00 N ATOM 1367 CA ARG I 1 58.707 7.267 8.000 1.00 0.00 C ATOM 1368 C ARG I 1 58.371 7.778 6.596 1.00 0.00 C ATOM 1369 O ARG I 1 59.090 8.574 6.027 1.00 0.00 O ATOM 1370 CB ARG I 1 59.575 8.282 8.745 1.00 0.00 C ATOM 1371 CG ARG I 1 59.877 7.759 10.150 1.00 0.00 C ATOM 1372 CD ARG I 1 59.649 8.874 11.171 1.00 0.00 C ATOM 1373 NE ARG I 1 59.453 8.171 12.469 1.00 0.00 N ATOM 1374 CZ ARG I 1 59.184 8.854 13.547 1.00 0.00 C ATOM 1375 NH1 ARG I 1 58.330 9.840 13.498 1.00 0.00 N ATOM 1376 NH2 ARG I 1 59.769 8.550 14.673 1.00 0.00 N ATOM 0 H1 ARG I 1 59.404 5.461 8.772 1.00 0.00 H new ATOM 0 H2 ARG I 1 59.260 5.480 7.081 1.00 0.00 H new ATOM 0 H3 ARG I 1 60.545 6.297 7.833 1.00 0.00 H new ATOM 0 HA ARG I 1 57.759 7.089 8.508 1.00 0.00 H new ATOM 0 HB2 ARG I 1 60.504 8.451 8.201 1.00 0.00 H new ATOM 0 HB3 ARG I 1 59.061 9.242 8.805 1.00 0.00 H new ATOM 0 HG2 ARG I 1 59.236 6.907 10.378 1.00 0.00 H new ATOM 0 HG3 ARG I 1 60.907 7.407 10.205 1.00 0.00 H new ATOM 0 HD2 ARG I 1 60.502 9.551 11.213 1.00 0.00 H new ATOM 0 HD3 ARG I 1 58.777 9.475 10.912 1.00 0.00 H new ATOM 0 HE ARG I 1 59.529 7.155 12.515 1.00 0.00 H new ATOM 0 HH11 ARG I 1 57.873 10.076 12.617 1.00 0.00 H new ATOM 0 HH12 ARG I 1 58.119 10.374 14.341 1.00 0.00 H new ATOM 0 HH21 ARG I 1 60.436 7.779 14.709 1.00 0.00 H new ATOM 0 HH22 ARG I 1 59.560 9.083 15.517 1.00 0.00 H new ATOM 1392 N ILE I 2 57.281 7.328 6.036 1.00 0.00 N ATOM 1393 CA ILE I 2 56.898 7.791 4.671 1.00 0.00 C ATOM 1394 C ILE I 2 55.441 7.424 4.377 1.00 0.00 C ATOM 1395 O ILE I 2 55.049 7.260 3.239 1.00 0.00 O ATOM 1396 CB ILE I 2 57.840 7.052 3.721 1.00 0.00 C ATOM 1397 CG1 ILE I 2 57.746 7.674 2.325 1.00 0.00 C ATOM 1398 CG2 ILE I 2 57.442 5.577 3.647 1.00 0.00 C ATOM 1399 CD1 ILE I 2 58.472 6.782 1.318 1.00 0.00 C ATOM 0 H ILE I 2 56.640 6.660 6.464 1.00 0.00 H new ATOM 0 HA ILE I 2 56.980 8.873 4.565 1.00 0.00 H new ATOM 0 HB ILE I 2 58.862 7.133 4.090 1.00 0.00 H new ATOM 0 HG12 ILE I 2 56.701 7.790 2.037 1.00 0.00 H new ATOM 0 HG13 ILE I 2 58.188 8.670 2.329 1.00 0.00 H new ATOM 0 HG21 ILE I 2 58.115 5.052 2.969 1.00 0.00 H new ATOM 0 HG22 ILE I 2 57.508 5.132 4.640 1.00 0.00 H new ATOM 0 HG23 ILE I 2 56.419 5.494 3.279 1.00 0.00 H new ATOM 0 HD11 ILE I 2 58.405 7.225 0.324 1.00 0.00 H new ATOM 0 HD12 ILE I 2 59.520 6.689 1.604 1.00 0.00 H new ATOM 0 HD13 ILE I 2 58.010 5.795 1.307 1.00 0.00 H new ATOM 1411 N SER I 3 54.636 7.293 5.396 1.00 0.00 N ATOM 1412 CA SER I 3 53.204 6.938 5.174 1.00 0.00 C ATOM 1413 C SER I 3 53.101 5.646 4.359 1.00 0.00 C ATOM 1414 O SER I 3 54.012 4.842 4.335 1.00 0.00 O ATOM 1415 CB SER I 3 52.622 8.114 4.391 1.00 0.00 C ATOM 1416 OG SER I 3 51.452 8.584 5.050 1.00 0.00 O ATOM 0 H SER I 3 54.907 7.416 6.372 1.00 0.00 H new ATOM 0 HA SER I 3 52.670 6.767 6.109 1.00 0.00 H new ATOM 0 HB2 SER I 3 53.357 8.915 4.315 1.00 0.00 H new ATOM 0 HB3 SER I 3 52.381 7.805 3.374 1.00 0.00 H new ATOM 0 HG SER I 3 51.077 9.340 4.551 1.00 0.00 H new ATOM 1422 N ALA I 4 52.001 5.441 3.690 1.00 0.00 N ATOM 1423 CA ALA I 4 51.842 4.201 2.877 1.00 0.00 C ATOM 1424 C ALA I 4 51.007 4.494 1.628 1.00 0.00 C ATOM 1425 O ALA I 4 51.384 4.154 0.523 1.00 0.00 O ATOM 1426 CB ALA I 4 51.111 3.218 3.793 1.00 0.00 C ATOM 0 H ALA I 4 51.205 6.078 3.670 1.00 0.00 H new ATOM 0 HA ALA I 4 52.798 3.804 2.535 1.00 0.00 H new ATOM 0 HB1 ALA I 4 50.955 2.277 3.266 1.00 0.00 H new ATOM 0 HB2 ALA I 4 51.709 3.039 4.686 1.00 0.00 H new ATOM 0 HB3 ALA I 4 50.147 3.637 4.080 1.00 0.00 H new ATOM 1432 N ASP I 5 49.877 5.122 1.793 1.00 0.00 N ATOM 1433 CA ASP I 5 49.021 5.438 0.614 1.00 0.00 C ATOM 1434 C ASP I 5 49.628 6.596 -0.184 1.00 0.00 C ATOM 1435 O ASP I 5 49.729 6.542 -1.394 1.00 0.00 O ATOM 1436 CB ASP I 5 47.669 5.840 1.205 1.00 0.00 C ATOM 1437 CG ASP I 5 46.544 5.261 0.343 1.00 0.00 C ATOM 1438 OD1 ASP I 5 46.582 5.464 -0.860 1.00 0.00 O ATOM 1439 OD2 ASP I 5 45.665 4.625 0.900 1.00 0.00 O ATOM 0 H ASP I 5 49.508 5.431 2.693 1.00 0.00 H new ATOM 0 HA ASP I 5 48.931 4.595 -0.071 1.00 0.00 H new ATOM 0 HB2 ASP I 5 47.584 5.473 2.228 1.00 0.00 H new ATOM 0 HB3 ASP I 5 47.587 6.926 1.248 1.00 0.00 H new ATOM 1444 N ALA I 6 50.036 7.641 0.484 1.00 0.00 N ATOM 1445 CA ALA I 6 50.637 8.800 -0.239 1.00 0.00 C ATOM 1446 C ALA I 6 51.841 8.340 -1.065 1.00 0.00 C ATOM 1447 O ALA I 6 52.173 8.927 -2.075 1.00 0.00 O ATOM 1448 CB ALA I 6 51.081 9.765 0.861 1.00 0.00 C ATOM 0 H ALA I 6 49.980 7.743 1.497 1.00 0.00 H new ATOM 0 HA ALA I 6 49.935 9.265 -0.931 1.00 0.00 H new ATOM 0 HB1 ALA I 6 51.535 10.647 0.410 1.00 0.00 H new ATOM 0 HB2 ALA I 6 50.216 10.065 1.453 1.00 0.00 H new ATOM 0 HB3 ALA I 6 51.809 9.272 1.506 1.00 0.00 H new ATOM 1454 N MET I 7 52.496 7.293 -0.643 1.00 0.00 N ATOM 1455 CA MET I 7 53.678 6.796 -1.406 1.00 0.00 C ATOM 1456 C MET I 7 53.251 6.353 -2.807 1.00 0.00 C ATOM 1457 O MET I 7 53.945 6.580 -3.779 1.00 0.00 O ATOM 1458 CB MET I 7 54.197 5.606 -0.599 1.00 0.00 C ATOM 1459 CG MET I 7 55.711 5.484 -0.784 1.00 0.00 C ATOM 1460 SD MET I 7 56.100 3.881 -1.532 1.00 0.00 S ATOM 1461 CE MET I 7 57.225 4.495 -2.809 1.00 0.00 C ATOM 0 H MET I 7 52.265 6.760 0.196 1.00 0.00 H new ATOM 0 HA MET I 7 54.442 7.563 -1.535 1.00 0.00 H new ATOM 0 HB2 MET I 7 53.959 5.737 0.456 1.00 0.00 H new ATOM 0 HB3 MET I 7 53.705 4.690 -0.925 1.00 0.00 H new ATOM 0 HG2 MET I 7 56.077 6.292 -1.418 1.00 0.00 H new ATOM 0 HG3 MET I 7 56.215 5.580 0.178 1.00 0.00 H new ATOM 0 HE1 MET I 7 57.892 3.692 -3.123 1.00 0.00 H new ATOM 0 HE2 MET I 7 56.648 4.844 -3.665 1.00 0.00 H new ATOM 0 HE3 MET I 7 57.814 5.320 -2.409 1.00 0.00 H new ATOM 1471 N MET I 8 52.115 5.721 -2.919 1.00 0.00 N ATOM 1472 CA MET I 8 51.642 5.261 -4.256 1.00 0.00 C ATOM 1473 C MET I 8 50.955 6.411 -5.000 1.00 0.00 C ATOM 1474 O MET I 8 50.974 6.478 -6.212 1.00 0.00 O ATOM 1475 CB MET I 8 50.641 4.142 -3.958 1.00 0.00 C ATOM 1476 CG MET I 8 51.364 2.795 -3.951 1.00 0.00 C ATOM 1477 SD MET I 8 52.640 2.802 -2.667 1.00 0.00 S ATOM 1478 CE MET I 8 54.043 3.177 -3.744 1.00 0.00 C ATOM 0 H MET I 8 51.493 5.503 -2.141 1.00 0.00 H new ATOM 0 HA MET I 8 52.461 4.919 -4.888 1.00 0.00 H new ATOM 0 HB2 MET I 8 50.164 4.315 -2.993 1.00 0.00 H new ATOM 0 HB3 MET I 8 49.851 4.138 -4.709 1.00 0.00 H new ATOM 0 HG2 MET I 8 50.653 1.989 -3.768 1.00 0.00 H new ATOM 0 HG3 MET I 8 51.815 2.607 -4.926 1.00 0.00 H new ATOM 0 HE1 MET I 8 54.880 2.526 -3.492 1.00 0.00 H new ATOM 0 HE2 MET I 8 53.757 3.015 -4.783 1.00 0.00 H new ATOM 0 HE3 MET I 8 54.339 4.217 -3.607 1.00 0.00 H new ATOM 1488 N GLN I 9 50.343 7.313 -4.281 1.00 0.00 N ATOM 1489 CA GLN I 9 49.650 8.455 -4.945 1.00 0.00 C ATOM 1490 C GLN I 9 50.633 9.596 -5.223 1.00 0.00 C ATOM 1491 O GLN I 9 50.743 10.077 -6.333 1.00 0.00 O ATOM 1492 CB GLN I 9 48.583 8.901 -3.944 1.00 0.00 C ATOM 1493 CG GLN I 9 47.208 8.425 -4.416 1.00 0.00 C ATOM 1494 CD GLN I 9 46.161 9.494 -4.097 1.00 0.00 C ATOM 1495 OE1 GLN I 9 45.437 9.931 -4.970 1.00 0.00 O ATOM 1496 NE2 GLN I 9 46.051 9.938 -2.875 1.00 0.00 N ATOM 0 H GLN I 9 50.293 7.309 -3.262 1.00 0.00 H new ATOM 0 HA GLN I 9 49.222 8.171 -5.906 1.00 0.00 H new ATOM 0 HB2 GLN I 9 48.802 8.493 -2.957 1.00 0.00 H new ATOM 0 HB3 GLN I 9 48.590 9.987 -3.848 1.00 0.00 H new ATOM 0 HG2 GLN I 9 47.228 8.228 -5.488 1.00 0.00 H new ATOM 0 HG3 GLN I 9 46.947 7.488 -3.925 1.00 0.00 H new ATOM 0 HE21 GLN I 9 46.659 9.571 -2.142 1.00 0.00 H new ATOM 0 HE22 GLN I 9 45.357 10.652 -2.652 1.00 0.00 H new ATOM 1505 N ALA I 10 51.343 10.038 -4.220 1.00 0.00 N ATOM 1506 CA ALA I 10 52.313 11.153 -4.423 1.00 0.00 C ATOM 1507 C ALA I 10 53.427 10.732 -5.384 1.00 0.00 C ATOM 1508 O ALA I 10 54.100 11.559 -5.968 1.00 0.00 O ATOM 1509 CB ALA I 10 52.892 11.431 -3.037 1.00 0.00 C ATOM 0 H ALA I 10 51.293 9.675 -3.268 1.00 0.00 H new ATOM 0 HA ALA I 10 51.836 12.031 -4.857 1.00 0.00 H new ATOM 0 HB1 ALA I 10 53.617 12.242 -3.102 1.00 0.00 H new ATOM 0 HB2 ALA I 10 52.089 11.716 -2.358 1.00 0.00 H new ATOM 0 HB3 ALA I 10 53.384 10.534 -2.661 1.00 0.00 H new ATOM 1515 N LEU I 11 53.637 9.456 -5.545 1.00 0.00 N ATOM 1516 CA LEU I 11 54.719 8.994 -6.460 1.00 0.00 C ATOM 1517 C LEU I 11 54.133 8.241 -7.655 1.00 0.00 C ATOM 1518 O LEU I 11 54.376 8.585 -8.795 1.00 0.00 O ATOM 1519 CB LEU I 11 55.578 8.065 -5.605 1.00 0.00 C ATOM 1520 CG LEU I 11 56.917 7.831 -6.300 1.00 0.00 C ATOM 1521 CD1 LEU I 11 57.780 9.085 -6.163 1.00 0.00 C ATOM 1522 CD2 LEU I 11 57.631 6.647 -5.647 1.00 0.00 C ATOM 0 H LEU I 11 53.109 8.715 -5.085 1.00 0.00 H new ATOM 0 HA LEU I 11 55.293 9.824 -6.872 1.00 0.00 H new ATOM 0 HB2 LEU I 11 55.739 8.504 -4.620 1.00 0.00 H new ATOM 0 HB3 LEU I 11 55.065 7.116 -5.451 1.00 0.00 H new ATOM 0 HG LEU I 11 56.749 7.615 -7.355 1.00 0.00 H new ATOM 0 HD11 LEU I 11 58.738 8.923 -6.658 1.00 0.00 H new ATOM 0 HD12 LEU I 11 57.270 9.930 -6.626 1.00 0.00 H new ATOM 0 HD13 LEU I 11 57.948 9.297 -5.107 1.00 0.00 H new ATOM 0 HD21 LEU I 11 58.587 6.480 -6.143 1.00 0.00 H new ATOM 0 HD22 LEU I 11 57.802 6.862 -4.592 1.00 0.00 H new ATOM 0 HD23 LEU I 11 57.013 5.754 -5.739 1.00 0.00 H new ATOM 1534 N LEU I 12 53.369 7.215 -7.410 1.00 0.00 N ATOM 1535 CA LEU I 12 52.778 6.446 -8.542 1.00 0.00 C ATOM 1536 C LEU I 12 51.308 6.829 -8.735 1.00 0.00 C ATOM 1537 O LEU I 12 50.445 5.981 -8.851 1.00 0.00 O ATOM 1538 CB LEU I 12 52.902 4.976 -8.134 1.00 0.00 C ATOM 1539 CG LEU I 12 54.381 4.590 -8.022 1.00 0.00 C ATOM 1540 CD1 LEU I 12 55.155 5.144 -9.222 1.00 0.00 C ATOM 1541 CD2 LEU I 12 54.964 5.170 -6.731 1.00 0.00 C ATOM 0 H LEU I 12 53.128 6.875 -6.479 1.00 0.00 H new ATOM 0 HA LEU I 12 53.284 6.650 -9.486 1.00 0.00 H new ATOM 0 HB2 LEU I 12 52.401 4.810 -7.180 1.00 0.00 H new ATOM 0 HB3 LEU I 12 52.406 4.342 -8.869 1.00 0.00 H new ATOM 0 HG LEU I 12 54.467 3.504 -8.008 1.00 0.00 H new ATOM 0 HD11 LEU I 12 56.206 4.866 -9.137 1.00 0.00 H new ATOM 0 HD12 LEU I 12 54.744 4.730 -10.143 1.00 0.00 H new ATOM 0 HD13 LEU I 12 55.067 6.230 -9.242 1.00 0.00 H new ATOM 0 HD21 LEU I 12 56.016 4.895 -6.651 1.00 0.00 H new ATOM 0 HD22 LEU I 12 54.873 6.256 -6.746 1.00 0.00 H new ATOM 0 HD23 LEU I 12 54.419 4.772 -5.875 1.00 0.00 H new ATOM 1553 N GLY I 13 51.016 8.101 -8.772 1.00 0.00 N ATOM 1554 CA GLY I 13 49.604 8.538 -8.961 1.00 0.00 C ATOM 1555 C GLY I 13 49.572 9.794 -9.833 1.00 0.00 C ATOM 1556 O GLY I 13 48.572 10.479 -9.916 1.00 0.00 O ATOM 0 H GLY I 13 51.695 8.856 -8.679 1.00 0.00 H new ATOM 0 HA2 GLY I 13 49.025 7.742 -9.430 1.00 0.00 H new ATOM 0 HA3 GLY I 13 49.142 8.741 -7.995 1.00 0.00 H new ATOM 1560 N ALA I 14 50.659 10.102 -10.485 1.00 0.00 N ATOM 1561 CA ALA I 14 50.692 11.315 -11.351 1.00 0.00 C ATOM 1562 C ALA I 14 49.914 11.061 -12.646 1.00 0.00 C ATOM 1563 O ALA I 14 50.481 10.983 -13.718 1.00 0.00 O ATOM 1564 CB ALA I 14 52.173 11.546 -11.650 1.00 0.00 C ATOM 0 H ALA I 14 51.526 9.566 -10.456 1.00 0.00 H new ATOM 0 HA ALA I 14 50.234 12.180 -10.871 1.00 0.00 H new ATOM 0 HB1 ALA I 14 52.283 12.425 -12.285 1.00 0.00 H new ATOM 0 HB2 ALA I 14 52.712 11.703 -10.716 1.00 0.00 H new ATOM 0 HB3 ALA I 14 52.581 10.675 -12.162 1.00 0.00 H new ATOM 1570 N ARG I 15 48.618 10.933 -12.554 1.00 0.00 N ATOM 1571 CA ARG I 15 47.804 10.686 -13.778 1.00 0.00 C ATOM 1572 C ARG I 15 46.958 11.918 -14.104 1.00 0.00 C ATOM 1573 O ARG I 15 47.142 12.557 -15.121 1.00 0.00 O ATOM 1574 CB ARG I 15 46.905 9.501 -13.425 1.00 0.00 C ATOM 1575 CG ARG I 15 47.714 8.205 -13.500 1.00 0.00 C ATOM 1576 CD ARG I 15 47.363 7.458 -14.789 1.00 0.00 C ATOM 1577 NE ARG I 15 48.197 8.096 -15.843 1.00 0.00 N ATOM 1578 CZ ARG I 15 48.846 7.356 -16.700 1.00 0.00 C ATOM 1579 NH1 ARG I 15 49.813 6.579 -16.293 1.00 0.00 N ATOM 1580 NH2 ARG I 15 48.527 7.391 -17.965 1.00 0.00 N ATOM 0 H ARG I 15 48.088 10.989 -11.684 1.00 0.00 H new ATOM 0 HA ARG I 15 48.423 10.482 -14.651 1.00 0.00 H new ATOM 0 HB2 ARG I 15 46.495 9.628 -12.423 1.00 0.00 H new ATOM 0 HB3 ARG I 15 46.060 9.455 -14.112 1.00 0.00 H new ATOM 0 HG2 ARG I 15 48.781 8.428 -13.475 1.00 0.00 H new ATOM 0 HG3 ARG I 15 47.499 7.579 -12.634 1.00 0.00 H new ATOM 0 HD2 ARG I 15 47.584 6.394 -14.701 1.00 0.00 H new ATOM 0 HD3 ARG I 15 46.301 7.545 -15.019 1.00 0.00 H new ATOM 0 HE ARG I 15 48.262 9.113 -15.896 1.00 0.00 H new ATOM 0 HH11 ARG I 15 50.062 6.550 -15.304 1.00 0.00 H new ATOM 0 HH12 ARG I 15 50.319 6.001 -16.964 1.00 0.00 H new ATOM 0 HH21 ARG I 15 47.771 7.997 -18.284 1.00 0.00 H new ATOM 0 HH22 ARG I 15 49.034 6.813 -18.635 1.00 0.00 H new ATOM 1594 N ALA I 16 46.035 12.259 -13.247 1.00 0.00 N ATOM 1595 CA ALA I 16 45.180 13.453 -13.506 1.00 0.00 C ATOM 1596 C ALA I 16 45.715 14.661 -12.734 1.00 0.00 C ATOM 1597 O ALA I 16 45.416 15.795 -13.053 1.00 0.00 O ATOM 1598 CB ALA I 16 43.791 13.063 -13.000 1.00 0.00 C ATOM 0 H ALA I 16 45.836 11.763 -12.378 1.00 0.00 H new ATOM 0 HA ALA I 16 45.165 13.731 -14.560 1.00 0.00 H new ATOM 0 HB1 ALA I 16 43.101 13.892 -13.156 1.00 0.00 H new ATOM 0 HB2 ALA I 16 43.437 12.189 -13.546 1.00 0.00 H new ATOM 0 HB3 ALA I 16 43.843 12.829 -11.937 1.00 0.00 H new ATOM 1604 N LYS I 17 46.506 14.429 -11.722 1.00 0.00 N ATOM 1605 CA LYS I 17 47.061 15.566 -10.932 1.00 0.00 C ATOM 1606 C LYS I 17 47.693 16.601 -11.867 1.00 0.00 C ATOM 1607 O LYS I 17 47.190 17.711 -11.917 1.00 0.00 O ATOM 1608 CB LYS I 17 48.128 14.941 -10.030 1.00 0.00 C ATOM 1609 CG LYS I 17 47.592 14.835 -8.600 1.00 0.00 C ATOM 1610 CD LYS I 17 47.935 16.113 -7.832 1.00 0.00 C ATOM 1611 CE LYS I 17 47.334 16.043 -6.425 1.00 0.00 C ATOM 1612 NZ LYS I 17 45.859 16.127 -6.625 1.00 0.00 N ATOM 1613 OXT LYS I 17 48.667 16.263 -12.520 1.00 0.00 O ATOM 0 H LYS I 17 46.792 13.502 -11.408 1.00 0.00 H new ATOM 0 HA LYS I 17 46.292 16.082 -10.357 1.00 0.00 H new ATOM 0 HB2 LYS I 17 48.400 13.953 -10.402 1.00 0.00 H new ATOM 0 HB3 LYS I 17 49.033 15.548 -10.046 1.00 0.00 H new ATOM 0 HG2 LYS I 17 46.512 14.685 -8.615 1.00 0.00 H new ATOM 0 HG3 LYS I 17 48.027 13.970 -8.100 1.00 0.00 H new ATOM 0 HD2 LYS I 17 49.017 16.234 -7.771 1.00 0.00 H new ATOM 0 HD3 LYS I 17 47.547 16.983 -8.362 1.00 0.00 H new ATOM 0 HE2 LYS I 17 47.611 15.115 -5.924 1.00 0.00 H new ATOM 0 HE3 LYS I 17 47.694 16.862 -5.802 1.00 0.00 H new ATOM 0 HZ1 LYS I 17 45.422 16.582 -5.798 1.00 0.00 H new ATOM 0 HZ2 LYS I 17 45.656 16.688 -7.477 1.00 0.00 H new ATOM 0 HZ3 LYS I 17 45.469 15.170 -6.740 1.00 0.00 H new TER 1627 LYS I 17 HETATM 1628 CA CA C 90 69.992 -4.502 3.772 1.00 0.00 CA