USER MOD reduce.3.24.130724 H: found=0, std=0, add=1016, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1017 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 19 MET CE :methyl -123:sc= -3.99! (180deg=-6.96!) USER MOD Set 1.2: B 68 HIS : no HD1:sc= -2.66! C(o=-6.6!,f=-12!) USER MOD Set 2.1: A 35 ASN : amide:sc= -0.276 X(o=-0.23,f=-0.65) USER MOD Set 2.2: A 42 THR OG1 : rot 95:sc= 0.0497 USER MOD Set 3.1: A 36 ASN : amide:sc= -2.96! K(o=-5.5!,f=-3) USER MOD Set 3.2: A 37 ASN : amide:sc= -2.53 X(o=-5.5,f=-5.7!) USER MOD Single : A 6 ASN : amide:sc= -0.0699 X(o=-0.07,f=0.14) USER MOD Single : A 9 HIS : no HD1:sc= -3.3 K(o=-3.3,f=-0.96) USER MOD Single : A 11 SER OG : rot 180:sc= -0.189 USER MOD Single : A 12 LYS NZ :NH3+ -163:sc= -0.0691 (180deg=-0.364) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 17 MET CE :methyl 160:sc= -0.165 (180deg=-0.794) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 GLN : amide:sc= -1.24! K(o=-1.2!,f=0) USER MOD Single : A 31 HIS : no HD1:sc= -1.25 X(o=-1.3,f=-1.1) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 ASN : amide:sc= -6.06! C(o=-6.1!,f=-12!) USER MOD Single : A 53 LYS NZ :NH3+ 152:sc= -3.88! (180deg=-5.02!) USER MOD Single : A 54 SER OG : rot 21:sc= 0.321 USER MOD Single : B 1 MET CE :methyl -152:sc= -1.84 (180deg=-3.15!) USER MOD Single : B 1 MET N :NH3+ 169:sc= 1.26 (180deg=0.945) USER MOD Single : B 2 GLN : amide:sc= -5.88! C(o=-5.9!,f=-2.5!) USER MOD Single : B 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 7 THR OG1 : rot 180:sc= -0.2 USER MOD Single : B 9 THR OG1 : rot 27:sc= 0.721 USER MOD Single : B 11 LYS NZ :NH3+ -170:sc= 1.16 (180deg=1) USER MOD Single : B 12 THR OG1 : rot 32:sc= 0.358 USER MOD Single : B 14 THR OG1 : rot 180:sc= 0 USER MOD Single : B 19 SER OG : rot 180:sc= 0 USER MOD Single : B 20 SER OG : rot -51:sc= 0.497 USER MOD Single : B 22 THR OG1 : rot -140:sc= 0 USER MOD Single : B 25 ASN : amide:sc= -3.72! C(o=-3.7!,f=-1.5!) USER MOD Single : B 27 LYS NZ :NH3+ 179:sc= 1.18 (180deg=1.18) USER MOD Single : B 28 SER OG : rot 180:sc= 0 USER MOD Single : B 29 LYS NZ :NH3+ -163:sc= -0.0529 (180deg=-0.352) USER MOD Single : B 31 GLN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : B 33 LYS NZ :NH3+ 167:sc= -0.0303 (180deg=-0.224) USER MOD Single : B 40 GLN : amide:sc= -4.05! K(o=-4!,f=-1.4) USER MOD Single : B 41 GLN : amide:sc= -2.24! C(o=-2.2!,f=-3!) USER MOD Single : B 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 49 GLN : amide:sc= -4.82! K(o=-4.8!,f=-2) USER MOD Single : B 55 THR OG1 : rot 180:sc= 0 USER MOD Single : B 57 SER OG : rot 180:sc= 0 USER MOD Single : B 59 TYR OH : rot -120:sc= 0.37 USER MOD Single : B 60 ASN : amide:sc= -1.11 K(o=-1.1,f=0.64) USER MOD Single : B 62 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 63 LYS NZ :NH3+ -166:sc= -0.0575 (180deg=-0.27) USER MOD Single : B 65 SER OG : rot 148:sc= 0.914 USER MOD Single : B 66 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ASN A 6 21.192 4.505 -3.286 1.00 0.00 N ATOM 2 CA ASN A 6 19.966 5.248 -3.565 1.00 0.00 C ATOM 3 C ASN A 6 18.776 4.659 -2.814 1.00 0.00 C ATOM 4 O ASN A 6 17.805 5.362 -2.527 1.00 0.00 O ATOM 5 CB ASN A 6 19.679 5.252 -5.067 1.00 0.00 C ATOM 6 CG ASN A 6 20.763 5.948 -5.864 1.00 0.00 C ATOM 7 OD1 ASN A 6 21.928 5.554 -5.825 1.00 0.00 O ATOM 8 ND2 ASN A 6 20.382 6.990 -6.594 1.00 0.00 N ATOM 0 HA ASN A 6 20.113 6.272 -3.222 1.00 0.00 H new ATOM 0 HB2 ASN A 6 19.578 4.225 -5.417 1.00 0.00 H new ATOM 0 HB3 ASN A 6 18.725 5.746 -5.250 1.00 0.00 H new ATOM 0 HD21 ASN A 6 21.067 7.499 -7.153 1.00 0.00 H new ATOM 0 HD22 ASN A 6 19.404 7.281 -6.596 1.00 0.00 H new ATOM 15 N ASP A 7 18.855 3.363 -2.512 1.00 0.00 N ATOM 16 CA ASP A 7 17.784 2.661 -1.806 1.00 0.00 C ATOM 17 C ASP A 7 16.554 2.524 -2.698 1.00 0.00 C ATOM 18 O ASP A 7 16.185 3.455 -3.416 1.00 0.00 O ATOM 19 CB ASP A 7 17.423 3.385 -0.504 1.00 0.00 C ATOM 20 CG ASP A 7 16.364 2.650 0.298 1.00 0.00 C ATOM 21 OD1 ASP A 7 15.230 2.504 -0.205 1.00 0.00 O ATOM 22 OD2 ASP A 7 16.672 2.217 1.428 1.00 0.00 O ATOM 0 H ASP A 7 19.655 2.775 -2.747 1.00 0.00 H new ATOM 0 HA ASP A 7 18.142 1.663 -1.554 1.00 0.00 H new ATOM 0 HB2 ASP A 7 18.320 3.500 0.105 1.00 0.00 H new ATOM 0 HB3 ASP A 7 17.066 4.388 -0.737 1.00 0.00 H new ATOM 27 N ASP A 8 15.933 1.347 -2.658 1.00 0.00 N ATOM 28 CA ASP A 8 14.753 1.070 -3.472 1.00 0.00 C ATOM 29 C ASP A 8 13.500 1.736 -2.909 1.00 0.00 C ATOM 30 O ASP A 8 12.419 1.146 -2.928 1.00 0.00 O ATOM 31 CB ASP A 8 14.527 -0.441 -3.574 1.00 0.00 C ATOM 32 CG ASP A 8 15.701 -1.162 -4.205 1.00 0.00 C ATOM 33 OD1 ASP A 8 16.808 -1.110 -3.630 1.00 0.00 O ATOM 34 OD2 ASP A 8 15.513 -1.781 -5.273 1.00 0.00 O ATOM 0 H ASP A 8 16.229 0.569 -2.069 1.00 0.00 H new ATOM 0 HA ASP A 8 14.938 1.486 -4.463 1.00 0.00 H new ATOM 0 HB2 ASP A 8 14.348 -0.846 -2.578 1.00 0.00 H new ATOM 0 HB3 ASP A 8 13.629 -0.632 -4.162 1.00 0.00 H new ATOM 39 N HIS A 9 13.632 2.967 -2.422 1.00 0.00 N ATOM 40 CA HIS A 9 12.484 3.682 -1.881 1.00 0.00 C ATOM 41 C HIS A 9 11.507 4.009 -3.004 1.00 0.00 C ATOM 42 O HIS A 9 10.313 4.195 -2.772 1.00 0.00 O ATOM 43 CB HIS A 9 12.906 4.954 -1.121 1.00 0.00 C ATOM 44 CG HIS A 9 12.959 6.214 -1.940 1.00 0.00 C ATOM 45 ND1 HIS A 9 12.587 7.441 -1.431 1.00 0.00 N ATOM 46 CD2 HIS A 9 13.347 6.446 -3.219 1.00 0.00 C ATOM 47 CE1 HIS A 9 12.737 8.368 -2.358 1.00 0.00 C ATOM 48 NE2 HIS A 9 13.198 7.792 -3.451 1.00 0.00 N ATOM 0 H HIS A 9 14.511 3.483 -2.391 1.00 0.00 H new ATOM 0 HA HIS A 9 11.988 3.035 -1.157 1.00 0.00 H new ATOM 0 HB2 HIS A 9 12.212 5.108 -0.294 1.00 0.00 H new ATOM 0 HB3 HIS A 9 13.890 4.785 -0.684 1.00 0.00 H new ATOM 0 HD2 HIS A 9 13.706 5.710 -3.923 1.00 0.00 H new ATOM 0 HE1 HIS A 9 12.519 9.419 -2.241 1.00 0.00 H new ATOM 0 HE2 HIS A 9 13.410 8.269 -4.327 1.00 0.00 H new ATOM 57 N GLU A 10 12.038 4.082 -4.226 1.00 0.00 N ATOM 58 CA GLU A 10 11.237 4.394 -5.403 1.00 0.00 C ATOM 59 C GLU A 10 10.016 3.487 -5.482 1.00 0.00 C ATOM 60 O GLU A 10 8.942 3.921 -5.896 1.00 0.00 O ATOM 61 CB GLU A 10 12.083 4.254 -6.670 1.00 0.00 C ATOM 62 CG GLU A 10 12.709 2.878 -6.840 1.00 0.00 C ATOM 63 CD GLU A 10 13.568 2.778 -8.086 1.00 0.00 C ATOM 64 OE1 GLU A 10 14.553 3.539 -8.190 1.00 0.00 O ATOM 65 OE2 GLU A 10 13.255 1.938 -8.957 1.00 0.00 O ATOM 0 H GLU A 10 13.027 3.927 -4.423 1.00 0.00 H new ATOM 0 HA GLU A 10 10.893 5.425 -5.320 1.00 0.00 H new ATOM 0 HB2 GLU A 10 11.460 4.469 -7.538 1.00 0.00 H new ATOM 0 HB3 GLU A 10 12.874 5.003 -6.652 1.00 0.00 H new ATOM 0 HG2 GLU A 10 13.317 2.649 -5.965 1.00 0.00 H new ATOM 0 HG3 GLU A 10 11.920 2.127 -6.886 1.00 0.00 H new ATOM 72 N SER A 11 10.177 2.234 -5.066 1.00 0.00 N ATOM 73 CA SER A 11 9.069 1.289 -5.075 1.00 0.00 C ATOM 74 C SER A 11 7.947 1.821 -4.191 1.00 0.00 C ATOM 75 O SER A 11 6.774 1.811 -4.572 1.00 0.00 O ATOM 76 CB SER A 11 9.528 -0.084 -4.582 1.00 0.00 C ATOM 77 OG SER A 11 8.466 -1.020 -4.624 1.00 0.00 O ATOM 0 H SER A 11 11.058 1.853 -4.721 1.00 0.00 H new ATOM 0 HA SER A 11 8.704 1.176 -6.096 1.00 0.00 H new ATOM 0 HB2 SER A 11 10.354 -0.438 -5.199 1.00 0.00 H new ATOM 0 HB3 SER A 11 9.904 -0.001 -3.562 1.00 0.00 H new ATOM 0 HG SER A 11 8.784 -1.890 -4.306 1.00 0.00 H new ATOM 83 N LYS A 12 8.327 2.315 -3.016 1.00 0.00 N ATOM 84 CA LYS A 12 7.370 2.886 -2.079 1.00 0.00 C ATOM 85 C LYS A 12 6.703 4.092 -2.725 1.00 0.00 C ATOM 86 O LYS A 12 5.485 4.262 -2.655 1.00 0.00 O ATOM 87 CB LYS A 12 8.081 3.311 -0.791 1.00 0.00 C ATOM 88 CG LYS A 12 9.023 2.255 -0.230 1.00 0.00 C ATOM 89 CD LYS A 12 8.288 0.976 0.129 1.00 0.00 C ATOM 90 CE LYS A 12 9.244 -0.100 0.620 1.00 0.00 C ATOM 91 NZ LYS A 12 10.266 -0.448 -0.406 1.00 0.00 N ATOM 0 H LYS A 12 9.294 2.330 -2.691 1.00 0.00 H new ATOM 0 HA LYS A 12 6.617 2.139 -1.829 1.00 0.00 H new ATOM 0 HB2 LYS A 12 8.646 4.223 -0.983 1.00 0.00 H new ATOM 0 HB3 LYS A 12 7.332 3.553 -0.037 1.00 0.00 H new ATOM 0 HG2 LYS A 12 9.799 2.034 -0.963 1.00 0.00 H new ATOM 0 HG3 LYS A 12 9.523 2.648 0.656 1.00 0.00 H new ATOM 0 HD2 LYS A 12 7.548 1.186 0.901 1.00 0.00 H new ATOM 0 HD3 LYS A 12 7.745 0.611 -0.743 1.00 0.00 H new ATOM 0 HE2 LYS A 12 9.742 0.244 1.526 1.00 0.00 H new ATOM 0 HE3 LYS A 12 8.679 -0.993 0.886 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 10.706 -1.358 -0.163 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 9.811 -0.521 -1.338 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 10.996 0.293 -0.434 1.00 0.00 H new ATOM 105 N LEU A 13 7.522 4.911 -3.381 1.00 0.00 N ATOM 106 CA LEU A 13 7.036 6.094 -4.075 1.00 0.00 C ATOM 107 C LEU A 13 6.000 5.683 -5.110 1.00 0.00 C ATOM 108 O LEU A 13 4.995 6.366 -5.309 1.00 0.00 O ATOM 109 CB LEU A 13 8.201 6.827 -4.747 1.00 0.00 C ATOM 110 CG LEU A 13 7.825 8.094 -5.519 1.00 0.00 C ATOM 111 CD1 LEU A 13 7.192 9.121 -4.593 1.00 0.00 C ATOM 112 CD2 LEU A 13 9.054 8.677 -6.201 1.00 0.00 C ATOM 0 H LEU A 13 8.531 4.773 -3.445 1.00 0.00 H new ATOM 0 HA LEU A 13 6.573 6.771 -3.356 1.00 0.00 H new ATOM 0 HB2 LEU A 13 8.931 7.092 -3.982 1.00 0.00 H new ATOM 0 HB3 LEU A 13 8.694 6.138 -5.432 1.00 0.00 H new ATOM 0 HG LEU A 13 7.094 7.829 -6.283 1.00 0.00 H new ATOM 0 HD11 LEU A 13 6.933 10.013 -5.163 1.00 0.00 H new ATOM 0 HD12 LEU A 13 6.291 8.701 -4.146 1.00 0.00 H new ATOM 0 HD13 LEU A 13 7.898 9.385 -3.806 1.00 0.00 H new ATOM 0 HD21 LEU A 13 8.774 9.578 -6.747 1.00 0.00 H new ATOM 0 HD22 LEU A 13 9.803 8.926 -5.450 1.00 0.00 H new ATOM 0 HD23 LEU A 13 9.466 7.945 -6.896 1.00 0.00 H new ATOM 124 N SER A 14 6.248 4.542 -5.749 1.00 0.00 N ATOM 125 CA SER A 14 5.334 4.010 -6.745 1.00 0.00 C ATOM 126 C SER A 14 3.990 3.719 -6.095 1.00 0.00 C ATOM 127 O SER A 14 2.935 4.052 -6.645 1.00 0.00 O ATOM 128 CB SER A 14 5.906 2.735 -7.370 1.00 0.00 C ATOM 129 OG SER A 14 5.029 2.208 -8.350 1.00 0.00 O ATOM 0 H SER A 14 7.078 3.970 -5.591 1.00 0.00 H new ATOM 0 HA SER A 14 5.200 4.748 -7.536 1.00 0.00 H new ATOM 0 HB2 SER A 14 6.874 2.951 -7.822 1.00 0.00 H new ATOM 0 HB3 SER A 14 6.077 1.990 -6.592 1.00 0.00 H new ATOM 0 HG SER A 14 5.419 1.395 -8.734 1.00 0.00 H new ATOM 135 N ILE A 15 4.038 3.113 -4.907 1.00 0.00 N ATOM 136 CA ILE A 15 2.819 2.801 -4.177 1.00 0.00 C ATOM 137 C ILE A 15 2.012 4.069 -3.967 1.00 0.00 C ATOM 138 O ILE A 15 0.804 4.078 -4.153 1.00 0.00 O ATOM 139 CB ILE A 15 3.087 2.180 -2.789 1.00 0.00 C ATOM 140 CG1 ILE A 15 4.107 1.044 -2.857 1.00 0.00 C ATOM 141 CG2 ILE A 15 1.785 1.672 -2.193 1.00 0.00 C ATOM 142 CD1 ILE A 15 3.786 -0.018 -3.885 1.00 0.00 C ATOM 0 H ILE A 15 4.900 2.833 -4.439 1.00 0.00 H new ATOM 0 HA ILE A 15 2.279 2.071 -4.780 1.00 0.00 H new ATOM 0 HB ILE A 15 3.506 2.960 -2.153 1.00 0.00 H new ATOM 0 HG12 ILE A 15 5.088 1.464 -3.080 1.00 0.00 H new ATOM 0 HG13 ILE A 15 4.177 0.574 -1.876 1.00 0.00 H new ATOM 0 HG21 ILE A 15 1.979 1.235 -1.214 1.00 0.00 H new ATOM 0 HG22 ILE A 15 1.085 2.501 -2.088 1.00 0.00 H new ATOM 0 HG23 ILE A 15 1.355 0.915 -2.849 1.00 0.00 H new ATOM 0 HD11 ILE A 15 4.559 -0.786 -3.868 1.00 0.00 H new ATOM 0 HD12 ILE A 15 2.821 -0.469 -3.653 1.00 0.00 H new ATOM 0 HD13 ILE A 15 3.746 0.435 -4.876 1.00 0.00 H new ATOM 154 N LEU A 16 2.703 5.137 -3.574 1.00 0.00 N ATOM 155 CA LEU A 16 2.065 6.425 -3.329 1.00 0.00 C ATOM 156 C LEU A 16 1.358 6.941 -4.578 1.00 0.00 C ATOM 157 O LEU A 16 0.223 7.414 -4.509 1.00 0.00 O ATOM 158 CB LEU A 16 3.104 7.452 -2.866 1.00 0.00 C ATOM 159 CG LEU A 16 3.762 7.159 -1.515 1.00 0.00 C ATOM 160 CD1 LEU A 16 4.825 8.202 -1.207 1.00 0.00 C ATOM 161 CD2 LEU A 16 2.717 7.130 -0.410 1.00 0.00 C ATOM 0 H LEU A 16 3.711 5.133 -3.418 1.00 0.00 H new ATOM 0 HA LEU A 16 1.320 6.282 -2.546 1.00 0.00 H new ATOM 0 HB2 LEU A 16 3.885 7.520 -3.624 1.00 0.00 H new ATOM 0 HB3 LEU A 16 2.625 8.430 -2.813 1.00 0.00 H new ATOM 0 HG LEU A 16 4.239 6.180 -1.568 1.00 0.00 H new ATOM 0 HD11 LEU A 16 5.284 7.980 -0.243 1.00 0.00 H new ATOM 0 HD12 LEU A 16 5.588 8.184 -1.985 1.00 0.00 H new ATOM 0 HD13 LEU A 16 4.366 9.190 -1.172 1.00 0.00 H new ATOM 0 HD21 LEU A 16 3.202 6.920 0.544 1.00 0.00 H new ATOM 0 HD22 LEU A 16 2.216 8.097 -0.358 1.00 0.00 H new ATOM 0 HD23 LEU A 16 1.984 6.352 -0.623 1.00 0.00 H new ATOM 173 N MET A 17 2.037 6.856 -5.718 1.00 0.00 N ATOM 174 CA MET A 17 1.472 7.324 -6.981 1.00 0.00 C ATOM 175 C MET A 17 0.139 6.644 -7.274 1.00 0.00 C ATOM 176 O MET A 17 -0.863 7.311 -7.529 1.00 0.00 O ATOM 177 CB MET A 17 2.448 7.062 -8.129 1.00 0.00 C ATOM 178 CG MET A 17 3.776 7.783 -7.976 1.00 0.00 C ATOM 179 SD MET A 17 4.918 7.428 -9.325 1.00 0.00 S ATOM 180 CE MET A 17 3.989 8.042 -10.728 1.00 0.00 C ATOM 0 H MET A 17 2.977 6.468 -5.794 1.00 0.00 H new ATOM 0 HA MET A 17 1.300 8.397 -6.892 1.00 0.00 H new ATOM 0 HB2 MET A 17 2.632 5.990 -8.200 1.00 0.00 H new ATOM 0 HB3 MET A 17 1.984 7.369 -9.066 1.00 0.00 H new ATOM 0 HG2 MET A 17 3.598 8.857 -7.929 1.00 0.00 H new ATOM 0 HG3 MET A 17 4.235 7.494 -7.031 1.00 0.00 H new ATOM 0 HE1 MET A 17 4.667 8.226 -11.561 1.00 0.00 H new ATOM 0 HE2 MET A 17 3.244 7.303 -11.023 1.00 0.00 H new ATOM 0 HE3 MET A 17 3.490 8.972 -10.455 1.00 0.00 H new ATOM 190 N ASP A 18 0.136 5.318 -7.234 1.00 0.00 N ATOM 191 CA ASP A 18 -1.077 4.550 -7.496 1.00 0.00 C ATOM 192 C ASP A 18 -2.052 4.655 -6.320 1.00 0.00 C ATOM 193 O ASP A 18 -3.268 4.587 -6.499 1.00 0.00 O ATOM 194 CB ASP A 18 -0.725 3.086 -7.769 1.00 0.00 C ATOM 195 CG ASP A 18 -1.921 2.266 -8.219 1.00 0.00 C ATOM 196 OD1 ASP A 18 -3.016 2.844 -8.381 1.00 0.00 O ATOM 197 OD2 ASP A 18 -1.759 1.044 -8.419 1.00 0.00 O ATOM 0 H ASP A 18 0.958 4.752 -7.023 1.00 0.00 H new ATOM 0 HA ASP A 18 -1.564 4.965 -8.378 1.00 0.00 H new ATOM 0 HB2 ASP A 18 0.050 3.040 -8.535 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -0.306 2.643 -6.865 1.00 0.00 H new ATOM 202 N MET A 19 -1.503 4.819 -5.119 1.00 0.00 N ATOM 203 CA MET A 19 -2.311 4.930 -3.904 1.00 0.00 C ATOM 204 C MET A 19 -3.254 6.125 -3.991 1.00 0.00 C ATOM 205 O MET A 19 -4.395 6.059 -3.531 1.00 0.00 O ATOM 206 CB MET A 19 -1.408 5.062 -2.670 1.00 0.00 C ATOM 207 CG MET A 19 -2.143 4.923 -1.345 1.00 0.00 C ATOM 208 SD MET A 19 -2.824 3.276 -1.094 1.00 0.00 S ATOM 209 CE MET A 19 -1.372 2.388 -0.539 1.00 0.00 C ATOM 0 H MET A 19 -0.497 4.878 -4.959 1.00 0.00 H new ATOM 0 HA MET A 19 -2.908 4.023 -3.809 1.00 0.00 H new ATOM 0 HB2 MET A 19 -0.627 4.303 -2.722 1.00 0.00 H new ATOM 0 HB3 MET A 19 -0.912 6.032 -2.698 1.00 0.00 H new ATOM 0 HG2 MET A 19 -1.459 5.156 -0.529 1.00 0.00 H new ATOM 0 HG3 MET A 19 -2.950 5.655 -1.304 1.00 0.00 H new ATOM 0 HE1 MET A 19 -1.192 1.538 -1.197 1.00 0.00 H new ATOM 0 HE2 MET A 19 -0.508 3.053 -0.561 1.00 0.00 H new ATOM 0 HE3 MET A 19 -1.530 2.032 0.479 1.00 0.00 H new ATOM 219 N PHE A 20 -2.775 7.217 -4.587 1.00 0.00 N ATOM 220 CA PHE A 20 -3.586 8.422 -4.733 1.00 0.00 C ATOM 221 C PHE A 20 -3.581 8.907 -6.182 1.00 0.00 C ATOM 222 O PHE A 20 -2.583 9.447 -6.661 1.00 0.00 O ATOM 223 CB PHE A 20 -3.067 9.531 -3.815 1.00 0.00 C ATOM 224 CG PHE A 20 -2.742 9.056 -2.428 1.00 0.00 C ATOM 225 CD1 PHE A 20 -1.473 8.587 -2.125 1.00 0.00 C ATOM 226 CD2 PHE A 20 -3.705 9.066 -1.433 1.00 0.00 C ATOM 227 CE1 PHE A 20 -1.172 8.138 -0.855 1.00 0.00 C ATOM 228 CE2 PHE A 20 -3.408 8.619 -0.160 1.00 0.00 C ATOM 229 CZ PHE A 20 -2.141 8.153 0.129 1.00 0.00 C ATOM 0 H PHE A 20 -1.834 7.290 -4.974 1.00 0.00 H new ATOM 0 HA PHE A 20 -4.609 8.175 -4.450 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -2.174 9.971 -4.259 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -3.815 10.321 -3.754 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -0.712 8.573 -2.891 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -4.699 9.427 -1.654 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -0.180 7.775 -0.631 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -4.167 8.634 0.609 1.00 0.00 H new ATOM 0 HZ PHE A 20 -1.908 7.801 1.123 1.00 0.00 H new ATOM 239 N PRO A 21 -4.702 8.718 -6.903 1.00 0.00 N ATOM 240 CA PRO A 21 -4.829 9.134 -8.298 1.00 0.00 C ATOM 241 C PRO A 21 -5.242 10.596 -8.441 1.00 0.00 C ATOM 242 O PRO A 21 -6.201 10.910 -9.147 1.00 0.00 O ATOM 243 CB PRO A 21 -5.928 8.213 -8.818 1.00 0.00 C ATOM 244 CG PRO A 21 -6.816 7.987 -7.641 1.00 0.00 C ATOM 245 CD PRO A 21 -5.940 8.078 -6.414 1.00 0.00 C ATOM 0 HA PRO A 21 -3.886 9.061 -8.840 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -6.472 8.672 -9.643 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -5.516 7.275 -9.190 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -7.610 8.733 -7.606 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -7.298 7.011 -7.701 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -6.412 8.670 -5.630 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -5.740 7.093 -5.993 1.00 0.00 H new ATOM 253 N ALA A 22 -4.520 11.488 -7.768 1.00 0.00 N ATOM 254 CA ALA A 22 -4.833 12.912 -7.830 1.00 0.00 C ATOM 255 C ALA A 22 -3.705 13.765 -7.255 1.00 0.00 C ATOM 256 O ALA A 22 -3.353 14.800 -7.823 1.00 0.00 O ATOM 257 CB ALA A 22 -6.132 13.197 -7.092 1.00 0.00 C ATOM 0 H ALA A 22 -3.721 11.253 -7.179 1.00 0.00 H new ATOM 0 HA ALA A 22 -4.948 13.179 -8.881 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -6.355 14.263 -7.145 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -6.943 12.633 -7.553 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -6.030 12.900 -6.048 1.00 0.00 H new ATOM 263 N ILE A 23 -3.147 13.337 -6.128 1.00 0.00 N ATOM 264 CA ILE A 23 -2.068 14.080 -5.490 1.00 0.00 C ATOM 265 C ILE A 23 -0.813 14.076 -6.353 1.00 0.00 C ATOM 266 O ILE A 23 -0.392 13.033 -6.855 1.00 0.00 O ATOM 267 CB ILE A 23 -1.735 13.510 -4.097 1.00 0.00 C ATOM 268 CG1 ILE A 23 -2.981 13.543 -3.207 1.00 0.00 C ATOM 269 CG2 ILE A 23 -0.597 14.297 -3.460 1.00 0.00 C ATOM 270 CD1 ILE A 23 -2.775 12.918 -1.845 1.00 0.00 C ATOM 0 H ILE A 23 -3.422 12.485 -5.640 1.00 0.00 H new ATOM 0 HA ILE A 23 -2.416 15.106 -5.373 1.00 0.00 H new ATOM 0 HB ILE A 23 -1.413 12.474 -4.206 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -3.296 14.578 -3.077 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -3.793 13.024 -3.716 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -0.374 13.882 -2.477 1.00 0.00 H new ATOM 0 HG22 ILE A 23 0.289 14.231 -4.091 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -0.891 15.341 -3.355 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -3.701 12.979 -1.273 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -2.490 11.873 -1.964 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -1.985 13.451 -1.316 1.00 0.00 H new ATOM 282 N SER A 24 -0.224 15.255 -6.525 1.00 0.00 N ATOM 283 CA SER A 24 0.981 15.404 -7.330 1.00 0.00 C ATOM 284 C SER A 24 2.108 14.520 -6.806 1.00 0.00 C ATOM 285 O SER A 24 2.313 14.409 -5.598 1.00 0.00 O ATOM 286 CB SER A 24 1.432 16.867 -7.340 1.00 0.00 C ATOM 287 OG SER A 24 2.623 17.028 -8.092 1.00 0.00 O ATOM 0 H SER A 24 -0.565 16.125 -6.115 1.00 0.00 H new ATOM 0 HA SER A 24 0.745 15.091 -8.347 1.00 0.00 H new ATOM 0 HB2 SER A 24 0.644 17.491 -7.762 1.00 0.00 H new ATOM 0 HB3 SER A 24 1.595 17.208 -6.318 1.00 0.00 H new ATOM 0 HG SER A 24 2.890 17.971 -8.085 1.00 0.00 H new ATOM 293 N LYS A 25 2.838 13.899 -7.729 1.00 0.00 N ATOM 294 CA LYS A 25 3.951 13.028 -7.373 1.00 0.00 C ATOM 295 C LYS A 25 4.955 13.769 -6.495 1.00 0.00 C ATOM 296 O LYS A 25 5.624 13.168 -5.654 1.00 0.00 O ATOM 297 CB LYS A 25 4.642 12.510 -8.639 1.00 0.00 C ATOM 298 CG LYS A 25 5.817 11.584 -8.363 1.00 0.00 C ATOM 299 CD LYS A 25 6.479 11.129 -9.653 1.00 0.00 C ATOM 300 CE LYS A 25 7.671 10.225 -9.377 1.00 0.00 C ATOM 301 NZ LYS A 25 8.348 9.799 -10.633 1.00 0.00 N ATOM 0 H LYS A 25 2.677 13.984 -8.733 1.00 0.00 H new ATOM 0 HA LYS A 25 3.559 12.181 -6.810 1.00 0.00 H new ATOM 0 HB2 LYS A 25 3.911 11.981 -9.250 1.00 0.00 H new ATOM 0 HB3 LYS A 25 4.992 13.360 -9.225 1.00 0.00 H new ATOM 0 HG2 LYS A 25 6.548 12.097 -7.739 1.00 0.00 H new ATOM 0 HG3 LYS A 25 5.473 10.715 -7.802 1.00 0.00 H new ATOM 0 HD2 LYS A 25 5.753 10.598 -10.269 1.00 0.00 H new ATOM 0 HD3 LYS A 25 6.805 11.999 -10.223 1.00 0.00 H new ATOM 0 HE2 LYS A 25 8.384 10.749 -8.740 1.00 0.00 H new ATOM 0 HE3 LYS A 25 7.339 9.344 -8.827 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 9.155 9.185 -10.401 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 7.675 9.277 -11.230 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 8.688 10.638 -11.146 1.00 0.00 H new ATOM 315 N SER A 26 5.054 15.080 -6.702 1.00 0.00 N ATOM 316 CA SER A 26 5.975 15.914 -5.938 1.00 0.00 C ATOM 317 C SER A 26 5.761 15.750 -4.436 1.00 0.00 C ATOM 318 O SER A 26 6.717 15.559 -3.686 1.00 0.00 O ATOM 319 CB SER A 26 5.806 17.383 -6.331 1.00 0.00 C ATOM 320 OG SER A 26 6.668 18.217 -5.575 1.00 0.00 O ATOM 0 H SER A 26 4.505 15.588 -7.395 1.00 0.00 H new ATOM 0 HA SER A 26 6.989 15.591 -6.172 1.00 0.00 H new ATOM 0 HB2 SER A 26 6.017 17.505 -7.393 1.00 0.00 H new ATOM 0 HB3 SER A 26 4.771 17.688 -6.175 1.00 0.00 H new ATOM 0 HG SER A 26 6.541 19.150 -5.847 1.00 0.00 H new ATOM 326 N LYS A 27 4.506 15.824 -4.000 1.00 0.00 N ATOM 327 CA LYS A 27 4.189 15.681 -2.582 1.00 0.00 C ATOM 328 C LYS A 27 4.530 14.288 -2.079 1.00 0.00 C ATOM 329 O LYS A 27 5.206 14.136 -1.067 1.00 0.00 O ATOM 330 CB LYS A 27 2.709 15.963 -2.308 1.00 0.00 C ATOM 331 CG LYS A 27 2.334 17.434 -2.362 1.00 0.00 C ATOM 332 CD LYS A 27 2.229 17.940 -3.792 1.00 0.00 C ATOM 333 CE LYS A 27 1.751 19.382 -3.837 1.00 0.00 C ATOM 334 NZ LYS A 27 1.611 19.878 -5.234 1.00 0.00 N ATOM 0 H LYS A 27 3.698 15.981 -4.603 1.00 0.00 H new ATOM 0 HA LYS A 27 4.795 16.414 -2.049 1.00 0.00 H new ATOM 0 HB2 LYS A 27 2.107 15.419 -3.036 1.00 0.00 H new ATOM 0 HB3 LYS A 27 2.452 15.570 -1.324 1.00 0.00 H new ATOM 0 HG2 LYS A 27 1.382 17.585 -1.853 1.00 0.00 H new ATOM 0 HG3 LYS A 27 3.080 18.019 -1.824 1.00 0.00 H new ATOM 0 HD2 LYS A 27 3.201 17.862 -4.279 1.00 0.00 H new ATOM 0 HD3 LYS A 27 1.540 17.309 -4.353 1.00 0.00 H new ATOM 0 HE2 LYS A 27 0.792 19.462 -3.326 1.00 0.00 H new ATOM 0 HE3 LYS A 27 2.455 20.015 -3.296 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 1.283 20.865 -5.221 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 2.532 19.825 -5.715 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 0.920 19.291 -5.743 1.00 0.00 H new ATOM 348 N LEU A 28 4.051 13.272 -2.786 1.00 0.00 N ATOM 349 CA LEU A 28 4.299 11.889 -2.403 1.00 0.00 C ATOM 350 C LEU A 28 5.784 11.651 -2.132 1.00 0.00 C ATOM 351 O LEU A 28 6.149 10.988 -1.161 1.00 0.00 O ATOM 352 CB LEU A 28 3.783 10.947 -3.494 1.00 0.00 C ATOM 353 CG LEU A 28 2.276 11.042 -3.760 1.00 0.00 C ATOM 354 CD1 LEU A 28 1.883 10.205 -4.966 1.00 0.00 C ATOM 355 CD2 LEU A 28 1.490 10.606 -2.532 1.00 0.00 C ATOM 0 H LEU A 28 3.488 13.381 -3.629 1.00 0.00 H new ATOM 0 HA LEU A 28 3.761 11.682 -1.478 1.00 0.00 H new ATOM 0 HB2 LEU A 28 4.316 11.159 -4.421 1.00 0.00 H new ATOM 0 HB3 LEU A 28 4.025 9.922 -3.215 1.00 0.00 H new ATOM 0 HG LEU A 28 2.035 12.083 -3.976 1.00 0.00 H new ATOM 0 HD11 LEU A 28 0.809 10.290 -5.133 1.00 0.00 H new ATOM 0 HD12 LEU A 28 2.417 10.563 -5.847 1.00 0.00 H new ATOM 0 HD13 LEU A 28 2.141 9.162 -4.784 1.00 0.00 H new ATOM 0 HD21 LEU A 28 0.422 10.680 -2.738 1.00 0.00 H new ATOM 0 HD22 LEU A 28 1.742 9.574 -2.286 1.00 0.00 H new ATOM 0 HD23 LEU A 28 1.742 11.251 -1.691 1.00 0.00 H new ATOM 367 N GLN A 29 6.636 12.213 -2.985 1.00 0.00 N ATOM 368 CA GLN A 29 8.082 12.076 -2.828 1.00 0.00 C ATOM 369 C GLN A 29 8.574 12.852 -1.607 1.00 0.00 C ATOM 370 O GLN A 29 9.389 12.353 -0.831 1.00 0.00 O ATOM 371 CB GLN A 29 8.798 12.568 -4.089 1.00 0.00 C ATOM 372 CG GLN A 29 10.313 12.469 -4.008 1.00 0.00 C ATOM 373 CD GLN A 29 11.008 12.913 -5.285 1.00 0.00 C ATOM 374 OE1 GLN A 29 12.237 12.931 -5.356 1.00 0.00 O ATOM 375 NE2 GLN A 29 10.230 13.270 -6.302 1.00 0.00 N ATOM 0 H GLN A 29 6.351 12.768 -3.792 1.00 0.00 H new ATOM 0 HA GLN A 29 8.311 11.021 -2.677 1.00 0.00 H new ATOM 0 HB2 GLN A 29 8.450 11.988 -4.944 1.00 0.00 H new ATOM 0 HB3 GLN A 29 8.520 13.606 -4.273 1.00 0.00 H new ATOM 0 HG2 GLN A 29 10.667 13.079 -3.177 1.00 0.00 H new ATOM 0 HG3 GLN A 29 10.593 11.439 -3.788 1.00 0.00 H new ATOM 0 HE21 GLN A 29 9.215 13.241 -6.203 1.00 0.00 H new ATOM 0 HE22 GLN A 29 10.648 13.573 -7.182 1.00 0.00 H new ATOM 384 N VAL A 30 8.075 14.076 -1.445 1.00 0.00 N ATOM 385 CA VAL A 30 8.464 14.925 -0.321 1.00 0.00 C ATOM 386 C VAL A 30 8.058 14.305 1.015 1.00 0.00 C ATOM 387 O VAL A 30 8.886 14.140 1.909 1.00 0.00 O ATOM 388 CB VAL A 30 7.836 16.329 -0.442 1.00 0.00 C ATOM 389 CG1 VAL A 30 8.121 17.164 0.797 1.00 0.00 C ATOM 390 CG2 VAL A 30 8.350 17.033 -1.688 1.00 0.00 C ATOM 0 H VAL A 30 7.399 14.502 -2.079 1.00 0.00 H new ATOM 0 HA VAL A 30 9.550 15.014 -0.352 1.00 0.00 H new ATOM 0 HB VAL A 30 6.756 16.211 -0.527 1.00 0.00 H new ATOM 0 HG11 VAL A 30 7.667 18.148 0.685 1.00 0.00 H new ATOM 0 HG12 VAL A 30 7.702 16.669 1.673 1.00 0.00 H new ATOM 0 HG13 VAL A 30 9.198 17.274 0.922 1.00 0.00 H new ATOM 0 HG21 VAL A 30 7.898 18.022 -1.760 1.00 0.00 H new ATOM 0 HG22 VAL A 30 9.434 17.133 -1.629 1.00 0.00 H new ATOM 0 HG23 VAL A 30 8.087 16.449 -2.570 1.00 0.00 H new ATOM 400 N HIS A 31 6.780 13.964 1.139 1.00 0.00 N ATOM 401 CA HIS A 31 6.258 13.364 2.361 1.00 0.00 C ATOM 402 C HIS A 31 6.994 12.070 2.687 1.00 0.00 C ATOM 403 O HIS A 31 7.347 11.819 3.837 1.00 0.00 O ATOM 404 CB HIS A 31 4.760 13.081 2.219 1.00 0.00 C ATOM 405 CG HIS A 31 3.934 14.306 1.969 1.00 0.00 C ATOM 406 ND1 HIS A 31 3.920 15.393 2.818 1.00 0.00 N ATOM 407 CD2 HIS A 31 3.082 14.609 0.959 1.00 0.00 C ATOM 408 CE1 HIS A 31 3.097 16.311 2.341 1.00 0.00 C ATOM 409 NE2 HIS A 31 2.577 15.859 1.216 1.00 0.00 N ATOM 0 H HIS A 31 6.084 14.094 0.405 1.00 0.00 H new ATOM 0 HA HIS A 31 6.414 14.071 3.176 1.00 0.00 H new ATOM 0 HB2 HIS A 31 4.609 12.379 1.399 1.00 0.00 H new ATOM 0 HB3 HIS A 31 4.404 12.593 3.127 1.00 0.00 H new ATOM 0 HD2 HIS A 31 2.845 13.984 0.111 1.00 0.00 H new ATOM 0 HE1 HIS A 31 2.886 17.268 2.795 1.00 0.00 H new ATOM 0 HE2 HIS A 31 1.907 16.358 0.631 1.00 0.00 H new ATOM 418 N LEU A 32 7.216 11.249 1.664 1.00 0.00 N ATOM 419 CA LEU A 32 7.906 9.976 1.844 1.00 0.00 C ATOM 420 C LEU A 32 9.300 10.180 2.432 1.00 0.00 C ATOM 421 O LEU A 32 9.665 9.537 3.414 1.00 0.00 O ATOM 422 CB LEU A 32 8.006 9.239 0.504 1.00 0.00 C ATOM 423 CG LEU A 32 8.678 7.864 0.563 1.00 0.00 C ATOM 424 CD1 LEU A 32 7.906 6.928 1.480 1.00 0.00 C ATOM 425 CD2 LEU A 32 8.790 7.268 -0.831 1.00 0.00 C ATOM 0 H LEU A 32 6.929 11.442 0.705 1.00 0.00 H new ATOM 0 HA LEU A 32 7.327 9.375 2.545 1.00 0.00 H new ATOM 0 HB2 LEU A 32 7.001 9.117 0.099 1.00 0.00 H new ATOM 0 HB3 LEU A 32 8.558 9.866 -0.196 1.00 0.00 H new ATOM 0 HG LEU A 32 9.682 7.990 0.969 1.00 0.00 H new ATOM 0 HD11 LEU A 32 8.400 5.957 1.508 1.00 0.00 H new ATOM 0 HD12 LEU A 32 7.874 7.348 2.485 1.00 0.00 H new ATOM 0 HD13 LEU A 32 6.890 6.808 1.105 1.00 0.00 H new ATOM 0 HD21 LEU A 32 9.270 6.291 -0.772 1.00 0.00 H new ATOM 0 HD22 LEU A 32 7.794 7.158 -1.261 1.00 0.00 H new ATOM 0 HD23 LEU A 32 9.386 7.927 -1.462 1.00 0.00 H new ATOM 437 N LEU A 33 10.075 11.073 1.826 1.00 0.00 N ATOM 438 CA LEU A 33 11.434 11.355 2.288 1.00 0.00 C ATOM 439 C LEU A 33 11.451 11.886 3.719 1.00 0.00 C ATOM 440 O LEU A 33 12.267 11.460 4.537 1.00 0.00 O ATOM 441 CB LEU A 33 12.109 12.363 1.355 1.00 0.00 C ATOM 442 CG LEU A 33 12.405 11.848 -0.054 1.00 0.00 C ATOM 443 CD1 LEU A 33 12.924 12.972 -0.936 1.00 0.00 C ATOM 444 CD2 LEU A 33 13.412 10.707 0.000 1.00 0.00 C ATOM 0 H LEU A 33 9.787 11.616 1.012 1.00 0.00 H new ATOM 0 HA LEU A 33 11.985 10.415 2.274 1.00 0.00 H new ATOM 0 HB2 LEU A 33 11.472 13.244 1.276 1.00 0.00 H new ATOM 0 HB3 LEU A 33 13.045 12.686 1.811 1.00 0.00 H new ATOM 0 HG LEU A 33 11.477 11.473 -0.486 1.00 0.00 H new ATOM 0 HD11 LEU A 33 13.129 12.586 -1.935 1.00 0.00 H new ATOM 0 HD12 LEU A 33 12.174 13.761 -0.999 1.00 0.00 H new ATOM 0 HD13 LEU A 33 13.841 13.376 -0.508 1.00 0.00 H new ATOM 0 HD21 LEU A 33 13.613 10.351 -1.010 1.00 0.00 H new ATOM 0 HD22 LEU A 33 14.339 11.061 0.451 1.00 0.00 H new ATOM 0 HD23 LEU A 33 13.006 9.891 0.598 1.00 0.00 H new ATOM 456 N GLU A 34 10.563 12.829 4.008 1.00 0.00 N ATOM 457 CA GLU A 34 10.491 13.437 5.334 1.00 0.00 C ATOM 458 C GLU A 34 10.122 12.421 6.415 1.00 0.00 C ATOM 459 O GLU A 34 10.764 12.364 7.465 1.00 0.00 O ATOM 460 CB GLU A 34 9.476 14.581 5.333 1.00 0.00 C ATOM 461 CG GLU A 34 9.838 15.714 4.388 1.00 0.00 C ATOM 462 CD GLU A 34 11.162 16.367 4.741 1.00 0.00 C ATOM 463 OE1 GLU A 34 11.284 16.890 5.869 1.00 0.00 O ATOM 464 OE2 GLU A 34 12.075 16.354 3.890 1.00 0.00 O ATOM 0 H GLU A 34 9.881 13.191 3.342 1.00 0.00 H new ATOM 0 HA GLU A 34 11.483 13.823 5.568 1.00 0.00 H new ATOM 0 HB2 GLU A 34 8.498 14.187 5.057 1.00 0.00 H new ATOM 0 HB3 GLU A 34 9.387 14.977 6.345 1.00 0.00 H new ATOM 0 HG2 GLU A 34 9.886 15.331 3.369 1.00 0.00 H new ATOM 0 HG3 GLU A 34 9.049 16.466 4.409 1.00 0.00 H new ATOM 471 N ASN A 35 9.077 11.638 6.168 1.00 0.00 N ATOM 472 CA ASN A 35 8.617 10.646 7.139 1.00 0.00 C ATOM 473 C ASN A 35 9.496 9.394 7.148 1.00 0.00 C ATOM 474 O ASN A 35 8.994 8.282 7.317 1.00 0.00 O ATOM 475 CB ASN A 35 7.165 10.258 6.852 1.00 0.00 C ATOM 476 CG ASN A 35 6.218 11.437 6.955 1.00 0.00 C ATOM 477 OD1 ASN A 35 6.121 12.082 7.999 1.00 0.00 O ATOM 478 ND2 ASN A 35 5.508 11.722 5.869 1.00 0.00 N ATOM 0 H ASN A 35 8.532 11.669 5.306 1.00 0.00 H new ATOM 0 HA ASN A 35 8.687 11.105 8.125 1.00 0.00 H new ATOM 0 HB2 ASN A 35 7.098 9.828 5.852 1.00 0.00 H new ATOM 0 HB3 ASN A 35 6.854 9.484 7.553 1.00 0.00 H new ATOM 0 HD21 ASN A 35 4.851 12.502 5.879 1.00 0.00 H new ATOM 0 HD22 ASN A 35 5.620 11.161 5.025 1.00 0.00 H new ATOM 485 N ASN A 36 10.805 9.577 6.983 1.00 0.00 N ATOM 486 CA ASN A 36 11.746 8.457 6.990 1.00 0.00 C ATOM 487 C ASN A 36 11.264 7.327 6.080 1.00 0.00 C ATOM 488 O ASN A 36 11.239 6.163 6.476 1.00 0.00 O ATOM 489 CB ASN A 36 11.935 7.938 8.421 1.00 0.00 C ATOM 490 CG ASN A 36 13.045 6.905 8.542 1.00 0.00 C ATOM 491 OD1 ASN A 36 13.277 6.358 9.620 1.00 0.00 O ATOM 492 ND2 ASN A 36 13.742 6.635 7.443 1.00 0.00 N ATOM 0 H ASN A 36 11.238 10.490 6.843 1.00 0.00 H new ATOM 0 HA ASN A 36 12.703 8.814 6.609 1.00 0.00 H new ATOM 0 HB2 ASN A 36 12.156 8.778 9.079 1.00 0.00 H new ATOM 0 HB3 ASN A 36 11.000 7.499 8.768 1.00 0.00 H new ATOM 0 HD21 ASN A 36 14.500 5.953 7.474 1.00 0.00 H new ATOM 0 HD22 ASN A 36 13.519 7.110 6.568 1.00 0.00 H new ATOM 499 N ASN A 37 10.882 7.690 4.858 1.00 0.00 N ATOM 500 CA ASN A 37 10.391 6.731 3.864 1.00 0.00 C ATOM 501 C ASN A 37 9.445 5.700 4.480 1.00 0.00 C ATOM 502 O ASN A 37 9.498 4.516 4.144 1.00 0.00 O ATOM 503 CB ASN A 37 11.553 6.031 3.145 1.00 0.00 C ATOM 504 CG ASN A 37 12.497 5.302 4.082 1.00 0.00 C ATOM 505 OD1 ASN A 37 13.247 5.920 4.837 1.00 0.00 O ATOM 506 ND2 ASN A 37 12.463 3.975 4.037 1.00 0.00 N ATOM 0 H ASN A 37 10.903 8.654 4.527 1.00 0.00 H new ATOM 0 HA ASN A 37 9.824 7.302 3.129 1.00 0.00 H new ATOM 0 HB2 ASN A 37 11.148 5.320 2.425 1.00 0.00 H new ATOM 0 HB3 ASN A 37 12.117 6.772 2.578 1.00 0.00 H new ATOM 0 HD21 ASN A 37 13.074 3.428 4.644 1.00 0.00 H new ATOM 0 HD22 ASN A 37 11.826 3.503 3.396 1.00 0.00 H new ATOM 513 N ASP A 38 8.566 6.159 5.368 1.00 0.00 N ATOM 514 CA ASP A 38 7.593 5.278 6.010 1.00 0.00 C ATOM 515 C ASP A 38 6.264 5.313 5.262 1.00 0.00 C ATOM 516 O ASP A 38 5.715 6.384 5.006 1.00 0.00 O ATOM 517 CB ASP A 38 7.377 5.683 7.471 1.00 0.00 C ATOM 518 CG ASP A 38 8.588 5.412 8.341 1.00 0.00 C ATOM 519 OD1 ASP A 38 9.559 4.810 7.839 1.00 0.00 O ATOM 520 OD2 ASP A 38 8.558 5.788 9.532 1.00 0.00 O ATOM 0 H ASP A 38 8.507 7.135 5.659 1.00 0.00 H new ATOM 0 HA ASP A 38 7.988 4.262 5.982 1.00 0.00 H new ATOM 0 HB2 ASP A 38 7.133 6.744 7.517 1.00 0.00 H new ATOM 0 HB3 ASP A 38 6.520 5.141 7.871 1.00 0.00 H new ATOM 525 N LEU A 39 5.749 4.138 4.913 1.00 0.00 N ATOM 526 CA LEU A 39 4.483 4.046 4.193 1.00 0.00 C ATOM 527 C LEU A 39 3.293 4.248 5.126 1.00 0.00 C ATOM 528 O LEU A 39 2.395 5.034 4.835 1.00 0.00 O ATOM 529 CB LEU A 39 4.362 2.692 3.487 1.00 0.00 C ATOM 530 CG LEU A 39 5.356 2.459 2.348 1.00 0.00 C ATOM 531 CD1 LEU A 39 5.154 1.077 1.745 1.00 0.00 C ATOM 532 CD2 LEU A 39 5.206 3.533 1.279 1.00 0.00 C ATOM 0 H LEU A 39 6.187 3.239 5.116 1.00 0.00 H new ATOM 0 HA LEU A 39 4.473 4.842 3.448 1.00 0.00 H new ATOM 0 HB2 LEU A 39 4.490 1.902 4.227 1.00 0.00 H new ATOM 0 HB3 LEU A 39 3.351 2.596 3.091 1.00 0.00 H new ATOM 0 HG LEU A 39 6.366 2.517 2.754 1.00 0.00 H new ATOM 0 HD11 LEU A 39 5.868 0.925 0.936 1.00 0.00 H new ATOM 0 HD12 LEU A 39 5.309 0.319 2.513 1.00 0.00 H new ATOM 0 HD13 LEU A 39 4.140 0.995 1.354 1.00 0.00 H new ATOM 0 HD21 LEU A 39 5.921 3.351 0.477 1.00 0.00 H new ATOM 0 HD22 LEU A 39 4.194 3.506 0.876 1.00 0.00 H new ATOM 0 HD23 LEU A 39 5.395 4.512 1.718 1.00 0.00 H new ATOM 544 N ASP A 40 3.288 3.527 6.241 1.00 0.00 N ATOM 545 CA ASP A 40 2.197 3.621 7.208 1.00 0.00 C ATOM 546 C ASP A 40 2.039 5.045 7.739 1.00 0.00 C ATOM 547 O ASP A 40 0.923 5.551 7.853 1.00 0.00 O ATOM 548 CB ASP A 40 2.432 2.655 8.369 1.00 0.00 C ATOM 549 CG ASP A 40 3.726 2.938 9.109 1.00 0.00 C ATOM 550 OD1 ASP A 40 4.799 2.879 8.473 1.00 0.00 O ATOM 551 OD2 ASP A 40 3.664 3.221 10.324 1.00 0.00 O ATOM 0 H ASP A 40 4.025 2.871 6.499 1.00 0.00 H new ATOM 0 HA ASP A 40 1.276 3.349 6.693 1.00 0.00 H new ATOM 0 HB2 ASP A 40 1.597 2.721 9.066 1.00 0.00 H new ATOM 0 HB3 ASP A 40 2.451 1.634 7.989 1.00 0.00 H new ATOM 556 N LEU A 41 3.156 5.680 8.073 1.00 0.00 N ATOM 557 CA LEU A 41 3.134 7.040 8.602 1.00 0.00 C ATOM 558 C LEU A 41 2.681 8.035 7.534 1.00 0.00 C ATOM 559 O LEU A 41 1.681 8.739 7.708 1.00 0.00 O ATOM 560 CB LEU A 41 4.528 7.421 9.118 1.00 0.00 C ATOM 561 CG LEU A 41 4.571 8.556 10.150 1.00 0.00 C ATOM 562 CD1 LEU A 41 5.993 8.774 10.640 1.00 0.00 C ATOM 563 CD2 LEU A 41 4.010 9.845 9.567 1.00 0.00 C ATOM 0 H LEU A 41 4.089 5.276 7.987 1.00 0.00 H new ATOM 0 HA LEU A 41 2.421 7.077 9.426 1.00 0.00 H new ATOM 0 HB2 LEU A 41 4.986 6.536 9.560 1.00 0.00 H new ATOM 0 HB3 LEU A 41 5.145 7.707 8.266 1.00 0.00 H new ATOM 0 HG LEU A 41 3.949 8.266 10.997 1.00 0.00 H new ATOM 0 HD11 LEU A 41 6.006 9.582 11.371 1.00 0.00 H new ATOM 0 HD12 LEU A 41 6.362 7.859 11.104 1.00 0.00 H new ATOM 0 HD13 LEU A 41 6.632 9.037 9.797 1.00 0.00 H new ATOM 0 HD21 LEU A 41 4.052 10.633 10.319 1.00 0.00 H new ATOM 0 HD22 LEU A 41 4.601 10.139 8.699 1.00 0.00 H new ATOM 0 HD23 LEU A 41 2.975 9.687 9.264 1.00 0.00 H new ATOM 575 N THR A 42 3.425 8.091 6.433 1.00 0.00 N ATOM 576 CA THR A 42 3.109 9.006 5.343 1.00 0.00 C ATOM 577 C THR A 42 1.691 8.789 4.831 1.00 0.00 C ATOM 578 O THR A 42 0.846 9.675 4.930 1.00 0.00 O ATOM 579 CB THR A 42 4.094 8.846 4.168 1.00 0.00 C ATOM 580 OG1 THR A 42 5.434 9.080 4.618 1.00 0.00 O ATOM 581 CG2 THR A 42 3.758 9.811 3.041 1.00 0.00 C ATOM 0 H THR A 42 4.250 7.513 6.273 1.00 0.00 H new ATOM 0 HA THR A 42 3.196 10.014 5.748 1.00 0.00 H new ATOM 0 HB THR A 42 4.009 7.828 3.789 1.00 0.00 H new ATOM 0 HG1 THR A 42 5.857 8.225 4.844 1.00 0.00 H new ATOM 0 HG21 THR A 42 4.468 9.678 2.224 1.00 0.00 H new ATOM 0 HG22 THR A 42 2.749 9.612 2.681 1.00 0.00 H new ATOM 0 HG23 THR A 42 3.817 10.835 3.409 1.00 0.00 H new ATOM 589 N ILE A 43 1.436 7.603 4.289 1.00 0.00 N ATOM 590 CA ILE A 43 0.119 7.274 3.762 1.00 0.00 C ATOM 591 C ILE A 43 -0.962 7.457 4.821 1.00 0.00 C ATOM 592 O ILE A 43 -2.061 7.923 4.522 1.00 0.00 O ATOM 593 CB ILE A 43 0.067 5.832 3.227 1.00 0.00 C ATOM 594 CG1 ILE A 43 1.091 5.647 2.106 1.00 0.00 C ATOM 595 CG2 ILE A 43 -1.332 5.504 2.736 1.00 0.00 C ATOM 596 CD1 ILE A 43 1.130 4.242 1.541 1.00 0.00 C ATOM 0 H ILE A 43 2.124 6.855 4.204 1.00 0.00 H new ATOM 0 HA ILE A 43 -0.069 7.961 2.937 1.00 0.00 H new ATOM 0 HB ILE A 43 0.316 5.146 4.037 1.00 0.00 H new ATOM 0 HG12 ILE A 43 0.865 6.346 1.301 1.00 0.00 H new ATOM 0 HG13 ILE A 43 2.080 5.904 2.484 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -1.355 4.481 2.360 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -2.039 5.604 3.559 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -1.607 6.191 1.936 1.00 0.00 H new ATOM 0 HD11 ILE A 43 1.879 4.188 0.751 1.00 0.00 H new ATOM 0 HD12 ILE A 43 1.386 3.538 2.333 1.00 0.00 H new ATOM 0 HD13 ILE A 43 0.152 3.987 1.132 1.00 0.00 H new ATOM 608 N GLY A 44 -0.643 7.089 6.059 1.00 0.00 N ATOM 609 CA GLY A 44 -1.603 7.227 7.139 1.00 0.00 C ATOM 610 C GLY A 44 -2.155 8.635 7.233 1.00 0.00 C ATOM 611 O GLY A 44 -3.367 8.829 7.330 1.00 0.00 O ATOM 0 H GLY A 44 0.259 6.699 6.332 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -2.423 6.526 6.986 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -1.127 6.961 8.083 1.00 0.00 H new ATOM 615 N LEU A 45 -1.262 9.618 7.194 1.00 0.00 N ATOM 616 CA LEU A 45 -1.662 11.019 7.264 1.00 0.00 C ATOM 617 C LEU A 45 -2.391 11.433 5.986 1.00 0.00 C ATOM 618 O LEU A 45 -3.363 12.188 6.031 1.00 0.00 O ATOM 619 CB LEU A 45 -0.426 11.904 7.497 1.00 0.00 C ATOM 620 CG LEU A 45 -0.696 13.384 7.812 1.00 0.00 C ATOM 621 CD1 LEU A 45 -1.159 14.138 6.574 1.00 0.00 C ATOM 622 CD2 LEU A 45 -1.721 13.517 8.929 1.00 0.00 C ATOM 0 H LEU A 45 -0.256 9.471 7.114 1.00 0.00 H new ATOM 0 HA LEU A 45 -2.348 11.149 8.101 1.00 0.00 H new ATOM 0 HB2 LEU A 45 0.149 11.479 8.320 1.00 0.00 H new ATOM 0 HB3 LEU A 45 0.203 11.853 6.609 1.00 0.00 H new ATOM 0 HG LEU A 45 0.242 13.828 8.145 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -1.341 15.182 6.831 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -0.389 14.083 5.805 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -2.079 13.691 6.198 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -1.898 14.572 9.137 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -2.655 13.046 8.624 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -1.345 13.028 9.828 1.00 0.00 H new ATOM 634 N LEU A 46 -1.911 10.936 4.848 1.00 0.00 N ATOM 635 CA LEU A 46 -2.507 11.255 3.551 1.00 0.00 C ATOM 636 C LEU A 46 -3.999 10.926 3.514 1.00 0.00 C ATOM 637 O LEU A 46 -4.801 11.732 3.040 1.00 0.00 O ATOM 638 CB LEU A 46 -1.776 10.509 2.431 1.00 0.00 C ATOM 639 CG LEU A 46 -0.587 11.250 1.805 1.00 0.00 C ATOM 640 CD1 LEU A 46 -1.065 12.467 1.034 1.00 0.00 C ATOM 641 CD2 LEU A 46 0.423 11.666 2.863 1.00 0.00 C ATOM 0 H LEU A 46 -1.108 10.309 4.797 1.00 0.00 H new ATOM 0 HA LEU A 46 -2.400 12.329 3.398 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -1.421 9.557 2.825 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -2.494 10.280 1.643 1.00 0.00 H new ATOM 0 HG LEU A 46 -0.094 10.564 1.116 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -0.209 12.980 0.597 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -1.743 12.152 0.241 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -1.587 13.144 1.710 1.00 0.00 H new ATOM 0 HD21 LEU A 46 1.253 12.189 2.388 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -0.057 12.328 3.584 1.00 0.00 H new ATOM 0 HD23 LEU A 46 0.798 10.781 3.376 1.00 0.00 H new ATOM 653 N LEU A 47 -4.372 9.749 4.011 1.00 0.00 N ATOM 654 CA LEU A 47 -5.777 9.343 4.023 1.00 0.00 C ATOM 655 C LEU A 47 -6.621 10.377 4.766 1.00 0.00 C ATOM 656 O LEU A 47 -7.771 10.631 4.412 1.00 0.00 O ATOM 657 CB LEU A 47 -5.943 7.974 4.684 1.00 0.00 C ATOM 658 CG LEU A 47 -5.116 6.846 4.065 1.00 0.00 C ATOM 659 CD1 LEU A 47 -5.365 5.539 4.801 1.00 0.00 C ATOM 660 CD2 LEU A 47 -5.437 6.695 2.584 1.00 0.00 C ATOM 0 H LEU A 47 -3.728 9.064 4.408 1.00 0.00 H new ATOM 0 HA LEU A 47 -6.117 9.276 2.990 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -5.676 8.062 5.737 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -6.996 7.695 4.644 1.00 0.00 H new ATOM 0 HG LEU A 47 -4.061 7.101 4.162 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -4.769 4.747 4.348 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -5.083 5.652 5.848 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -6.422 5.280 4.736 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -4.838 5.888 2.162 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -6.495 6.464 2.463 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -5.208 7.626 2.065 1.00 0.00 H new ATOM 672 N LYS A 48 -6.034 10.959 5.809 1.00 0.00 N ATOM 673 CA LYS A 48 -6.709 11.957 6.626 1.00 0.00 C ATOM 674 C LYS A 48 -6.972 13.247 5.846 1.00 0.00 C ATOM 675 O LYS A 48 -7.956 13.942 6.102 1.00 0.00 O ATOM 676 CB LYS A 48 -5.864 12.260 7.865 1.00 0.00 C ATOM 677 CG LYS A 48 -6.491 13.283 8.793 1.00 0.00 C ATOM 678 CD LYS A 48 -7.768 12.753 9.428 1.00 0.00 C ATOM 679 CE LYS A 48 -8.397 13.780 10.355 1.00 0.00 C ATOM 680 NZ LYS A 48 -9.652 13.273 10.976 1.00 0.00 N ATOM 0 H LYS A 48 -5.081 10.751 6.108 1.00 0.00 H new ATOM 0 HA LYS A 48 -7.675 11.550 6.925 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -5.699 11.335 8.417 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -4.886 12.621 7.548 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -5.780 13.551 9.574 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -6.711 14.194 8.236 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -8.479 12.483 8.647 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -7.547 11.844 9.987 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -7.686 14.046 11.138 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -8.611 14.691 9.796 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -10.050 14.003 11.601 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -10.340 13.043 10.231 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -9.444 12.418 11.531 1.00 0.00 H new ATOM 694 N GLU A 49 -6.080 13.569 4.911 1.00 0.00 N ATOM 695 CA GLU A 49 -6.205 14.787 4.107 1.00 0.00 C ATOM 696 C GLU A 49 -7.625 14.972 3.579 1.00 0.00 C ATOM 697 O GLU A 49 -8.218 16.041 3.736 1.00 0.00 O ATOM 698 CB GLU A 49 -5.220 14.752 2.936 1.00 0.00 C ATOM 699 CG GLU A 49 -3.761 14.743 3.364 1.00 0.00 C ATOM 700 CD GLU A 49 -3.334 16.040 4.026 1.00 0.00 C ATOM 701 OE1 GLU A 49 -4.169 16.963 4.123 1.00 0.00 O ATOM 702 OE2 GLU A 49 -2.161 16.134 4.442 1.00 0.00 O ATOM 0 H GLU A 49 -5.261 13.003 4.690 1.00 0.00 H new ATOM 0 HA GLU A 49 -5.973 15.632 4.755 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -5.418 13.866 2.333 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -5.397 15.618 2.298 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -3.595 13.916 4.055 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -3.133 14.561 2.492 1.00 0.00 H new ATOM 709 N ASN A 50 -8.166 13.932 2.956 1.00 0.00 N ATOM 710 CA ASN A 50 -9.519 13.988 2.410 1.00 0.00 C ATOM 711 C ASN A 50 -10.558 14.034 3.535 1.00 0.00 C ATOM 712 O ASN A 50 -10.413 14.811 4.479 1.00 0.00 O ATOM 713 CB ASN A 50 -9.766 12.795 1.481 1.00 0.00 C ATOM 714 CG ASN A 50 -9.428 11.470 2.134 1.00 0.00 C ATOM 715 OD1 ASN A 50 -10.002 11.104 3.157 1.00 0.00 O ATOM 716 ND2 ASN A 50 -8.488 10.741 1.541 1.00 0.00 N ATOM 0 H ASN A 50 -7.691 13.041 2.816 1.00 0.00 H new ATOM 0 HA ASN A 50 -9.620 14.903 1.826 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -10.812 12.788 1.174 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -9.169 12.913 0.577 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -8.218 9.840 1.934 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -8.037 11.083 0.693 1.00 0.00 H new ATOM 723 N ASP A 51 -11.604 13.207 3.428 1.00 0.00 N ATOM 724 CA ASP A 51 -12.665 13.160 4.438 1.00 0.00 C ATOM 725 C ASP A 51 -13.551 14.405 4.392 1.00 0.00 C ATOM 726 O ASP A 51 -14.700 14.369 4.830 1.00 0.00 O ATOM 727 CB ASP A 51 -12.080 12.989 5.843 1.00 0.00 C ATOM 728 CG ASP A 51 -11.469 11.617 6.060 1.00 0.00 C ATOM 729 OD1 ASP A 51 -11.574 10.767 5.151 1.00 0.00 O ATOM 730 OD2 ASP A 51 -10.895 11.389 7.145 1.00 0.00 O ATOM 0 H ASP A 51 -11.738 12.561 2.650 1.00 0.00 H new ATOM 0 HA ASP A 51 -13.285 12.294 4.205 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -11.319 13.752 6.011 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -12.865 13.154 6.581 1.00 0.00 H new ATOM 735 N ASP A 52 -13.012 15.507 3.878 1.00 0.00 N ATOM 736 CA ASP A 52 -13.762 16.756 3.791 1.00 0.00 C ATOM 737 C ASP A 52 -14.671 16.778 2.564 1.00 0.00 C ATOM 738 O ASP A 52 -14.253 16.417 1.463 1.00 0.00 O ATOM 739 CB ASP A 52 -12.804 17.947 3.744 1.00 0.00 C ATOM 740 CG ASP A 52 -11.914 18.025 4.969 1.00 0.00 C ATOM 741 OD1 ASP A 52 -12.455 18.143 6.088 1.00 0.00 O ATOM 742 OD2 ASP A 52 -10.677 17.968 4.809 1.00 0.00 O ATOM 0 H ASP A 52 -12.060 15.560 3.516 1.00 0.00 H new ATOM 0 HA ASP A 52 -14.388 16.828 4.680 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -12.183 17.874 2.851 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -13.379 18.869 3.658 1.00 0.00 H new ATOM 747 N LYS A 53 -15.910 17.226 2.761 1.00 0.00 N ATOM 748 CA LYS A 53 -16.880 17.322 1.672 1.00 0.00 C ATOM 749 C LYS A 53 -18.118 18.098 2.118 1.00 0.00 C ATOM 750 O LYS A 53 -18.629 18.943 1.383 1.00 0.00 O ATOM 751 CB LYS A 53 -17.291 15.933 1.157 1.00 0.00 C ATOM 752 CG LYS A 53 -18.067 15.091 2.161 1.00 0.00 C ATOM 753 CD LYS A 53 -17.158 14.469 3.211 1.00 0.00 C ATOM 754 CE LYS A 53 -16.383 13.280 2.656 1.00 0.00 C ATOM 755 NZ LYS A 53 -15.472 13.666 1.543 1.00 0.00 N ATOM 0 H LYS A 53 -16.266 17.529 3.667 1.00 0.00 H new ATOM 0 HA LYS A 53 -16.398 17.859 0.855 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -17.898 16.057 0.260 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -16.394 15.389 0.862 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -18.816 15.712 2.653 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -18.604 14.302 1.634 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -16.458 15.220 3.577 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -17.755 14.147 4.064 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -15.801 12.823 3.457 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -17.085 12.525 2.302 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -14.664 13.011 1.512 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -15.988 13.622 0.641 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -15.127 14.635 1.697 1.00 0.00 H new ATOM 769 N SER A 54 -18.595 17.807 3.325 1.00 0.00 N ATOM 770 CA SER A 54 -19.770 18.479 3.866 1.00 0.00 C ATOM 771 C SER A 54 -19.513 19.973 4.033 1.00 0.00 C ATOM 772 O SER A 54 -20.332 20.773 3.533 1.00 0.00 O ATOM 773 CB SER A 54 -20.162 17.864 5.210 1.00 0.00 C ATOM 774 OG SER A 54 -19.119 18.006 6.160 1.00 0.00 O ATOM 775 OXT SER A 54 -18.496 20.331 4.663 1.00 0.00 O ATOM 0 H SER A 54 -18.185 17.110 3.946 1.00 0.00 H new ATOM 0 HA SER A 54 -20.590 18.346 3.161 1.00 0.00 H new ATOM 0 HB2 SER A 54 -21.066 18.345 5.583 1.00 0.00 H new ATOM 0 HB3 SER A 54 -20.395 16.808 5.076 1.00 0.00 H new ATOM 0 HG SER A 54 -18.523 18.733 5.885 1.00 0.00 H new TER 781 SER A 54 ATOM 782 N MET B 1 -17.051 -10.898 -9.692 1.00 0.00 N ATOM 783 CA MET B 1 -15.805 -10.409 -10.337 1.00 0.00 C ATOM 784 C MET B 1 -14.643 -10.376 -9.347 1.00 0.00 C ATOM 785 O MET B 1 -14.807 -9.982 -8.191 1.00 0.00 O ATOM 786 CB MET B 1 -16.058 -9.009 -10.905 1.00 0.00 C ATOM 787 CG MET B 1 -16.457 -7.986 -9.856 1.00 0.00 C ATOM 788 SD MET B 1 -16.721 -6.344 -10.555 1.00 0.00 S ATOM 789 CE MET B 1 -17.144 -5.412 -9.087 1.00 0.00 C ATOM 0 H1 MET B 1 -17.858 -10.735 -10.328 1.00 0.00 H new ATOM 0 H2 MET B 1 -16.964 -11.916 -9.496 1.00 0.00 H new ATOM 0 H3 MET B 1 -17.204 -10.386 -8.800 1.00 0.00 H new ATOM 0 HA MET B 1 -15.531 -11.093 -11.140 1.00 0.00 H new ATOM 0 HB2 MET B 1 -15.157 -8.664 -11.411 1.00 0.00 H new ATOM 0 HB3 MET B 1 -16.844 -9.069 -11.658 1.00 0.00 H new ATOM 0 HG2 MET B 1 -17.369 -8.317 -9.360 1.00 0.00 H new ATOM 0 HG3 MET B 1 -15.681 -7.932 -9.093 1.00 0.00 H new ATOM 0 HE1 MET B 1 -17.790 -4.577 -9.360 1.00 0.00 H new ATOM 0 HE2 MET B 1 -17.666 -6.060 -8.383 1.00 0.00 H new ATOM 0 HE3 MET B 1 -16.234 -5.031 -8.623 1.00 0.00 H new ATOM 801 N GLN B 2 -13.471 -10.797 -9.810 1.00 0.00 N ATOM 802 CA GLN B 2 -12.276 -10.818 -8.974 1.00 0.00 C ATOM 803 C GLN B 2 -11.763 -9.404 -8.715 1.00 0.00 C ATOM 804 O GLN B 2 -11.876 -8.526 -9.570 1.00 0.00 O ATOM 805 CB GLN B 2 -11.168 -11.661 -9.619 1.00 0.00 C ATOM 806 CG GLN B 2 -10.792 -11.219 -11.026 1.00 0.00 C ATOM 807 CD GLN B 2 -11.764 -11.707 -12.090 1.00 0.00 C ATOM 808 OE1 GLN B 2 -11.679 -11.302 -13.249 1.00 0.00 O ATOM 809 NE2 GLN B 2 -12.677 -12.597 -11.710 1.00 0.00 N ATOM 0 H GLN B 2 -13.323 -11.129 -10.763 1.00 0.00 H new ATOM 0 HA GLN B 2 -12.552 -11.270 -8.022 1.00 0.00 H new ATOM 0 HB2 GLN B 2 -10.281 -11.620 -8.987 1.00 0.00 H new ATOM 0 HB3 GLN B 2 -11.490 -12.702 -9.650 1.00 0.00 H new ATOM 0 HG2 GLN B 2 -10.746 -10.130 -11.057 1.00 0.00 H new ATOM 0 HG3 GLN B 2 -9.793 -11.587 -11.260 1.00 0.00 H new ATOM 0 HE21 GLN B 2 -12.714 -12.907 -10.739 1.00 0.00 H new ATOM 0 HE22 GLN B 2 -13.340 -12.969 -12.390 1.00 0.00 H new ATOM 818 N ILE B 3 -11.197 -9.195 -7.530 1.00 0.00 N ATOM 819 CA ILE B 3 -10.663 -7.891 -7.158 1.00 0.00 C ATOM 820 C ILE B 3 -9.249 -8.021 -6.602 1.00 0.00 C ATOM 821 O ILE B 3 -8.961 -8.923 -5.811 1.00 0.00 O ATOM 822 CB ILE B 3 -11.556 -7.191 -6.116 1.00 0.00 C ATOM 823 CG1 ILE B 3 -11.672 -8.044 -4.849 1.00 0.00 C ATOM 824 CG2 ILE B 3 -12.930 -6.917 -6.706 1.00 0.00 C ATOM 825 CD1 ILE B 3 -12.463 -7.381 -3.743 1.00 0.00 C ATOM 0 H ILE B 3 -11.097 -9.912 -6.812 1.00 0.00 H new ATOM 0 HA ILE B 3 -10.641 -7.285 -8.064 1.00 0.00 H new ATOM 0 HB ILE B 3 -11.098 -6.240 -5.844 1.00 0.00 H new ATOM 0 HG12 ILE B 3 -12.143 -8.994 -5.102 1.00 0.00 H new ATOM 0 HG13 ILE B 3 -10.671 -8.273 -4.482 1.00 0.00 H new ATOM 0 HG21 ILE B 3 -13.554 -6.422 -5.961 1.00 0.00 H new ATOM 0 HG22 ILE B 3 -12.829 -6.274 -7.580 1.00 0.00 H new ATOM 0 HG23 ILE B 3 -13.394 -7.858 -7.000 1.00 0.00 H new ATOM 0 HD11 ILE B 3 -12.504 -8.043 -2.878 1.00 0.00 H new ATOM 0 HD12 ILE B 3 -11.981 -6.445 -3.462 1.00 0.00 H new ATOM 0 HD13 ILE B 3 -13.475 -7.177 -4.092 1.00 0.00 H new ATOM 837 N PHE B 4 -8.367 -7.119 -7.030 1.00 0.00 N ATOM 838 CA PHE B 4 -6.978 -7.133 -6.585 1.00 0.00 C ATOM 839 C PHE B 4 -6.795 -6.330 -5.301 1.00 0.00 C ATOM 840 O PHE B 4 -7.467 -5.325 -5.078 1.00 0.00 O ATOM 841 CB PHE B 4 -6.050 -6.589 -7.678 1.00 0.00 C ATOM 842 CG PHE B 4 -5.928 -7.488 -8.880 1.00 0.00 C ATOM 843 CD1 PHE B 4 -7.053 -7.914 -9.571 1.00 0.00 C ATOM 844 CD2 PHE B 4 -4.681 -7.905 -9.320 1.00 0.00 C ATOM 845 CE1 PHE B 4 -6.936 -8.737 -10.674 1.00 0.00 C ATOM 846 CE2 PHE B 4 -4.558 -8.728 -10.424 1.00 0.00 C ATOM 847 CZ PHE B 4 -5.687 -9.144 -11.101 1.00 0.00 C ATOM 0 H PHE B 4 -8.592 -6.370 -7.685 1.00 0.00 H new ATOM 0 HA PHE B 4 -6.713 -8.170 -6.380 1.00 0.00 H new ATOM 0 HB2 PHE B 4 -6.418 -5.615 -8.001 1.00 0.00 H new ATOM 0 HB3 PHE B 4 -5.059 -6.431 -7.253 1.00 0.00 H new ATOM 0 HD1 PHE B 4 -8.032 -7.598 -9.242 1.00 0.00 H new ATOM 0 HD2 PHE B 4 -3.795 -7.583 -8.794 1.00 0.00 H new ATOM 0 HE1 PHE B 4 -7.820 -9.062 -11.202 1.00 0.00 H new ATOM 0 HE2 PHE B 4 -3.580 -9.045 -10.756 1.00 0.00 H new ATOM 0 HZ PHE B 4 -5.594 -9.787 -11.964 1.00 0.00 H new ATOM 857 N VAL B 5 -5.865 -6.787 -4.467 1.00 0.00 N ATOM 858 CA VAL B 5 -5.553 -6.133 -3.202 1.00 0.00 C ATOM 859 C VAL B 5 -4.066 -6.294 -2.905 1.00 0.00 C ATOM 860 O VAL B 5 -3.667 -7.147 -2.112 1.00 0.00 O ATOM 861 CB VAL B 5 -6.371 -6.723 -2.031 1.00 0.00 C ATOM 862 CG1 VAL B 5 -6.059 -5.993 -0.733 1.00 0.00 C ATOM 863 CG2 VAL B 5 -7.861 -6.670 -2.333 1.00 0.00 C ATOM 0 H VAL B 5 -5.307 -7.621 -4.650 1.00 0.00 H new ATOM 0 HA VAL B 5 -5.814 -5.079 -3.297 1.00 0.00 H new ATOM 0 HB VAL B 5 -6.085 -7.768 -1.911 1.00 0.00 H new ATOM 0 HG11 VAL B 5 -6.646 -6.425 0.078 1.00 0.00 H new ATOM 0 HG12 VAL B 5 -4.998 -6.093 -0.506 1.00 0.00 H new ATOM 0 HG13 VAL B 5 -6.310 -4.938 -0.840 1.00 0.00 H new ATOM 0 HG21 VAL B 5 -8.417 -7.090 -1.495 1.00 0.00 H new ATOM 0 HG22 VAL B 5 -8.164 -5.634 -2.487 1.00 0.00 H new ATOM 0 HG23 VAL B 5 -8.070 -7.247 -3.234 1.00 0.00 H new ATOM 873 N LYS B 6 -3.248 -5.489 -3.576 1.00 0.00 N ATOM 874 CA LYS B 6 -1.800 -5.564 -3.413 1.00 0.00 C ATOM 875 C LYS B 6 -1.327 -5.032 -2.071 1.00 0.00 C ATOM 876 O LYS B 6 -1.729 -3.956 -1.631 1.00 0.00 O ATOM 877 CB LYS B 6 -1.080 -4.804 -4.527 1.00 0.00 C ATOM 878 CG LYS B 6 0.426 -4.747 -4.314 1.00 0.00 C ATOM 879 CD LYS B 6 1.133 -3.953 -5.396 1.00 0.00 C ATOM 880 CE LYS B 6 2.610 -3.791 -5.072 1.00 0.00 C ATOM 881 NZ LYS B 6 3.357 -3.140 -6.182 1.00 0.00 N ATOM 0 H LYS B 6 -3.562 -4.778 -4.237 1.00 0.00 H new ATOM 0 HA LYS B 6 -1.552 -6.624 -3.464 1.00 0.00 H new ATOM 0 HB2 LYS B 6 -1.291 -5.282 -5.484 1.00 0.00 H new ATOM 0 HB3 LYS B 6 -1.474 -3.789 -4.584 1.00 0.00 H new ATOM 0 HG2 LYS B 6 0.636 -4.299 -3.343 1.00 0.00 H new ATOM 0 HG3 LYS B 6 0.826 -5.761 -4.291 1.00 0.00 H new ATOM 0 HD2 LYS B 6 1.020 -4.458 -6.356 1.00 0.00 H new ATOM 0 HD3 LYS B 6 0.668 -2.972 -5.495 1.00 0.00 H new ATOM 0 HE2 LYS B 6 2.719 -3.197 -4.165 1.00 0.00 H new ATOM 0 HE3 LYS B 6 3.045 -4.769 -4.867 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 4.359 -3.049 -5.920 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 3.275 -3.719 -7.042 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 2.959 -2.196 -6.361 1.00 0.00 H new ATOM 895 N THR B 7 -0.421 -5.784 -1.458 1.00 0.00 N ATOM 896 CA THR B 7 0.178 -5.395 -0.194 1.00 0.00 C ATOM 897 C THR B 7 1.313 -4.416 -0.476 1.00 0.00 C ATOM 898 O THR B 7 2.020 -4.575 -1.471 1.00 0.00 O ATOM 899 CB THR B 7 0.737 -6.619 0.559 1.00 0.00 C ATOM 900 OG1 THR B 7 1.919 -7.096 -0.095 1.00 0.00 O ATOM 901 CG2 THR B 7 -0.293 -7.741 0.615 1.00 0.00 C ATOM 0 H THR B 7 -0.084 -6.675 -1.823 1.00 0.00 H new ATOM 0 HA THR B 7 -0.586 -4.933 0.431 1.00 0.00 H new ATOM 0 HB THR B 7 0.976 -6.310 1.577 1.00 0.00 H new ATOM 0 HG1 THR B 7 2.270 -7.872 0.389 1.00 0.00 H new ATOM 0 HG21 THR B 7 0.126 -8.593 1.151 1.00 0.00 H new ATOM 0 HG22 THR B 7 -1.186 -7.390 1.132 1.00 0.00 H new ATOM 0 HG23 THR B 7 -0.556 -8.044 -0.398 1.00 0.00 H new ATOM 909 N LEU B 8 1.481 -3.401 0.372 1.00 0.00 N ATOM 910 CA LEU B 8 2.538 -2.410 0.161 1.00 0.00 C ATOM 911 C LEU B 8 3.838 -3.087 -0.264 1.00 0.00 C ATOM 912 O LEU B 8 4.549 -3.658 0.563 1.00 0.00 O ATOM 913 CB LEU B 8 2.778 -1.584 1.429 1.00 0.00 C ATOM 914 CG LEU B 8 1.632 -0.659 1.844 1.00 0.00 C ATOM 915 CD1 LEU B 8 2.001 0.098 3.109 1.00 0.00 C ATOM 916 CD2 LEU B 8 1.289 0.318 0.726 1.00 0.00 C ATOM 0 H LEU B 8 0.908 -3.244 1.201 1.00 0.00 H new ATOM 0 HA LEU B 8 2.209 -1.742 -0.635 1.00 0.00 H new ATOM 0 HB2 LEU B 8 2.985 -2.268 2.252 1.00 0.00 H new ATOM 0 HB3 LEU B 8 3.674 -0.980 1.283 1.00 0.00 H new ATOM 0 HG LEU B 8 0.753 -1.272 2.042 1.00 0.00 H new ATOM 0 HD11 LEU B 8 1.178 0.753 3.394 1.00 0.00 H new ATOM 0 HD12 LEU B 8 2.196 -0.611 3.913 1.00 0.00 H new ATOM 0 HD13 LEU B 8 2.894 0.696 2.928 1.00 0.00 H new ATOM 0 HD21 LEU B 8 0.472 0.964 1.046 1.00 0.00 H new ATOM 0 HD22 LEU B 8 2.163 0.926 0.494 1.00 0.00 H new ATOM 0 HD23 LEU B 8 0.987 -0.237 -0.162 1.00 0.00 H new ATOM 928 N THR B 9 4.132 -3.023 -1.564 1.00 0.00 N ATOM 929 CA THR B 9 5.339 -3.633 -2.114 1.00 0.00 C ATOM 930 C THR B 9 5.499 -5.067 -1.621 1.00 0.00 C ATOM 931 O THR B 9 6.424 -5.369 -0.866 1.00 0.00 O ATOM 932 CB THR B 9 6.602 -2.826 -1.752 1.00 0.00 C ATOM 933 OG1 THR B 9 6.771 -2.779 -0.330 1.00 0.00 O ATOM 934 CG2 THR B 9 6.515 -1.410 -2.301 1.00 0.00 C ATOM 0 H THR B 9 3.548 -2.553 -2.255 1.00 0.00 H new ATOM 0 HA THR B 9 5.226 -3.634 -3.198 1.00 0.00 H new ATOM 0 HB THR B 9 7.461 -3.325 -2.201 1.00 0.00 H new ATOM 0 HG1 THR B 9 6.349 -3.565 0.076 1.00 0.00 H new ATOM 0 HG21 THR B 9 7.417 -0.860 -2.033 1.00 0.00 H new ATOM 0 HG22 THR B 9 6.421 -1.446 -3.386 1.00 0.00 H new ATOM 0 HG23 THR B 9 5.645 -0.908 -1.877 1.00 0.00 H new ATOM 942 N GLY B 10 4.589 -5.950 -2.030 1.00 0.00 N ATOM 943 CA GLY B 10 4.671 -7.326 -1.584 1.00 0.00 C ATOM 944 C GLY B 10 4.026 -8.334 -2.520 1.00 0.00 C ATOM 945 O GLY B 10 4.722 -9.161 -3.111 1.00 0.00 O ATOM 0 H GLY B 10 3.809 -5.739 -2.653 1.00 0.00 H new ATOM 0 HA2 GLY B 10 5.721 -7.590 -1.454 1.00 0.00 H new ATOM 0 HA3 GLY B 10 4.199 -7.405 -0.605 1.00 0.00 H new ATOM 949 N LYS B 11 2.697 -8.292 -2.640 1.00 0.00 N ATOM 950 CA LYS B 11 1.984 -9.245 -3.491 1.00 0.00 C ATOM 951 C LYS B 11 0.498 -8.893 -3.607 1.00 0.00 C ATOM 952 O LYS B 11 -0.135 -8.503 -2.626 1.00 0.00 O ATOM 953 CB LYS B 11 2.169 -10.658 -2.916 1.00 0.00 C ATOM 954 CG LYS B 11 1.396 -11.752 -3.635 1.00 0.00 C ATOM 955 CD LYS B 11 -0.036 -11.845 -3.140 1.00 0.00 C ATOM 956 CE LYS B 11 -0.703 -13.120 -3.626 1.00 0.00 C ATOM 957 NZ LYS B 11 -0.722 -13.205 -5.113 1.00 0.00 N ATOM 0 H LYS B 11 2.099 -7.616 -2.164 1.00 0.00 H new ATOM 0 HA LYS B 11 2.399 -9.201 -4.498 1.00 0.00 H new ATOM 0 HB2 LYS B 11 3.230 -10.908 -2.941 1.00 0.00 H new ATOM 0 HB3 LYS B 11 1.868 -10.650 -1.869 1.00 0.00 H new ATOM 0 HG2 LYS B 11 1.398 -11.555 -4.707 1.00 0.00 H new ATOM 0 HG3 LYS B 11 1.896 -12.709 -3.486 1.00 0.00 H new ATOM 0 HD2 LYS B 11 -0.050 -11.817 -2.050 1.00 0.00 H new ATOM 0 HD3 LYS B 11 -0.601 -10.980 -3.488 1.00 0.00 H new ATOM 0 HE2 LYS B 11 -0.176 -13.983 -3.220 1.00 0.00 H new ATOM 0 HE3 LYS B 11 -1.724 -13.163 -3.247 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 -1.329 -13.996 -5.408 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 -1.095 -12.318 -5.507 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 0.244 -13.361 -5.464 1.00 0.00 H new ATOM 971 N THR B 12 -0.047 -9.033 -4.818 1.00 0.00 N ATOM 972 CA THR B 12 -1.455 -8.730 -5.075 1.00 0.00 C ATOM 973 C THR B 12 -2.374 -9.879 -4.668 1.00 0.00 C ATOM 974 O THR B 12 -2.222 -11.004 -5.140 1.00 0.00 O ATOM 975 CB THR B 12 -1.701 -8.412 -6.562 1.00 0.00 C ATOM 976 OG1 THR B 12 -1.318 -9.530 -7.371 1.00 0.00 O ATOM 977 CG2 THR B 12 -0.925 -7.180 -6.993 1.00 0.00 C ATOM 0 H THR B 12 0.468 -9.355 -5.637 1.00 0.00 H new ATOM 0 HA THR B 12 -1.688 -7.855 -4.468 1.00 0.00 H new ATOM 0 HB THR B 12 -2.764 -8.213 -6.694 1.00 0.00 H new ATOM 0 HG1 THR B 12 -1.466 -10.361 -6.872 1.00 0.00 H new ATOM 0 HG21 THR B 12 -1.117 -6.979 -8.047 1.00 0.00 H new ATOM 0 HG22 THR B 12 -1.241 -6.324 -6.397 1.00 0.00 H new ATOM 0 HG23 THR B 12 0.141 -7.351 -6.845 1.00 0.00 H new ATOM 985 N ILE B 13 -3.343 -9.578 -3.806 1.00 0.00 N ATOM 986 CA ILE B 13 -4.307 -10.577 -3.352 1.00 0.00 C ATOM 987 C ILE B 13 -5.566 -10.530 -4.215 1.00 0.00 C ATOM 988 O ILE B 13 -6.063 -9.452 -4.534 1.00 0.00 O ATOM 989 CB ILE B 13 -4.698 -10.353 -1.876 1.00 0.00 C ATOM 990 CG1 ILE B 13 -3.451 -10.253 -0.996 1.00 0.00 C ATOM 991 CG2 ILE B 13 -5.604 -11.476 -1.391 1.00 0.00 C ATOM 992 CD1 ILE B 13 -2.630 -11.519 -0.970 1.00 0.00 C ATOM 0 H ILE B 13 -3.481 -8.649 -3.408 1.00 0.00 H new ATOM 0 HA ILE B 13 -3.832 -11.554 -3.443 1.00 0.00 H new ATOM 0 HB ILE B 13 -5.243 -9.412 -1.804 1.00 0.00 H new ATOM 0 HG12 ILE B 13 -2.828 -9.433 -1.354 1.00 0.00 H new ATOM 0 HG13 ILE B 13 -3.753 -10.004 0.021 1.00 0.00 H new ATOM 0 HG21 ILE B 13 -5.871 -11.304 -0.348 1.00 0.00 H new ATOM 0 HG22 ILE B 13 -6.509 -11.501 -1.998 1.00 0.00 H new ATOM 0 HG23 ILE B 13 -5.082 -12.429 -1.479 1.00 0.00 H new ATOM 0 HD11 ILE B 13 -1.762 -11.376 -0.327 1.00 0.00 H new ATOM 0 HD12 ILE B 13 -3.237 -12.338 -0.584 1.00 0.00 H new ATOM 0 HD13 ILE B 13 -2.298 -11.758 -1.980 1.00 0.00 H new ATOM 1004 N THR B 14 -6.077 -11.693 -4.602 1.00 0.00 N ATOM 1005 CA THR B 14 -7.274 -11.749 -5.437 1.00 0.00 C ATOM 1006 C THR B 14 -8.443 -12.412 -4.711 1.00 0.00 C ATOM 1007 O THR B 14 -8.312 -13.517 -4.184 1.00 0.00 O ATOM 1008 CB THR B 14 -7.003 -12.507 -6.750 1.00 0.00 C ATOM 1009 OG1 THR B 14 -5.933 -11.878 -7.466 1.00 0.00 O ATOM 1010 CG2 THR B 14 -8.247 -12.544 -7.627 1.00 0.00 C ATOM 0 H THR B 14 -5.687 -12.602 -4.355 1.00 0.00 H new ATOM 0 HA THR B 14 -7.542 -10.717 -5.663 1.00 0.00 H new ATOM 0 HB THR B 14 -6.725 -13.530 -6.498 1.00 0.00 H new ATOM 0 HG1 THR B 14 -5.765 -12.366 -8.299 1.00 0.00 H new ATOM 0 HG21 THR B 14 -8.027 -13.085 -8.547 1.00 0.00 H new ATOM 0 HG22 THR B 14 -9.053 -13.047 -7.094 1.00 0.00 H new ATOM 0 HG23 THR B 14 -8.552 -11.526 -7.869 1.00 0.00 H new ATOM 1018 N LEU B 15 -9.590 -11.733 -4.702 1.00 0.00 N ATOM 1019 CA LEU B 15 -10.789 -12.260 -4.053 1.00 0.00 C ATOM 1020 C LEU B 15 -11.992 -12.168 -4.982 1.00 0.00 C ATOM 1021 O LEU B 15 -12.163 -11.183 -5.700 1.00 0.00 O ATOM 1022 CB LEU B 15 -11.105 -11.512 -2.754 1.00 0.00 C ATOM 1023 CG LEU B 15 -10.082 -11.659 -1.623 1.00 0.00 C ATOM 1024 CD1 LEU B 15 -9.769 -13.125 -1.368 1.00 0.00 C ATOM 1025 CD2 LEU B 15 -8.814 -10.881 -1.931 1.00 0.00 C ATOM 0 H LEU B 15 -9.714 -10.818 -5.136 1.00 0.00 H new ATOM 0 HA LEU B 15 -10.587 -13.305 -3.816 1.00 0.00 H new ATOM 0 HB2 LEU B 15 -11.210 -10.452 -2.986 1.00 0.00 H new ATOM 0 HB3 LEU B 15 -12.073 -11.855 -2.388 1.00 0.00 H new ATOM 0 HG LEU B 15 -10.519 -11.241 -0.716 1.00 0.00 H new ATOM 0 HD11 LEU B 15 -9.041 -13.207 -0.561 1.00 0.00 H new ATOM 0 HD12 LEU B 15 -10.683 -13.648 -1.086 1.00 0.00 H new ATOM 0 HD13 LEU B 15 -9.359 -13.572 -2.273 1.00 0.00 H new ATOM 0 HD21 LEU B 15 -8.105 -11.002 -1.112 1.00 0.00 H new ATOM 0 HD22 LEU B 15 -8.371 -11.257 -2.853 1.00 0.00 H new ATOM 0 HD23 LEU B 15 -9.055 -9.824 -2.049 1.00 0.00 H new ATOM 1037 N GLU B 16 -12.827 -13.196 -4.950 1.00 0.00 N ATOM 1038 CA GLU B 16 -14.028 -13.237 -5.778 1.00 0.00 C ATOM 1039 C GLU B 16 -15.184 -12.531 -5.076 1.00 0.00 C ATOM 1040 O GLU B 16 -15.546 -12.888 -3.955 1.00 0.00 O ATOM 1041 CB GLU B 16 -14.408 -14.690 -6.082 1.00 0.00 C ATOM 1042 CG GLU B 16 -15.635 -14.832 -6.972 1.00 0.00 C ATOM 1043 CD GLU B 16 -15.412 -14.296 -8.373 1.00 0.00 C ATOM 1044 OE1 GLU B 16 -15.157 -13.082 -8.512 1.00 0.00 O ATOM 1045 OE2 GLU B 16 -15.491 -15.091 -9.333 1.00 0.00 O ATOM 0 H GLU B 16 -12.696 -14.016 -4.358 1.00 0.00 H new ATOM 0 HA GLU B 16 -13.821 -12.720 -6.715 1.00 0.00 H new ATOM 0 HB2 GLU B 16 -13.563 -15.184 -6.563 1.00 0.00 H new ATOM 0 HB3 GLU B 16 -14.590 -15.212 -5.143 1.00 0.00 H new ATOM 0 HG2 GLU B 16 -15.915 -15.884 -7.031 1.00 0.00 H new ATOM 0 HG3 GLU B 16 -16.472 -14.304 -6.515 1.00 0.00 H new ATOM 1052 N VAL B 17 -15.761 -11.531 -5.740 1.00 0.00 N ATOM 1053 CA VAL B 17 -16.877 -10.780 -5.170 1.00 0.00 C ATOM 1054 C VAL B 17 -17.806 -10.247 -6.255 1.00 0.00 C ATOM 1055 O VAL B 17 -17.359 -9.698 -7.263 1.00 0.00 O ATOM 1056 CB VAL B 17 -16.390 -9.596 -4.308 1.00 0.00 C ATOM 1057 CG1 VAL B 17 -15.675 -10.090 -3.059 1.00 0.00 C ATOM 1058 CG2 VAL B 17 -15.484 -8.685 -5.118 1.00 0.00 C ATOM 0 H VAL B 17 -15.475 -11.223 -6.670 1.00 0.00 H new ATOM 0 HA VAL B 17 -17.423 -11.481 -4.538 1.00 0.00 H new ATOM 0 HB VAL B 17 -17.263 -9.024 -3.993 1.00 0.00 H new ATOM 0 HG11 VAL B 17 -15.342 -9.236 -2.469 1.00 0.00 H new ATOM 0 HG12 VAL B 17 -16.358 -10.697 -2.465 1.00 0.00 H new ATOM 0 HG13 VAL B 17 -14.812 -10.691 -3.347 1.00 0.00 H new ATOM 0 HG21 VAL B 17 -15.150 -7.856 -4.494 1.00 0.00 H new ATOM 0 HG22 VAL B 17 -14.618 -9.249 -5.466 1.00 0.00 H new ATOM 0 HG23 VAL B 17 -16.032 -8.296 -5.976 1.00 0.00 H new ATOM 1068 N GLU B 18 -19.105 -10.415 -6.033 1.00 0.00 N ATOM 1069 CA GLU B 18 -20.119 -9.957 -6.977 1.00 0.00 C ATOM 1070 C GLU B 18 -20.161 -8.435 -7.042 1.00 0.00 C ATOM 1071 O GLU B 18 -19.835 -7.756 -6.068 1.00 0.00 O ATOM 1072 CB GLU B 18 -21.494 -10.484 -6.567 1.00 0.00 C ATOM 1073 CG GLU B 18 -22.593 -10.169 -7.570 1.00 0.00 C ATOM 1074 CD GLU B 18 -23.949 -10.693 -7.139 1.00 0.00 C ATOM 1075 OE1 GLU B 18 -24.034 -11.306 -6.053 1.00 0.00 O ATOM 1076 OE2 GLU B 18 -24.928 -10.491 -7.888 1.00 0.00 O ATOM 0 H GLU B 18 -19.483 -10.868 -5.201 1.00 0.00 H new ATOM 0 HA GLU B 18 -19.857 -10.341 -7.963 1.00 0.00 H new ATOM 0 HB2 GLU B 18 -21.434 -11.564 -6.434 1.00 0.00 H new ATOM 0 HB3 GLU B 18 -21.763 -10.058 -5.600 1.00 0.00 H new ATOM 0 HG2 GLU B 18 -22.653 -9.090 -7.709 1.00 0.00 H new ATOM 0 HG3 GLU B 18 -22.332 -10.601 -8.536 1.00 0.00 H new ATOM 1083 N SER B 19 -20.575 -7.904 -8.191 1.00 0.00 N ATOM 1084 CA SER B 19 -20.678 -6.459 -8.374 1.00 0.00 C ATOM 1085 C SER B 19 -21.935 -5.922 -7.688 1.00 0.00 C ATOM 1086 O SER B 19 -22.660 -5.098 -8.246 1.00 0.00 O ATOM 1087 CB SER B 19 -20.703 -6.110 -9.863 1.00 0.00 C ATOM 1088 OG SER B 19 -21.808 -6.715 -10.511 1.00 0.00 O ATOM 0 H SER B 19 -20.844 -8.453 -9.008 1.00 0.00 H new ATOM 0 HA SER B 19 -19.804 -5.992 -7.919 1.00 0.00 H new ATOM 0 HB2 SER B 19 -20.754 -5.028 -9.985 1.00 0.00 H new ATOM 0 HB3 SER B 19 -19.777 -6.441 -10.333 1.00 0.00 H new ATOM 0 HG SER B 19 -21.802 -6.475 -11.461 1.00 0.00 H new ATOM 1094 N SER B 20 -22.181 -6.404 -6.473 1.00 0.00 N ATOM 1095 CA SER B 20 -23.339 -5.997 -5.688 1.00 0.00 C ATOM 1096 C SER B 20 -23.186 -6.500 -4.257 1.00 0.00 C ATOM 1097 O SER B 20 -24.090 -7.121 -3.697 1.00 0.00 O ATOM 1098 CB SER B 20 -24.626 -6.546 -6.307 1.00 0.00 C ATOM 1099 OG SER B 20 -25.764 -6.131 -5.572 1.00 0.00 O ATOM 0 H SER B 20 -21.583 -7.087 -6.007 1.00 0.00 H new ATOM 0 HA SER B 20 -23.400 -4.909 -5.683 1.00 0.00 H new ATOM 0 HB2 SER B 20 -24.711 -6.204 -7.339 1.00 0.00 H new ATOM 0 HB3 SER B 20 -24.584 -7.635 -6.334 1.00 0.00 H new ATOM 0 HG SER B 20 -25.631 -6.332 -4.622 1.00 0.00 H new ATOM 1105 N ASP B 21 -22.018 -6.231 -3.682 1.00 0.00 N ATOM 1106 CA ASP B 21 -21.704 -6.651 -2.329 1.00 0.00 C ATOM 1107 C ASP B 21 -20.950 -5.542 -1.604 1.00 0.00 C ATOM 1108 O ASP B 21 -20.135 -4.837 -2.199 1.00 0.00 O ATOM 1109 CB ASP B 21 -20.874 -7.937 -2.364 1.00 0.00 C ATOM 1110 CG ASP B 21 -20.565 -8.467 -0.981 1.00 0.00 C ATOM 1111 OD1 ASP B 21 -19.878 -7.760 -0.219 1.00 0.00 O ATOM 1112 OD2 ASP B 21 -21.011 -9.588 -0.660 1.00 0.00 O ATOM 0 H ASP B 21 -21.267 -5.717 -4.143 1.00 0.00 H new ATOM 0 HA ASP B 21 -22.629 -6.851 -1.788 1.00 0.00 H new ATOM 0 HB2 ASP B 21 -21.413 -8.698 -2.929 1.00 0.00 H new ATOM 0 HB3 ASP B 21 -19.940 -7.748 -2.894 1.00 0.00 H new ATOM 1117 N THR B 22 -21.251 -5.375 -0.324 1.00 0.00 N ATOM 1118 CA THR B 22 -20.632 -4.333 0.482 1.00 0.00 C ATOM 1119 C THR B 22 -19.153 -4.603 0.747 1.00 0.00 C ATOM 1120 O THR B 22 -18.729 -5.751 0.882 1.00 0.00 O ATOM 1121 CB THR B 22 -21.374 -4.170 1.814 1.00 0.00 C ATOM 1122 OG1 THR B 22 -20.808 -3.092 2.568 1.00 0.00 O ATOM 1123 CG2 THR B 22 -21.320 -5.453 2.629 1.00 0.00 C ATOM 0 H THR B 22 -21.924 -5.952 0.181 1.00 0.00 H new ATOM 0 HA THR B 22 -20.702 -3.409 -0.092 1.00 0.00 H new ATOM 0 HB THR B 22 -22.417 -3.945 1.593 1.00 0.00 H new ATOM 0 HG1 THR B 22 -20.770 -3.340 3.515 1.00 0.00 H new ATOM 0 HG21 THR B 22 -21.854 -5.310 3.569 1.00 0.00 H new ATOM 0 HG22 THR B 22 -21.787 -6.261 2.066 1.00 0.00 H new ATOM 0 HG23 THR B 22 -20.281 -5.708 2.837 1.00 0.00 H new ATOM 1131 N ILE B 23 -18.376 -3.526 0.812 1.00 0.00 N ATOM 1132 CA ILE B 23 -16.941 -3.614 1.052 1.00 0.00 C ATOM 1133 C ILE B 23 -16.632 -4.401 2.325 1.00 0.00 C ATOM 1134 O ILE B 23 -15.698 -5.203 2.354 1.00 0.00 O ATOM 1135 CB ILE B 23 -16.308 -2.213 1.178 1.00 0.00 C ATOM 1136 CG1 ILE B 23 -16.657 -1.346 -0.038 1.00 0.00 C ATOM 1137 CG2 ILE B 23 -14.800 -2.327 1.340 1.00 0.00 C ATOM 1138 CD1 ILE B 23 -16.142 -1.891 -1.353 1.00 0.00 C ATOM 0 H ILE B 23 -18.722 -2.573 0.700 1.00 0.00 H new ATOM 0 HA ILE B 23 -16.515 -4.133 0.193 1.00 0.00 H new ATOM 0 HB ILE B 23 -16.717 -1.730 2.066 1.00 0.00 H new ATOM 0 HG12 ILE B 23 -17.740 -1.243 -0.099 1.00 0.00 H new ATOM 0 HG13 ILE B 23 -16.250 -0.346 0.113 1.00 0.00 H new ATOM 0 HG21 ILE B 23 -14.367 -1.330 1.428 1.00 0.00 H new ATOM 0 HG22 ILE B 23 -14.573 -2.902 2.238 1.00 0.00 H new ATOM 0 HG23 ILE B 23 -14.378 -2.831 0.471 1.00 0.00 H new ATOM 0 HD11 ILE B 23 -16.430 -1.221 -2.163 1.00 0.00 H new ATOM 0 HD12 ILE B 23 -15.055 -1.967 -1.315 1.00 0.00 H new ATOM 0 HD13 ILE B 23 -16.569 -2.878 -1.530 1.00 0.00 H new ATOM 1150 N ASP B 24 -17.411 -4.154 3.376 1.00 0.00 N ATOM 1151 CA ASP B 24 -17.212 -4.830 4.655 1.00 0.00 C ATOM 1152 C ASP B 24 -17.136 -6.342 4.474 1.00 0.00 C ATOM 1153 O ASP B 24 -16.277 -7.001 5.061 1.00 0.00 O ATOM 1154 CB ASP B 24 -18.345 -4.473 5.623 1.00 0.00 C ATOM 1155 CG ASP B 24 -18.167 -5.101 6.993 1.00 0.00 C ATOM 1156 OD1 ASP B 24 -18.140 -6.347 7.080 1.00 0.00 O ATOM 1157 OD2 ASP B 24 -18.057 -4.346 7.982 1.00 0.00 O ATOM 0 H ASP B 24 -18.186 -3.491 3.367 1.00 0.00 H new ATOM 0 HA ASP B 24 -16.264 -4.490 5.072 1.00 0.00 H new ATOM 0 HB2 ASP B 24 -18.398 -3.389 5.729 1.00 0.00 H new ATOM 0 HB3 ASP B 24 -19.295 -4.799 5.199 1.00 0.00 H new ATOM 1162 N ASN B 25 -18.035 -6.889 3.660 1.00 0.00 N ATOM 1163 CA ASN B 25 -18.054 -8.324 3.408 1.00 0.00 C ATOM 1164 C ASN B 25 -16.691 -8.783 2.899 1.00 0.00 C ATOM 1165 O ASN B 25 -16.151 -9.793 3.353 1.00 0.00 O ATOM 1166 CB ASN B 25 -19.140 -8.673 2.390 1.00 0.00 C ATOM 1167 CG ASN B 25 -19.302 -10.169 2.208 1.00 0.00 C ATOM 1168 OD1 ASN B 25 -19.612 -10.891 3.157 1.00 0.00 O ATOM 1169 ND2 ASN B 25 -19.094 -10.643 0.987 1.00 0.00 N ATOM 0 H ASN B 25 -18.756 -6.362 3.167 1.00 0.00 H new ATOM 0 HA ASN B 25 -18.276 -8.839 4.343 1.00 0.00 H new ATOM 0 HB2 ASN B 25 -20.089 -8.244 2.713 1.00 0.00 H new ATOM 0 HB3 ASN B 25 -18.895 -8.217 1.431 1.00 0.00 H new ATOM 0 HD21 ASN B 25 -19.189 -11.642 0.805 1.00 0.00 H new ATOM 0 HD22 ASN B 25 -18.839 -10.009 0.230 1.00 0.00 H new ATOM 1176 N VAL B 26 -16.135 -8.015 1.966 1.00 0.00 N ATOM 1177 CA VAL B 26 -14.826 -8.320 1.405 1.00 0.00 C ATOM 1178 C VAL B 26 -13.765 -8.302 2.496 1.00 0.00 C ATOM 1179 O VAL B 26 -12.867 -9.143 2.521 1.00 0.00 O ATOM 1180 CB VAL B 26 -14.436 -7.311 0.306 1.00 0.00 C ATOM 1181 CG1 VAL B 26 -13.079 -7.660 -0.290 1.00 0.00 C ATOM 1182 CG2 VAL B 26 -15.503 -7.257 -0.774 1.00 0.00 C ATOM 0 H VAL B 26 -16.572 -7.177 1.583 1.00 0.00 H new ATOM 0 HA VAL B 26 -14.884 -9.315 0.963 1.00 0.00 H new ATOM 0 HB VAL B 26 -14.361 -6.323 0.760 1.00 0.00 H new ATOM 0 HG11 VAL B 26 -12.824 -6.935 -1.063 1.00 0.00 H new ATOM 0 HG12 VAL B 26 -12.321 -7.637 0.493 1.00 0.00 H new ATOM 0 HG13 VAL B 26 -13.119 -8.658 -0.727 1.00 0.00 H new ATOM 0 HG21 VAL B 26 -15.209 -6.539 -1.540 1.00 0.00 H new ATOM 0 HG22 VAL B 26 -15.615 -8.243 -1.224 1.00 0.00 H new ATOM 0 HG23 VAL B 26 -16.451 -6.949 -0.333 1.00 0.00 H new ATOM 1192 N LYS B 27 -13.882 -7.335 3.404 1.00 0.00 N ATOM 1193 CA LYS B 27 -12.941 -7.200 4.508 1.00 0.00 C ATOM 1194 C LYS B 27 -12.917 -8.472 5.348 1.00 0.00 C ATOM 1195 O LYS B 27 -11.853 -8.941 5.752 1.00 0.00 O ATOM 1196 CB LYS B 27 -13.315 -5.999 5.383 1.00 0.00 C ATOM 1197 CG LYS B 27 -13.321 -4.674 4.635 1.00 0.00 C ATOM 1198 CD LYS B 27 -11.955 -4.364 4.047 1.00 0.00 C ATOM 1199 CE LYS B 27 -11.948 -3.034 3.310 1.00 0.00 C ATOM 1200 NZ LYS B 27 -12.239 -1.890 4.216 1.00 0.00 N ATOM 0 H LYS B 27 -14.622 -6.633 3.394 1.00 0.00 H new ATOM 0 HA LYS B 27 -11.946 -7.037 4.093 1.00 0.00 H new ATOM 0 HB2 LYS B 27 -14.302 -6.168 5.813 1.00 0.00 H new ATOM 0 HB3 LYS B 27 -12.613 -5.934 6.214 1.00 0.00 H new ATOM 0 HG2 LYS B 27 -14.063 -4.708 3.837 1.00 0.00 H new ATOM 0 HG3 LYS B 27 -13.618 -3.873 5.312 1.00 0.00 H new ATOM 0 HD2 LYS B 27 -11.212 -4.342 4.844 1.00 0.00 H new ATOM 0 HD3 LYS B 27 -11.664 -5.161 3.362 1.00 0.00 H new ATOM 0 HE2 LYS B 27 -10.976 -2.886 2.840 1.00 0.00 H new ATOM 0 HE3 LYS B 27 -12.688 -3.060 2.510 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 -12.207 -1.002 3.675 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 -13.185 -2.009 4.632 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 -11.528 -1.859 4.975 1.00 0.00 H new ATOM 1214 N SER B 28 -14.098 -9.027 5.600 1.00 0.00 N ATOM 1215 CA SER B 28 -14.217 -10.250 6.385 1.00 0.00 C ATOM 1216 C SER B 28 -13.551 -11.422 5.672 1.00 0.00 C ATOM 1217 O SER B 28 -12.817 -12.198 6.287 1.00 0.00 O ATOM 1218 CB SER B 28 -15.688 -10.570 6.649 1.00 0.00 C ATOM 1219 OG SER B 28 -15.825 -11.782 7.372 1.00 0.00 O ATOM 0 H SER B 28 -14.987 -8.649 5.272 1.00 0.00 H new ATOM 0 HA SER B 28 -13.710 -10.091 7.337 1.00 0.00 H new ATOM 0 HB2 SER B 28 -16.146 -9.755 7.209 1.00 0.00 H new ATOM 0 HB3 SER B 28 -16.223 -10.645 5.702 1.00 0.00 H new ATOM 0 HG SER B 28 -16.775 -11.963 7.529 1.00 0.00 H new ATOM 1225 N LYS B 29 -13.811 -11.546 4.372 1.00 0.00 N ATOM 1226 CA LYS B 29 -13.233 -12.627 3.579 1.00 0.00 C ATOM 1227 C LYS B 29 -11.709 -12.573 3.609 1.00 0.00 C ATOM 1228 O LYS B 29 -11.046 -13.586 3.832 1.00 0.00 O ATOM 1229 CB LYS B 29 -13.727 -12.554 2.133 1.00 0.00 C ATOM 1230 CG LYS B 29 -15.223 -12.778 1.986 1.00 0.00 C ATOM 1231 CD LYS B 29 -15.655 -12.708 0.531 1.00 0.00 C ATOM 1232 CE LYS B 29 -17.134 -13.018 0.372 1.00 0.00 C ATOM 1233 NZ LYS B 29 -17.465 -14.393 0.833 1.00 0.00 N ATOM 0 H LYS B 29 -14.416 -10.914 3.848 1.00 0.00 H new ATOM 0 HA LYS B 29 -13.555 -13.572 4.018 1.00 0.00 H new ATOM 0 HB2 LYS B 29 -13.473 -11.578 1.720 1.00 0.00 H new ATOM 0 HB3 LYS B 29 -13.197 -13.299 1.539 1.00 0.00 H new ATOM 0 HG2 LYS B 29 -15.489 -13.751 2.399 1.00 0.00 H new ATOM 0 HG3 LYS B 29 -15.763 -12.028 2.564 1.00 0.00 H new ATOM 0 HD2 LYS B 29 -15.446 -11.714 0.136 1.00 0.00 H new ATOM 0 HD3 LYS B 29 -15.069 -13.414 -0.058 1.00 0.00 H new ATOM 0 HE2 LYS B 29 -17.720 -12.294 0.939 1.00 0.00 H new ATOM 0 HE3 LYS B 29 -17.418 -12.908 -0.675 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 -18.392 -14.672 0.454 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 -16.739 -15.057 0.495 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 -17.495 -14.413 1.872 1.00 0.00 H new ATOM 1247 N ILE B 30 -11.161 -11.382 3.388 1.00 0.00 N ATOM 1248 CA ILE B 30 -9.715 -11.191 3.394 1.00 0.00 C ATOM 1249 C ILE B 30 -9.133 -11.486 4.772 1.00 0.00 C ATOM 1250 O ILE B 30 -8.061 -12.081 4.890 1.00 0.00 O ATOM 1251 CB ILE B 30 -9.335 -9.755 2.977 1.00 0.00 C ATOM 1252 CG1 ILE B 30 -9.846 -9.460 1.564 1.00 0.00 C ATOM 1253 CG2 ILE B 30 -7.827 -9.559 3.053 1.00 0.00 C ATOM 1254 CD1 ILE B 30 -9.575 -8.043 1.102 1.00 0.00 C ATOM 0 H ILE B 30 -11.697 -10.534 3.202 1.00 0.00 H new ATOM 0 HA ILE B 30 -9.297 -11.889 2.669 1.00 0.00 H new ATOM 0 HB ILE B 30 -9.806 -9.056 3.668 1.00 0.00 H new ATOM 0 HG12 ILE B 30 -9.380 -10.156 0.866 1.00 0.00 H new ATOM 0 HG13 ILE B 30 -10.920 -9.645 1.529 1.00 0.00 H new ATOM 0 HG21 ILE B 30 -7.577 -8.541 2.755 1.00 0.00 H new ATOM 0 HG22 ILE B 30 -7.489 -9.732 4.075 1.00 0.00 H new ATOM 0 HG23 ILE B 30 -7.334 -10.264 2.383 1.00 0.00 H new ATOM 0 HD11 ILE B 30 -9.965 -7.908 0.093 1.00 0.00 H new ATOM 0 HD12 ILE B 30 -10.064 -7.340 1.777 1.00 0.00 H new ATOM 0 HD13 ILE B 30 -8.501 -7.859 1.103 1.00 0.00 H new ATOM 1266 N GLN B 31 -9.847 -11.066 5.811 1.00 0.00 N ATOM 1267 CA GLN B 31 -9.407 -11.282 7.185 1.00 0.00 C ATOM 1268 C GLN B 31 -9.215 -12.767 7.475 1.00 0.00 C ATOM 1269 O GLN B 31 -8.195 -13.173 8.026 1.00 0.00 O ATOM 1270 CB GLN B 31 -10.423 -10.692 8.166 1.00 0.00 C ATOM 1271 CG GLN B 31 -10.081 -10.940 9.626 1.00 0.00 C ATOM 1272 CD GLN B 31 -11.119 -10.372 10.573 1.00 0.00 C ATOM 1273 OE1 GLN B 31 -11.368 -9.166 10.587 1.00 0.00 O ATOM 1274 NE2 GLN B 31 -11.732 -11.239 11.372 1.00 0.00 N ATOM 0 H GLN B 31 -10.736 -10.572 5.727 1.00 0.00 H new ATOM 0 HA GLN B 31 -8.448 -10.779 7.312 1.00 0.00 H new ATOM 0 HB2 GLN B 31 -10.496 -9.618 7.997 1.00 0.00 H new ATOM 0 HB3 GLN B 31 -11.405 -11.115 7.956 1.00 0.00 H new ATOM 0 HG2 GLN B 31 -9.988 -12.013 9.796 1.00 0.00 H new ATOM 0 HG3 GLN B 31 -9.110 -10.496 9.848 1.00 0.00 H new ATOM 0 HE21 GLN B 31 -11.495 -12.230 11.327 1.00 0.00 H new ATOM 0 HE22 GLN B 31 -12.440 -10.914 12.030 1.00 0.00 H new ATOM 1283 N ASP B 32 -10.204 -13.570 7.107 1.00 0.00 N ATOM 1284 CA ASP B 32 -10.145 -15.009 7.337 1.00 0.00 C ATOM 1285 C ASP B 32 -9.089 -15.672 6.454 1.00 0.00 C ATOM 1286 O ASP B 32 -8.370 -16.568 6.896 1.00 0.00 O ATOM 1287 CB ASP B 32 -11.516 -15.641 7.084 1.00 0.00 C ATOM 1288 CG ASP B 32 -11.538 -17.129 7.380 1.00 0.00 C ATOM 1289 OD1 ASP B 32 -10.797 -17.880 6.713 1.00 0.00 O ATOM 1290 OD2 ASP B 32 -12.297 -17.543 8.281 1.00 0.00 O ATOM 0 H ASP B 32 -11.057 -13.251 6.648 1.00 0.00 H new ATOM 0 HA ASP B 32 -9.862 -15.170 8.377 1.00 0.00 H new ATOM 0 HB2 ASP B 32 -12.262 -15.141 7.702 1.00 0.00 H new ATOM 0 HB3 ASP B 32 -11.801 -15.477 6.045 1.00 0.00 H new ATOM 1295 N LYS B 33 -9.014 -15.237 5.200 1.00 0.00 N ATOM 1296 CA LYS B 33 -8.060 -15.797 4.247 1.00 0.00 C ATOM 1297 C LYS B 33 -6.614 -15.548 4.673 1.00 0.00 C ATOM 1298 O LYS B 33 -5.890 -16.482 5.017 1.00 0.00 O ATOM 1299 CB LYS B 33 -8.299 -15.199 2.858 1.00 0.00 C ATOM 1300 CG LYS B 33 -7.337 -15.710 1.799 1.00 0.00 C ATOM 1301 CD LYS B 33 -7.610 -15.072 0.446 1.00 0.00 C ATOM 1302 CE LYS B 33 -6.638 -15.567 -0.612 1.00 0.00 C ATOM 1303 NZ LYS B 33 -6.719 -17.043 -0.795 1.00 0.00 N ATOM 0 H LYS B 33 -9.603 -14.497 4.819 1.00 0.00 H new ATOM 0 HA LYS B 33 -8.218 -16.875 4.219 1.00 0.00 H new ATOM 0 HB2 LYS B 33 -9.320 -15.422 2.547 1.00 0.00 H new ATOM 0 HB3 LYS B 33 -8.214 -14.114 2.920 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -6.312 -15.497 2.103 1.00 0.00 H new ATOM 0 HG3 LYS B 33 -7.426 -16.793 1.717 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -8.631 -15.296 0.137 1.00 0.00 H new ATOM 0 HD3 LYS B 33 -7.534 -13.988 0.532 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -6.850 -15.072 -1.560 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -5.622 -15.292 -0.329 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -6.213 -17.314 -1.662 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -6.285 -17.518 0.022 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -7.716 -17.329 -0.873 1.00 0.00 H new ATOM 1317 N GLU B 34 -6.195 -14.287 4.630 1.00 0.00 N ATOM 1318 CA GLU B 34 -4.829 -13.916 4.994 1.00 0.00 C ATOM 1319 C GLU B 34 -4.598 -14.006 6.499 1.00 0.00 C ATOM 1320 O GLU B 34 -3.532 -14.429 6.947 1.00 0.00 O ATOM 1321 CB GLU B 34 -4.516 -12.501 4.503 1.00 0.00 C ATOM 1322 CG GLU B 34 -4.591 -12.351 2.993 1.00 0.00 C ATOM 1323 CD GLU B 34 -4.233 -10.954 2.526 1.00 0.00 C ATOM 1324 OE1 GLU B 34 -3.101 -10.506 2.808 1.00 0.00 O ATOM 1325 OE2 GLU B 34 -5.082 -10.309 1.876 1.00 0.00 O ATOM 0 H GLU B 34 -6.782 -13.503 4.346 1.00 0.00 H new ATOM 0 HA GLU B 34 -4.158 -14.626 4.511 1.00 0.00 H new ATOM 0 HB2 GLU B 34 -5.214 -11.803 4.964 1.00 0.00 H new ATOM 0 HB3 GLU B 34 -3.517 -12.222 4.838 1.00 0.00 H new ATOM 0 HG2 GLU B 34 -3.917 -13.070 2.527 1.00 0.00 H new ATOM 0 HG3 GLU B 34 -5.599 -12.595 2.657 1.00 0.00 H new ATOM 1332 N GLY B 35 -5.594 -13.595 7.275 1.00 0.00 N ATOM 1333 CA GLY B 35 -5.470 -13.625 8.722 1.00 0.00 C ATOM 1334 C GLY B 35 -4.861 -12.350 9.269 1.00 0.00 C ATOM 1335 O GLY B 35 -4.171 -12.369 10.289 1.00 0.00 O ATOM 0 H GLY B 35 -6.486 -13.241 6.929 1.00 0.00 H new ATOM 0 HA2 GLY B 35 -6.454 -13.776 9.167 1.00 0.00 H new ATOM 0 HA3 GLY B 35 -4.854 -14.475 9.015 1.00 0.00 H new ATOM 1339 N ILE B 36 -5.125 -11.239 8.588 1.00 0.00 N ATOM 1340 CA ILE B 36 -4.611 -9.941 9.004 1.00 0.00 C ATOM 1341 C ILE B 36 -5.642 -9.196 9.854 1.00 0.00 C ATOM 1342 O ILE B 36 -6.817 -9.135 9.496 1.00 0.00 O ATOM 1343 CB ILE B 36 -4.232 -9.071 7.787 1.00 0.00 C ATOM 1344 CG1 ILE B 36 -3.128 -9.752 6.973 1.00 0.00 C ATOM 1345 CG2 ILE B 36 -3.791 -7.684 8.236 1.00 0.00 C ATOM 1346 CD1 ILE B 36 -2.739 -8.996 5.719 1.00 0.00 C ATOM 0 H ILE B 36 -5.695 -11.213 7.742 1.00 0.00 H new ATOM 0 HA ILE B 36 -3.716 -10.124 9.598 1.00 0.00 H new ATOM 0 HB ILE B 36 -5.111 -8.959 7.153 1.00 0.00 H new ATOM 0 HG12 ILE B 36 -2.246 -9.871 7.603 1.00 0.00 H new ATOM 0 HG13 ILE B 36 -3.459 -10.753 6.695 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -3.528 -7.086 7.364 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -4.605 -7.200 8.776 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -2.924 -7.772 8.890 1.00 0.00 H new ATOM 0 HD11 ILE B 36 -1.952 -9.540 5.196 1.00 0.00 H new ATOM 0 HD12 ILE B 36 -3.608 -8.899 5.068 1.00 0.00 H new ATOM 0 HD13 ILE B 36 -2.376 -8.004 5.990 1.00 0.00 H new ATOM 1358 N PRO B 37 -5.216 -8.615 10.992 1.00 0.00 N ATOM 1359 CA PRO B 37 -6.118 -7.874 11.879 1.00 0.00 C ATOM 1360 C PRO B 37 -6.882 -6.779 11.136 1.00 0.00 C ATOM 1361 O PRO B 37 -6.310 -6.065 10.314 1.00 0.00 O ATOM 1362 CB PRO B 37 -5.176 -7.258 12.919 1.00 0.00 C ATOM 1363 CG PRO B 37 -3.974 -8.138 12.913 1.00 0.00 C ATOM 1364 CD PRO B 37 -3.831 -8.633 11.501 1.00 0.00 C ATOM 0 HA PRO B 37 -6.884 -8.517 12.312 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -4.916 -6.232 12.659 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -5.640 -7.229 13.905 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -3.086 -7.588 13.226 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -4.095 -8.969 13.608 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -3.178 -7.988 10.913 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -3.403 -9.635 11.468 1.00 0.00 H new ATOM 1372 N PRO B 38 -8.193 -6.635 11.410 1.00 0.00 N ATOM 1373 CA PRO B 38 -9.032 -5.623 10.757 1.00 0.00 C ATOM 1374 C PRO B 38 -8.492 -4.208 10.941 1.00 0.00 C ATOM 1375 O PRO B 38 -8.490 -3.408 10.006 1.00 0.00 O ATOM 1376 CB PRO B 38 -10.396 -5.769 11.446 1.00 0.00 C ATOM 1377 CG PRO B 38 -10.136 -6.563 12.681 1.00 0.00 C ATOM 1378 CD PRO B 38 -8.962 -7.443 12.369 1.00 0.00 C ATOM 0 HA PRO B 38 -9.071 -5.775 9.678 1.00 0.00 H new ATOM 0 HB2 PRO B 38 -10.820 -4.794 11.688 1.00 0.00 H new ATOM 0 HB3 PRO B 38 -11.111 -6.275 10.797 1.00 0.00 H new ATOM 0 HG2 PRO B 38 -9.920 -5.910 13.526 1.00 0.00 H new ATOM 0 HG3 PRO B 38 -11.008 -7.158 12.953 1.00 0.00 H new ATOM 0 HD2 PRO B 38 -8.380 -7.673 13.262 1.00 0.00 H new ATOM 0 HD3 PRO B 38 -9.273 -8.394 11.938 1.00 0.00 H new ATOM 1386 N ASP B 39 -8.040 -3.906 12.153 1.00 0.00 N ATOM 1387 CA ASP B 39 -7.502 -2.585 12.458 1.00 0.00 C ATOM 1388 C ASP B 39 -6.190 -2.340 11.716 1.00 0.00 C ATOM 1389 O ASP B 39 -5.962 -1.255 11.180 1.00 0.00 O ATOM 1390 CB ASP B 39 -7.283 -2.438 13.966 1.00 0.00 C ATOM 1391 CG ASP B 39 -8.564 -2.609 14.758 1.00 0.00 C ATOM 1392 OD1 ASP B 39 -9.170 -3.699 14.681 1.00 0.00 O ATOM 1393 OD2 ASP B 39 -8.963 -1.652 15.457 1.00 0.00 O ATOM 0 H ASP B 39 -8.035 -4.556 12.939 1.00 0.00 H new ATOM 0 HA ASP B 39 -8.227 -1.842 12.126 1.00 0.00 H new ATOM 0 HB2 ASP B 39 -6.553 -3.177 14.298 1.00 0.00 H new ATOM 0 HB3 ASP B 39 -6.859 -1.456 14.174 1.00 0.00 H new ATOM 1398 N GLN B 40 -5.330 -3.354 11.697 1.00 0.00 N ATOM 1399 CA GLN B 40 -4.036 -3.251 11.030 1.00 0.00 C ATOM 1400 C GLN B 40 -4.192 -3.044 9.524 1.00 0.00 C ATOM 1401 O GLN B 40 -3.566 -2.158 8.944 1.00 0.00 O ATOM 1402 CB GLN B 40 -3.203 -4.507 11.300 1.00 0.00 C ATOM 1403 CG GLN B 40 -1.824 -4.475 10.662 1.00 0.00 C ATOM 1404 CD GLN B 40 -1.008 -5.712 10.976 1.00 0.00 C ATOM 1405 OE1 GLN B 40 -0.716 -6.000 12.137 1.00 0.00 O ATOM 1406 NE2 GLN B 40 -0.637 -6.454 9.940 1.00 0.00 N ATOM 0 H GLN B 40 -5.506 -4.257 12.136 1.00 0.00 H new ATOM 0 HA GLN B 40 -3.523 -2.379 11.436 1.00 0.00 H new ATOM 0 HB2 GLN B 40 -3.092 -4.634 12.377 1.00 0.00 H new ATOM 0 HB3 GLN B 40 -3.745 -5.378 10.930 1.00 0.00 H new ATOM 0 HG2 GLN B 40 -1.930 -4.379 9.581 1.00 0.00 H new ATOM 0 HG3 GLN B 40 -1.287 -3.592 11.010 1.00 0.00 H new ATOM 0 HE21 GLN B 40 -0.901 -6.178 8.994 1.00 0.00 H new ATOM 0 HE22 GLN B 40 -0.088 -7.300 10.090 1.00 0.00 H new ATOM 1415 N GLN B 41 -5.024 -3.870 8.896 1.00 0.00 N ATOM 1416 CA GLN B 41 -5.250 -3.778 7.457 1.00 0.00 C ATOM 1417 C GLN B 41 -5.905 -2.451 7.083 1.00 0.00 C ATOM 1418 O GLN B 41 -6.833 -1.993 7.750 1.00 0.00 O ATOM 1419 CB GLN B 41 -6.114 -4.944 6.972 1.00 0.00 C ATOM 1420 CG GLN B 41 -7.491 -4.995 7.615 1.00 0.00 C ATOM 1421 CD GLN B 41 -8.332 -6.165 7.131 1.00 0.00 C ATOM 1422 OE1 GLN B 41 -9.476 -6.334 7.554 1.00 0.00 O ATOM 1423 NE2 GLN B 41 -7.775 -6.981 6.241 1.00 0.00 N ATOM 0 H GLN B 41 -5.552 -4.609 9.360 1.00 0.00 H new ATOM 0 HA GLN B 41 -4.278 -3.829 6.966 1.00 0.00 H new ATOM 0 HB2 GLN B 41 -6.230 -4.873 5.891 1.00 0.00 H new ATOM 0 HB3 GLN B 41 -5.593 -5.880 7.176 1.00 0.00 H new ATOM 0 HG2 GLN B 41 -7.378 -5.060 8.697 1.00 0.00 H new ATOM 0 HG3 GLN B 41 -8.018 -4.065 7.405 1.00 0.00 H new ATOM 0 HE21 GLN B 41 -6.824 -6.807 5.915 1.00 0.00 H new ATOM 0 HE22 GLN B 41 -8.298 -7.781 5.885 1.00 0.00 H new ATOM 1432 N ARG B 42 -5.409 -1.840 6.013 1.00 0.00 N ATOM 1433 CA ARG B 42 -5.932 -0.567 5.539 1.00 0.00 C ATOM 1434 C ARG B 42 -6.116 -0.596 4.024 1.00 0.00 C ATOM 1435 O ARG B 42 -5.263 -0.120 3.274 1.00 0.00 O ATOM 1436 CB ARG B 42 -4.980 0.567 5.933 1.00 0.00 C ATOM 1437 CG ARG B 42 -4.650 0.592 7.417 1.00 0.00 C ATOM 1438 CD ARG B 42 -3.712 1.735 7.768 1.00 0.00 C ATOM 1439 NE ARG B 42 -4.352 3.038 7.609 1.00 0.00 N ATOM 1440 CZ ARG B 42 -3.747 4.193 7.869 1.00 0.00 C ATOM 1441 NH1 ARG B 42 -2.483 4.209 8.274 1.00 0.00 N ATOM 1442 NH2 ARG B 42 -4.405 5.335 7.720 1.00 0.00 N ATOM 0 H ARG B 42 -4.640 -2.210 5.455 1.00 0.00 H new ATOM 0 HA ARG B 42 -6.904 -0.394 6.002 1.00 0.00 H new ATOM 0 HB2 ARG B 42 -4.055 0.469 5.365 1.00 0.00 H new ATOM 0 HB3 ARG B 42 -5.427 1.521 5.652 1.00 0.00 H new ATOM 0 HG2 ARG B 42 -5.571 0.688 7.992 1.00 0.00 H new ATOM 0 HG3 ARG B 42 -4.192 -0.355 7.703 1.00 0.00 H new ATOM 0 HD2 ARG B 42 -3.372 1.622 8.797 1.00 0.00 H new ATOM 0 HD3 ARG B 42 -2.827 1.686 7.133 1.00 0.00 H new ATOM 0 HE ARG B 42 -5.317 3.063 7.280 1.00 0.00 H new ATOM 0 HH11 ARG B 42 -1.972 3.333 8.387 1.00 0.00 H new ATOM 0 HH12 ARG B 42 -2.022 5.097 8.472 1.00 0.00 H new ATOM 0 HH21 ARG B 42 -5.375 5.327 7.406 1.00 0.00 H new ATOM 0 HH22 ARG B 42 -3.941 6.221 7.920 1.00 0.00 H new ATOM 1456 N LEU B 43 -7.231 -1.175 3.580 1.00 0.00 N ATOM 1457 CA LEU B 43 -7.525 -1.282 2.152 1.00 0.00 C ATOM 1458 C LEU B 43 -7.836 0.082 1.545 1.00 0.00 C ATOM 1459 O LEU B 43 -8.997 0.484 1.449 1.00 0.00 O ATOM 1460 CB LEU B 43 -8.694 -2.241 1.907 1.00 0.00 C ATOM 1461 CG LEU B 43 -8.437 -3.701 2.287 1.00 0.00 C ATOM 1462 CD1 LEU B 43 -8.501 -3.881 3.794 1.00 0.00 C ATOM 1463 CD2 LEU B 43 -9.430 -4.617 1.589 1.00 0.00 C ATOM 0 H LEU B 43 -7.945 -1.577 4.188 1.00 0.00 H new ATOM 0 HA LEU B 43 -6.634 -1.679 1.665 1.00 0.00 H new ATOM 0 HB2 LEU B 43 -9.558 -1.884 2.468 1.00 0.00 H new ATOM 0 HB3 LEU B 43 -8.960 -2.200 0.851 1.00 0.00 H new ATOM 0 HG LEU B 43 -7.434 -3.972 1.956 1.00 0.00 H new ATOM 0 HD11 LEU B 43 -8.316 -4.926 4.044 1.00 0.00 H new ATOM 0 HD12 LEU B 43 -7.745 -3.255 4.268 1.00 0.00 H new ATOM 0 HD13 LEU B 43 -9.489 -3.592 4.153 1.00 0.00 H new ATOM 0 HD21 LEU B 43 -9.232 -5.651 1.871 1.00 0.00 H new ATOM 0 HD22 LEU B 43 -10.444 -4.348 1.885 1.00 0.00 H new ATOM 0 HD23 LEU B 43 -9.327 -4.510 0.509 1.00 0.00 H new ATOM 1475 N ILE B 44 -6.785 0.781 1.129 1.00 0.00 N ATOM 1476 CA ILE B 44 -6.926 2.098 0.520 1.00 0.00 C ATOM 1477 C ILE B 44 -7.277 1.986 -0.959 1.00 0.00 C ATOM 1478 O ILE B 44 -6.761 1.124 -1.674 1.00 0.00 O ATOM 1479 CB ILE B 44 -5.632 2.923 0.665 1.00 0.00 C ATOM 1480 CG1 ILE B 44 -5.343 3.209 2.139 1.00 0.00 C ATOM 1481 CG2 ILE B 44 -5.736 4.226 -0.117 1.00 0.00 C ATOM 1482 CD1 ILE B 44 -3.911 3.607 2.402 1.00 0.00 C ATOM 0 H ILE B 44 -5.821 0.455 1.203 1.00 0.00 H new ATOM 0 HA ILE B 44 -7.735 2.604 1.046 1.00 0.00 H new ATOM 0 HB ILE B 44 -4.807 2.340 0.256 1.00 0.00 H new ATOM 0 HG12 ILE B 44 -6.003 4.005 2.483 1.00 0.00 H new ATOM 0 HG13 ILE B 44 -5.580 2.322 2.727 1.00 0.00 H new ATOM 0 HG21 ILE B 44 -4.813 4.794 -0.002 1.00 0.00 H new ATOM 0 HG22 ILE B 44 -5.897 4.005 -1.172 1.00 0.00 H new ATOM 0 HG23 ILE B 44 -6.573 4.812 0.263 1.00 0.00 H new ATOM 0 HD11 ILE B 44 -3.775 3.795 3.467 1.00 0.00 H new ATOM 0 HD12 ILE B 44 -3.246 2.802 2.088 1.00 0.00 H new ATOM 0 HD13 ILE B 44 -3.676 4.511 1.841 1.00 0.00 H new ATOM 1494 N PHE B 45 -8.150 2.876 -1.407 1.00 0.00 N ATOM 1495 CA PHE B 45 -8.581 2.911 -2.797 1.00 0.00 C ATOM 1496 C PHE B 45 -9.203 4.267 -3.105 1.00 0.00 C ATOM 1497 O PHE B 45 -9.909 4.836 -2.273 1.00 0.00 O ATOM 1498 CB PHE B 45 -9.581 1.788 -3.083 1.00 0.00 C ATOM 1499 CG PHE B 45 -10.003 1.711 -4.526 1.00 0.00 C ATOM 1500 CD1 PHE B 45 -9.057 1.722 -5.540 1.00 0.00 C ATOM 1501 CD2 PHE B 45 -11.342 1.627 -4.867 1.00 0.00 C ATOM 1502 CE1 PHE B 45 -9.440 1.653 -6.865 1.00 0.00 C ATOM 1503 CE2 PHE B 45 -11.732 1.557 -6.192 1.00 0.00 C ATOM 1504 CZ PHE B 45 -10.780 1.570 -7.192 1.00 0.00 C ATOM 0 H PHE B 45 -8.578 3.592 -0.820 1.00 0.00 H new ATOM 0 HA PHE B 45 -7.713 2.761 -3.439 1.00 0.00 H new ATOM 0 HB2 PHE B 45 -9.139 0.836 -2.791 1.00 0.00 H new ATOM 0 HB3 PHE B 45 -10.465 1.933 -2.462 1.00 0.00 H new ATOM 0 HD1 PHE B 45 -8.008 1.785 -5.290 1.00 0.00 H new ATOM 0 HD2 PHE B 45 -12.091 1.616 -4.089 1.00 0.00 H new ATOM 0 HE1 PHE B 45 -8.693 1.664 -7.645 1.00 0.00 H new ATOM 0 HE2 PHE B 45 -12.780 1.492 -6.444 1.00 0.00 H new ATOM 0 HZ PHE B 45 -11.082 1.515 -8.227 1.00 0.00 H new ATOM 1514 N ALA B 46 -8.920 4.794 -4.288 1.00 0.00 N ATOM 1515 CA ALA B 46 -9.442 6.095 -4.679 1.00 0.00 C ATOM 1516 C ALA B 46 -8.955 7.171 -3.712 1.00 0.00 C ATOM 1517 O ALA B 46 -9.642 8.161 -3.463 1.00 0.00 O ATOM 1518 CB ALA B 46 -10.963 6.069 -4.729 1.00 0.00 C ATOM 0 H ALA B 46 -8.334 4.343 -4.991 1.00 0.00 H new ATOM 0 HA ALA B 46 -9.073 6.332 -5.677 1.00 0.00 H new ATOM 0 HB1 ALA B 46 -11.334 7.051 -5.023 1.00 0.00 H new ATOM 0 HB2 ALA B 46 -11.291 5.325 -5.455 1.00 0.00 H new ATOM 0 HB3 ALA B 46 -11.355 5.813 -3.745 1.00 0.00 H new ATOM 1524 N GLY B 47 -7.753 6.963 -3.180 1.00 0.00 N ATOM 1525 CA GLY B 47 -7.162 7.910 -2.252 1.00 0.00 C ATOM 1526 C GLY B 47 -7.685 7.786 -0.828 1.00 0.00 C ATOM 1527 O GLY B 47 -7.494 8.697 -0.023 1.00 0.00 O ATOM 0 H GLY B 47 -7.174 6.147 -3.378 1.00 0.00 H new ATOM 0 HA2 GLY B 47 -6.081 7.771 -2.245 1.00 0.00 H new ATOM 0 HA3 GLY B 47 -7.351 8.922 -2.611 1.00 0.00 H new ATOM 1531 N LYS B 48 -8.333 6.664 -0.503 1.00 0.00 N ATOM 1532 CA LYS B 48 -8.854 6.462 0.852 1.00 0.00 C ATOM 1533 C LYS B 48 -9.411 5.055 1.053 1.00 0.00 C ATOM 1534 O LYS B 48 -10.010 4.476 0.149 1.00 0.00 O ATOM 1535 CB LYS B 48 -9.930 7.500 1.180 1.00 0.00 C ATOM 1536 CG LYS B 48 -10.644 7.236 2.498 1.00 0.00 C ATOM 1537 CD LYS B 48 -11.479 8.428 2.937 1.00 0.00 C ATOM 1538 CE LYS B 48 -12.583 8.744 1.939 1.00 0.00 C ATOM 1539 NZ LYS B 48 -13.413 9.899 2.378 1.00 0.00 N ATOM 0 H LYS B 48 -8.508 5.893 -1.148 1.00 0.00 H new ATOM 0 HA LYS B 48 -8.013 6.587 1.535 1.00 0.00 H new ATOM 0 HB2 LYS B 48 -9.472 8.488 1.215 1.00 0.00 H new ATOM 0 HB3 LYS B 48 -10.664 7.518 0.375 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -11.286 6.361 2.395 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -9.909 7.003 3.269 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -11.919 8.223 3.913 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -10.835 9.299 3.054 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -12.142 8.963 0.967 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -13.219 7.868 1.811 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 -14.154 10.083 1.671 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 -13.855 9.681 3.294 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 -12.811 10.742 2.476 1.00 0.00 H new ATOM 1553 N GLN B 49 -9.219 4.522 2.257 1.00 0.00 N ATOM 1554 CA GLN B 49 -9.709 3.190 2.596 1.00 0.00 C ATOM 1555 C GLN B 49 -11.207 3.088 2.332 1.00 0.00 C ATOM 1556 O GLN B 49 -11.974 3.972 2.718 1.00 0.00 O ATOM 1557 CB GLN B 49 -9.426 2.882 4.067 1.00 0.00 C ATOM 1558 CG GLN B 49 -7.961 3.013 4.449 1.00 0.00 C ATOM 1559 CD GLN B 49 -7.714 2.719 5.917 1.00 0.00 C ATOM 1560 OE1 GLN B 49 -7.977 1.614 6.393 1.00 0.00 O ATOM 1561 NE2 GLN B 49 -7.214 3.710 6.645 1.00 0.00 N ATOM 0 H GLN B 49 -8.726 4.994 3.015 1.00 0.00 H new ATOM 0 HA GLN B 49 -9.189 2.465 1.970 1.00 0.00 H new ATOM 0 HB2 GLN B 49 -10.016 3.555 4.690 1.00 0.00 H new ATOM 0 HB3 GLN B 49 -9.760 1.868 4.287 1.00 0.00 H new ATOM 0 HG2 GLN B 49 -7.368 2.330 3.840 1.00 0.00 H new ATOM 0 HG3 GLN B 49 -7.619 4.022 4.221 1.00 0.00 H new ATOM 0 HE21 GLN B 49 -7.011 4.610 6.210 1.00 0.00 H new ATOM 0 HE22 GLN B 49 -7.033 3.572 7.639 1.00 0.00 H new ATOM 1570 N LEU B 50 -11.623 2.010 1.672 1.00 0.00 N ATOM 1571 CA LEU B 50 -13.036 1.812 1.363 1.00 0.00 C ATOM 1572 C LEU B 50 -13.840 1.551 2.633 1.00 0.00 C ATOM 1573 O LEU B 50 -13.473 0.708 3.452 1.00 0.00 O ATOM 1574 CB LEU B 50 -13.209 0.657 0.372 1.00 0.00 C ATOM 1575 CG LEU B 50 -12.445 0.819 -0.946 1.00 0.00 C ATOM 1576 CD1 LEU B 50 -12.704 -0.363 -1.868 1.00 0.00 C ATOM 1577 CD2 LEU B 50 -12.832 2.121 -1.628 1.00 0.00 C ATOM 0 H LEU B 50 -11.007 1.266 1.343 1.00 0.00 H new ATOM 0 HA LEU B 50 -13.415 2.725 0.904 1.00 0.00 H new ATOM 0 HB2 LEU B 50 -12.885 -0.266 0.852 1.00 0.00 H new ATOM 0 HB3 LEU B 50 -14.270 0.545 0.149 1.00 0.00 H new ATOM 0 HG LEU B 50 -11.379 0.849 -0.721 1.00 0.00 H new ATOM 0 HD11 LEU B 50 -12.152 -0.227 -2.798 1.00 0.00 H new ATOM 0 HD12 LEU B 50 -12.376 -1.282 -1.382 1.00 0.00 H new ATOM 0 HD13 LEU B 50 -13.770 -0.428 -2.085 1.00 0.00 H new ATOM 0 HD21 LEU B 50 -12.280 2.220 -2.563 1.00 0.00 H new ATOM 0 HD22 LEU B 50 -13.902 2.118 -1.837 1.00 0.00 H new ATOM 0 HD23 LEU B 50 -12.592 2.960 -0.974 1.00 0.00 H new ATOM 1589 N GLU B 51 -14.936 2.289 2.789 1.00 0.00 N ATOM 1590 CA GLU B 51 -15.798 2.158 3.961 1.00 0.00 C ATOM 1591 C GLU B 51 -16.374 0.750 4.074 1.00 0.00 C ATOM 1592 O GLU B 51 -16.790 0.154 3.080 1.00 0.00 O ATOM 1593 CB GLU B 51 -16.933 3.182 3.900 1.00 0.00 C ATOM 1594 CG GLU B 51 -16.449 4.623 3.900 1.00 0.00 C ATOM 1595 CD GLU B 51 -17.588 5.622 3.830 1.00 0.00 C ATOM 1596 OE1 GLU B 51 -18.445 5.610 4.738 1.00 0.00 O ATOM 1597 OE2 GLU B 51 -17.622 6.415 2.866 1.00 0.00 O ATOM 0 H GLU B 51 -15.249 2.987 2.115 1.00 0.00 H new ATOM 0 HA GLU B 51 -15.189 2.347 4.845 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -17.523 3.005 3.001 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -17.596 3.029 4.752 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -15.865 4.806 4.802 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -15.782 4.778 3.052 1.00 0.00 H new ATOM 1604 N ASP B 52 -16.392 0.226 5.298 1.00 0.00 N ATOM 1605 CA ASP B 52 -16.913 -1.111 5.560 1.00 0.00 C ATOM 1606 C ASP B 52 -18.439 -1.109 5.630 1.00 0.00 C ATOM 1607 O ASP B 52 -19.024 -1.627 6.581 1.00 0.00 O ATOM 1608 CB ASP B 52 -16.337 -1.656 6.870 1.00 0.00 C ATOM 1609 CG ASP B 52 -14.821 -1.699 6.871 1.00 0.00 C ATOM 1610 OD1 ASP B 52 -14.214 -1.290 5.859 1.00 0.00 O ATOM 1611 OD2 ASP B 52 -14.240 -2.141 7.884 1.00 0.00 O ATOM 0 H ASP B 52 -16.049 0.711 6.127 1.00 0.00 H new ATOM 0 HA ASP B 52 -16.609 -1.754 4.734 1.00 0.00 H new ATOM 0 HB2 ASP B 52 -16.679 -1.035 7.698 1.00 0.00 H new ATOM 0 HB3 ASP B 52 -16.725 -2.660 7.043 1.00 0.00 H new ATOM 1616 N GLY B 53 -19.082 -0.522 4.625 1.00 0.00 N ATOM 1617 CA GLY B 53 -20.532 -0.474 4.611 1.00 0.00 C ATOM 1618 C GLY B 53 -21.087 0.209 3.377 1.00 0.00 C ATOM 1619 O GLY B 53 -21.980 1.051 3.478 1.00 0.00 O ATOM 0 H GLY B 53 -18.628 -0.081 3.825 1.00 0.00 H new ATOM 0 HA2 GLY B 53 -20.925 -1.489 4.666 1.00 0.00 H new ATOM 0 HA3 GLY B 53 -20.882 0.052 5.500 1.00 0.00 H new ATOM 1623 N ARG B 54 -20.561 -0.159 2.211 1.00 0.00 N ATOM 1624 CA ARG B 54 -21.010 0.423 0.949 1.00 0.00 C ATOM 1625 C ARG B 54 -20.810 -0.550 -0.207 1.00 0.00 C ATOM 1626 O ARG B 54 -19.756 -1.170 -0.336 1.00 0.00 O ATOM 1627 CB ARG B 54 -20.262 1.726 0.657 1.00 0.00 C ATOM 1628 CG ARG B 54 -20.603 2.856 1.613 1.00 0.00 C ATOM 1629 CD ARG B 54 -19.881 4.141 1.239 1.00 0.00 C ATOM 1630 NE ARG B 54 -20.276 5.259 2.092 1.00 0.00 N ATOM 1631 CZ ARG B 54 -21.510 5.756 2.137 1.00 0.00 C ATOM 1632 NH1 ARG B 54 -22.465 5.248 1.369 1.00 0.00 N ATOM 1633 NH2 ARG B 54 -21.789 6.766 2.950 1.00 0.00 N ATOM 0 H ARG B 54 -19.824 -0.857 2.114 1.00 0.00 H new ATOM 0 HA ARG B 54 -22.075 0.636 1.047 1.00 0.00 H new ATOM 0 HB2 ARG B 54 -19.190 1.536 0.701 1.00 0.00 H new ATOM 0 HB3 ARG B 54 -20.488 2.043 -0.361 1.00 0.00 H new ATOM 0 HG2 ARG B 54 -21.679 3.027 1.606 1.00 0.00 H new ATOM 0 HG3 ARG B 54 -20.333 2.568 2.629 1.00 0.00 H new ATOM 0 HD2 ARG B 54 -18.805 3.988 1.317 1.00 0.00 H new ATOM 0 HD3 ARG B 54 -20.093 4.386 0.198 1.00 0.00 H new ATOM 0 HE ARG B 54 -19.565 5.683 2.688 1.00 0.00 H new ATOM 0 HH11 ARG B 54 -22.255 4.473 0.740 1.00 0.00 H new ATOM 0 HH12 ARG B 54 -23.409 5.633 1.407 1.00 0.00 H new ATOM 0 HH21 ARG B 54 -21.058 7.162 3.541 1.00 0.00 H new ATOM 0 HH22 ARG B 54 -22.735 7.147 2.984 1.00 0.00 H new ATOM 1647 N THR B 55 -21.831 -0.670 -1.048 1.00 0.00 N ATOM 1648 CA THR B 55 -21.776 -1.559 -2.200 1.00 0.00 C ATOM 1649 C THR B 55 -20.764 -1.063 -3.228 1.00 0.00 C ATOM 1650 O THR B 55 -20.547 0.141 -3.368 1.00 0.00 O ATOM 1651 CB THR B 55 -23.154 -1.689 -2.874 1.00 0.00 C ATOM 1652 OG1 THR B 55 -23.607 -0.403 -3.316 1.00 0.00 O ATOM 1653 CG2 THR B 55 -24.171 -2.289 -1.916 1.00 0.00 C ATOM 0 H THR B 55 -22.709 -0.160 -0.952 1.00 0.00 H new ATOM 0 HA THR B 55 -21.466 -2.537 -1.832 1.00 0.00 H new ATOM 0 HB THR B 55 -23.052 -2.353 -3.733 1.00 0.00 H new ATOM 0 HG1 THR B 55 -24.483 -0.495 -3.745 1.00 0.00 H new ATOM 0 HG21 THR B 55 -25.137 -2.371 -2.415 1.00 0.00 H new ATOM 0 HG22 THR B 55 -23.838 -3.279 -1.605 1.00 0.00 H new ATOM 0 HG23 THR B 55 -24.268 -1.648 -1.040 1.00 0.00 H new ATOM 1661 N LEU B 56 -20.150 -2.001 -3.945 1.00 0.00 N ATOM 1662 CA LEU B 56 -19.161 -1.668 -4.967 1.00 0.00 C ATOM 1663 C LEU B 56 -19.701 -0.611 -5.927 1.00 0.00 C ATOM 1664 O LEU B 56 -18.951 0.223 -6.436 1.00 0.00 O ATOM 1665 CB LEU B 56 -18.766 -2.925 -5.745 1.00 0.00 C ATOM 1666 CG LEU B 56 -18.035 -3.992 -4.929 1.00 0.00 C ATOM 1667 CD1 LEU B 56 -17.918 -5.283 -5.725 1.00 0.00 C ATOM 1668 CD2 LEU B 56 -16.656 -3.497 -4.519 1.00 0.00 C ATOM 0 H LEU B 56 -20.321 -3.001 -3.837 1.00 0.00 H new ATOM 0 HA LEU B 56 -18.281 -1.261 -4.469 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -19.667 -3.368 -6.169 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -18.131 -2.631 -6.581 1.00 0.00 H new ATOM 0 HG LEU B 56 -18.614 -4.192 -4.027 1.00 0.00 H new ATOM 0 HD11 LEU B 56 -17.395 -6.031 -5.130 1.00 0.00 H new ATOM 0 HD12 LEU B 56 -18.914 -5.648 -5.974 1.00 0.00 H new ATOM 0 HD13 LEU B 56 -17.361 -5.095 -6.643 1.00 0.00 H new ATOM 0 HD21 LEU B 56 -16.150 -4.269 -3.939 1.00 0.00 H new ATOM 0 HD22 LEU B 56 -16.071 -3.271 -5.410 1.00 0.00 H new ATOM 0 HD23 LEU B 56 -16.758 -2.596 -3.913 1.00 0.00 H new ATOM 1680 N SER B 57 -21.007 -0.658 -6.172 1.00 0.00 N ATOM 1681 CA SER B 57 -21.657 0.288 -7.073 1.00 0.00 C ATOM 1682 C SER B 57 -21.418 1.733 -6.637 1.00 0.00 C ATOM 1683 O SER B 57 -21.219 2.614 -7.474 1.00 0.00 O ATOM 1684 CB SER B 57 -23.160 0.009 -7.137 1.00 0.00 C ATOM 1685 OG SER B 57 -23.814 0.924 -7.998 1.00 0.00 O ATOM 0 H SER B 57 -21.638 -1.344 -5.757 1.00 0.00 H new ATOM 0 HA SER B 57 -21.220 0.156 -8.063 1.00 0.00 H new ATOM 0 HB2 SER B 57 -23.329 -1.009 -7.488 1.00 0.00 H new ATOM 0 HB3 SER B 57 -23.588 0.077 -6.137 1.00 0.00 H new ATOM 0 HG SER B 57 -24.773 0.723 -8.022 1.00 0.00 H new ATOM 1691 N ASP B 58 -21.450 1.971 -5.327 1.00 0.00 N ATOM 1692 CA ASP B 58 -21.248 3.314 -4.789 1.00 0.00 C ATOM 1693 C ASP B 58 -19.952 3.931 -5.308 1.00 0.00 C ATOM 1694 O ASP B 58 -19.965 5.000 -5.918 1.00 0.00 O ATOM 1695 CB ASP B 58 -21.228 3.274 -3.259 1.00 0.00 C ATOM 1696 CG ASP B 58 -21.009 4.643 -2.648 1.00 0.00 C ATOM 1697 OD1 ASP B 58 -21.838 5.544 -2.898 1.00 0.00 O ATOM 1698 OD2 ASP B 58 -20.010 4.816 -1.919 1.00 0.00 O ATOM 0 H ASP B 58 -21.613 1.253 -4.621 1.00 0.00 H new ATOM 0 HA ASP B 58 -22.079 3.935 -5.123 1.00 0.00 H new ATOM 0 HB2 ASP B 58 -22.171 2.864 -2.897 1.00 0.00 H new ATOM 0 HB3 ASP B 58 -20.439 2.600 -2.926 1.00 0.00 H new ATOM 1703 N TYR B 59 -18.835 3.250 -5.072 1.00 0.00 N ATOM 1704 CA TYR B 59 -17.537 3.734 -5.527 1.00 0.00 C ATOM 1705 C TYR B 59 -17.373 3.509 -7.024 1.00 0.00 C ATOM 1706 O TYR B 59 -16.421 3.998 -7.634 1.00 0.00 O ATOM 1707 CB TYR B 59 -16.397 3.037 -4.777 1.00 0.00 C ATOM 1708 CG TYR B 59 -16.392 3.290 -3.286 1.00 0.00 C ATOM 1709 CD1 TYR B 59 -17.356 2.728 -2.459 1.00 0.00 C ATOM 1710 CD2 TYR B 59 -15.410 4.083 -2.704 1.00 0.00 C ATOM 1711 CE1 TYR B 59 -17.344 2.953 -1.096 1.00 0.00 C ATOM 1712 CE2 TYR B 59 -15.392 4.312 -1.340 1.00 0.00 C ATOM 1713 CZ TYR B 59 -16.362 3.745 -0.542 1.00 0.00 C ATOM 1714 OH TYR B 59 -16.347 3.970 0.815 1.00 0.00 O ATOM 0 H TYR B 59 -18.803 2.363 -4.569 1.00 0.00 H new ATOM 0 HA TYR B 59 -17.493 4.803 -5.319 1.00 0.00 H new ATOM 0 HB2 TYR B 59 -16.465 1.963 -4.952 1.00 0.00 H new ATOM 0 HB3 TYR B 59 -15.446 3.369 -5.194 1.00 0.00 H new ATOM 0 HD1 TYR B 59 -18.127 2.105 -2.888 1.00 0.00 H new ATOM 0 HD2 TYR B 59 -14.648 4.528 -3.327 1.00 0.00 H new ATOM 0 HE1 TYR B 59 -18.102 2.510 -0.467 1.00 0.00 H new ATOM 0 HE2 TYR B 59 -14.623 4.931 -0.903 1.00 0.00 H new ATOM 0 HH TYR B 59 -16.428 4.931 0.988 1.00 0.00 H new ATOM 1724 N ASN B 60 -18.295 2.746 -7.604 1.00 0.00 N ATOM 1725 CA ASN B 60 -18.246 2.430 -9.027 1.00 0.00 C ATOM 1726 C ASN B 60 -16.949 1.686 -9.332 1.00 0.00 C ATOM 1727 O ASN B 60 -16.290 1.933 -10.340 1.00 0.00 O ATOM 1728 CB ASN B 60 -18.347 3.707 -9.870 1.00 0.00 C ATOM 1729 CG ASN B 60 -18.653 3.424 -11.331 1.00 0.00 C ATOM 1730 OD1 ASN B 60 -17.877 2.772 -12.030 1.00 0.00 O ATOM 1731 ND2 ASN B 60 -19.793 3.916 -11.800 1.00 0.00 N ATOM 0 H ASN B 60 -19.086 2.335 -7.109 1.00 0.00 H new ATOM 0 HA ASN B 60 -19.094 1.795 -9.283 1.00 0.00 H new ATOM 0 HB2 ASN B 60 -19.126 4.349 -9.458 1.00 0.00 H new ATOM 0 HB3 ASN B 60 -17.409 4.259 -9.800 1.00 0.00 H new ATOM 0 HD21 ASN B 60 -20.054 3.759 -12.773 1.00 0.00 H new ATOM 0 HD22 ASN B 60 -20.408 4.451 -11.187 1.00 0.00 H new ATOM 1738 N ILE B 61 -16.590 0.777 -8.431 1.00 0.00 N ATOM 1739 CA ILE B 61 -15.373 -0.010 -8.571 1.00 0.00 C ATOM 1740 C ILE B 61 -15.432 -0.912 -9.799 1.00 0.00 C ATOM 1741 O ILE B 61 -16.360 -1.705 -9.960 1.00 0.00 O ATOM 1742 CB ILE B 61 -15.129 -0.868 -7.312 1.00 0.00 C ATOM 1743 CG1 ILE B 61 -14.905 0.033 -6.096 1.00 0.00 C ATOM 1744 CG2 ILE B 61 -13.946 -1.805 -7.516 1.00 0.00 C ATOM 1745 CD1 ILE B 61 -14.708 -0.727 -4.801 1.00 0.00 C ATOM 0 H ILE B 61 -17.130 0.567 -7.591 1.00 0.00 H new ATOM 0 HA ILE B 61 -14.547 0.690 -8.694 1.00 0.00 H new ATOM 0 HB ILE B 61 -16.013 -1.480 -7.133 1.00 0.00 H new ATOM 0 HG12 ILE B 61 -14.031 0.659 -6.275 1.00 0.00 H new ATOM 0 HG13 ILE B 61 -15.759 0.701 -5.988 1.00 0.00 H new ATOM 0 HG21 ILE B 61 -13.793 -2.400 -6.615 1.00 0.00 H new ATOM 0 HG22 ILE B 61 -14.147 -2.467 -8.358 1.00 0.00 H new ATOM 0 HG23 ILE B 61 -13.049 -1.220 -7.721 1.00 0.00 H new ATOM 0 HD11 ILE B 61 -14.555 -0.021 -3.985 1.00 0.00 H new ATOM 0 HD12 ILE B 61 -15.591 -1.333 -4.597 1.00 0.00 H new ATOM 0 HD13 ILE B 61 -13.836 -1.375 -4.888 1.00 0.00 H new ATOM 1757 N GLN B 62 -14.428 -0.782 -10.661 1.00 0.00 N ATOM 1758 CA GLN B 62 -14.350 -1.583 -11.877 1.00 0.00 C ATOM 1759 C GLN B 62 -13.780 -2.965 -11.579 1.00 0.00 C ATOM 1760 O GLN B 62 -12.931 -3.120 -10.700 1.00 0.00 O ATOM 1761 CB GLN B 62 -13.491 -0.876 -12.928 1.00 0.00 C ATOM 1762 CG GLN B 62 -12.060 -0.622 -12.482 1.00 0.00 C ATOM 1763 CD GLN B 62 -11.245 0.103 -13.535 1.00 0.00 C ATOM 1764 OE1 GLN B 62 -11.579 1.217 -13.936 1.00 0.00 O ATOM 1765 NE2 GLN B 62 -10.170 -0.529 -13.990 1.00 0.00 N ATOM 0 H GLN B 62 -13.655 -0.127 -10.539 1.00 0.00 H new ATOM 0 HA GLN B 62 -15.360 -1.703 -12.269 1.00 0.00 H new ATOM 0 HB2 GLN B 62 -13.477 -1.478 -13.837 1.00 0.00 H new ATOM 0 HB3 GLN B 62 -13.956 0.076 -13.183 1.00 0.00 H new ATOM 0 HG2 GLN B 62 -12.068 -0.034 -11.564 1.00 0.00 H new ATOM 0 HG3 GLN B 62 -11.581 -1.573 -12.247 1.00 0.00 H new ATOM 0 HE21 GLN B 62 -9.930 -1.452 -13.629 1.00 0.00 H new ATOM 0 HE22 GLN B 62 -9.584 -0.091 -14.701 1.00 0.00 H new ATOM 1774 N LYS B 63 -14.254 -3.966 -12.315 1.00 0.00 N ATOM 1775 CA LYS B 63 -13.794 -5.339 -12.132 1.00 0.00 C ATOM 1776 C LYS B 63 -12.270 -5.419 -12.166 1.00 0.00 C ATOM 1777 O LYS B 63 -11.619 -4.723 -12.947 1.00 0.00 O ATOM 1778 CB LYS B 63 -14.391 -6.242 -13.215 1.00 0.00 C ATOM 1779 CG LYS B 63 -14.054 -5.799 -14.628 1.00 0.00 C ATOM 1780 CD LYS B 63 -14.707 -6.700 -15.663 1.00 0.00 C ATOM 1781 CE LYS B 63 -14.370 -6.263 -17.080 1.00 0.00 C ATOM 1782 NZ LYS B 63 -14.814 -4.868 -17.352 1.00 0.00 N ATOM 0 H LYS B 63 -14.957 -3.852 -13.045 1.00 0.00 H new ATOM 0 HA LYS B 63 -14.130 -5.681 -11.153 1.00 0.00 H new ATOM 0 HB2 LYS B 63 -14.031 -7.260 -13.067 1.00 0.00 H new ATOM 0 HB3 LYS B 63 -15.475 -6.267 -13.099 1.00 0.00 H new ATOM 0 HG2 LYS B 63 -14.385 -4.771 -14.777 1.00 0.00 H new ATOM 0 HG3 LYS B 63 -12.973 -5.809 -14.766 1.00 0.00 H new ATOM 0 HD2 LYS B 63 -14.377 -7.728 -15.511 1.00 0.00 H new ATOM 0 HD3 LYS B 63 -15.788 -6.688 -15.526 1.00 0.00 H new ATOM 0 HE2 LYS B 63 -13.294 -6.338 -17.237 1.00 0.00 H new ATOM 0 HE3 LYS B 63 -14.844 -6.940 -17.791 1.00 0.00 H new ATOM 0 HZ1 LYS B 63 -14.786 -4.688 -18.376 1.00 0.00 H new ATOM 0 HZ2 LYS B 63 -15.786 -4.739 -17.004 1.00 0.00 H new ATOM 0 HZ3 LYS B 63 -14.181 -4.201 -16.866 1.00 0.00 H new ATOM 1796 N GLU B 64 -11.711 -6.266 -11.305 1.00 0.00 N ATOM 1797 CA GLU B 64 -10.264 -6.442 -11.218 1.00 0.00 C ATOM 1798 C GLU B 64 -9.578 -5.142 -10.811 1.00 0.00 C ATOM 1799 O GLU B 64 -8.512 -4.803 -11.324 1.00 0.00 O ATOM 1800 CB GLU B 64 -9.699 -6.937 -12.552 1.00 0.00 C ATOM 1801 CG GLU B 64 -10.246 -8.287 -12.984 1.00 0.00 C ATOM 1802 CD GLU B 64 -9.676 -8.747 -14.311 1.00 0.00 C ATOM 1803 OE1 GLU B 64 -9.875 -8.038 -15.321 1.00 0.00 O ATOM 1804 OE2 GLU B 64 -9.028 -9.813 -14.341 1.00 0.00 O ATOM 0 H GLU B 64 -12.242 -6.844 -10.654 1.00 0.00 H new ATOM 0 HA GLU B 64 -10.065 -7.191 -10.452 1.00 0.00 H new ATOM 0 HB2 GLU B 64 -9.920 -6.201 -13.325 1.00 0.00 H new ATOM 0 HB3 GLU B 64 -8.614 -7.003 -12.475 1.00 0.00 H new ATOM 0 HG2 GLU B 64 -10.020 -9.029 -12.218 1.00 0.00 H new ATOM 0 HG3 GLU B 64 -11.332 -8.228 -13.060 1.00 0.00 H new ATOM 1811 N SER B 65 -10.195 -4.420 -9.880 1.00 0.00 N ATOM 1812 CA SER B 65 -9.640 -3.160 -9.396 1.00 0.00 C ATOM 1813 C SER B 65 -8.399 -3.400 -8.544 1.00 0.00 C ATOM 1814 O SER B 65 -8.368 -4.314 -7.716 1.00 0.00 O ATOM 1815 CB SER B 65 -10.686 -2.389 -8.588 1.00 0.00 C ATOM 1816 OG SER B 65 -10.135 -1.199 -8.054 1.00 0.00 O ATOM 0 H SER B 65 -11.079 -4.686 -9.446 1.00 0.00 H new ATOM 0 HA SER B 65 -9.353 -2.566 -10.264 1.00 0.00 H new ATOM 0 HB2 SER B 65 -11.537 -2.147 -9.224 1.00 0.00 H new ATOM 0 HB3 SER B 65 -11.061 -3.016 -7.779 1.00 0.00 H new ATOM 0 HG SER B 65 -10.832 -0.512 -7.999 1.00 0.00 H new ATOM 1822 N THR B 66 -7.377 -2.575 -8.753 1.00 0.00 N ATOM 1823 CA THR B 66 -6.130 -2.691 -8.006 1.00 0.00 C ATOM 1824 C THR B 66 -6.215 -1.954 -6.672 1.00 0.00 C ATOM 1825 O THR B 66 -5.817 -0.793 -6.566 1.00 0.00 O ATOM 1826 CB THR B 66 -4.938 -2.138 -8.814 1.00 0.00 C ATOM 1827 OG1 THR B 66 -4.834 -2.829 -10.065 1.00 0.00 O ATOM 1828 CG2 THR B 66 -3.636 -2.288 -8.039 1.00 0.00 C ATOM 0 H THR B 66 -7.389 -1.817 -9.436 1.00 0.00 H new ATOM 0 HA THR B 66 -5.971 -3.753 -7.819 1.00 0.00 H new ATOM 0 HB THR B 66 -5.113 -1.077 -8.994 1.00 0.00 H new ATOM 0 HG1 THR B 66 -4.076 -2.472 -10.574 1.00 0.00 H new ATOM 0 HG21 THR B 66 -2.812 -1.890 -8.631 1.00 0.00 H new ATOM 0 HG22 THR B 66 -3.706 -1.739 -7.100 1.00 0.00 H new ATOM 0 HG23 THR B 66 -3.457 -3.343 -7.830 1.00 0.00 H new ATOM 1836 N LEU B 67 -6.727 -2.635 -5.651 1.00 0.00 N ATOM 1837 CA LEU B 67 -6.849 -2.039 -4.325 1.00 0.00 C ATOM 1838 C LEU B 67 -5.556 -2.210 -3.542 1.00 0.00 C ATOM 1839 O LEU B 67 -4.919 -3.262 -3.598 1.00 0.00 O ATOM 1840 CB LEU B 67 -8.009 -2.660 -3.537 1.00 0.00 C ATOM 1841 CG LEU B 67 -9.414 -2.285 -4.015 1.00 0.00 C ATOM 1842 CD1 LEU B 67 -9.681 -2.834 -5.406 1.00 0.00 C ATOM 1843 CD2 LEU B 67 -10.458 -2.793 -3.033 1.00 0.00 C ATOM 0 H LEU B 67 -7.063 -3.596 -5.716 1.00 0.00 H new ATOM 0 HA LEU B 67 -7.052 -0.977 -4.462 1.00 0.00 H new ATOM 0 HB2 LEU B 67 -7.910 -3.745 -3.575 1.00 0.00 H new ATOM 0 HB3 LEU B 67 -7.911 -2.368 -2.492 1.00 0.00 H new ATOM 0 HG LEU B 67 -9.478 -1.198 -4.064 1.00 0.00 H new ATOM 0 HD11 LEU B 67 -10.686 -2.553 -5.721 1.00 0.00 H new ATOM 0 HD12 LEU B 67 -8.953 -2.423 -6.105 1.00 0.00 H new ATOM 0 HD13 LEU B 67 -9.596 -3.921 -5.391 1.00 0.00 H new ATOM 0 HD21 LEU B 67 -11.453 -2.519 -3.385 1.00 0.00 H new ATOM 0 HD22 LEU B 67 -10.387 -3.878 -2.955 1.00 0.00 H new ATOM 0 HD23 LEU B 67 -10.284 -2.346 -2.054 1.00 0.00 H new ATOM 1855 N HIS B 68 -5.171 -1.169 -2.816 1.00 0.00 N ATOM 1856 CA HIS B 68 -3.953 -1.209 -2.021 1.00 0.00 C ATOM 1857 C HIS B 68 -4.252 -1.593 -0.578 1.00 0.00 C ATOM 1858 O HIS B 68 -5.260 -1.173 -0.008 1.00 0.00 O ATOM 1859 CB HIS B 68 -3.239 0.138 -2.067 1.00 0.00 C ATOM 1860 CG HIS B 68 -2.665 0.471 -3.410 1.00 0.00 C ATOM 1861 ND1 HIS B 68 -1.911 1.601 -3.643 1.00 0.00 N ATOM 1862 CD2 HIS B 68 -2.729 -0.186 -4.592 1.00 0.00 C ATOM 1863 CE1 HIS B 68 -1.537 1.624 -4.907 1.00 0.00 C ATOM 1864 NE2 HIS B 68 -2.019 0.552 -5.505 1.00 0.00 N ATOM 0 H HIS B 68 -5.684 -0.289 -2.762 1.00 0.00 H new ATOM 0 HA HIS B 68 -3.300 -1.969 -2.449 1.00 0.00 H new ATOM 0 HB2 HIS B 68 -3.940 0.921 -1.777 1.00 0.00 H new ATOM 0 HB3 HIS B 68 -2.437 0.139 -1.329 1.00 0.00 H new ATOM 0 HD2 HIS B 68 -3.243 -1.117 -4.781 1.00 0.00 H new ATOM 0 HE1 HIS B 68 -0.937 2.391 -5.374 1.00 0.00 H new ATOM 0 HE2 HIS B 68 -1.886 0.311 -6.487 1.00 0.00 H new ATOM 1873 N LEU B 69 -3.368 -2.391 0.008 1.00 0.00 N ATOM 1874 CA LEU B 69 -3.530 -2.830 1.387 1.00 0.00 C ATOM 1875 C LEU B 69 -2.332 -2.403 2.227 1.00 0.00 C ATOM 1876 O LEU B 69 -1.196 -2.792 1.949 1.00 0.00 O ATOM 1877 CB LEU B 69 -3.691 -4.353 1.440 1.00 0.00 C ATOM 1878 CG LEU B 69 -3.863 -4.945 2.841 1.00 0.00 C ATOM 1879 CD1 LEU B 69 -5.133 -4.425 3.493 1.00 0.00 C ATOM 1880 CD2 LEU B 69 -3.880 -6.465 2.777 1.00 0.00 C ATOM 0 H LEU B 69 -2.530 -2.748 -0.452 1.00 0.00 H new ATOM 0 HA LEU B 69 -4.426 -2.364 1.796 1.00 0.00 H new ATOM 0 HB2 LEU B 69 -4.556 -4.631 0.837 1.00 0.00 H new ATOM 0 HB3 LEU B 69 -2.818 -4.810 0.975 1.00 0.00 H new ATOM 0 HG LEU B 69 -3.015 -4.633 3.451 1.00 0.00 H new ATOM 0 HD11 LEU B 69 -5.235 -4.859 4.488 1.00 0.00 H new ATOM 0 HD12 LEU B 69 -5.082 -3.339 3.574 1.00 0.00 H new ATOM 0 HD13 LEU B 69 -5.994 -4.704 2.886 1.00 0.00 H new ATOM 0 HD21 LEU B 69 -4.003 -6.870 3.781 1.00 0.00 H new ATOM 0 HD22 LEU B 69 -4.708 -6.793 2.149 1.00 0.00 H new ATOM 0 HD23 LEU B 69 -2.941 -6.822 2.354 1.00 0.00 H new ATOM 1892 N VAL B 70 -2.591 -1.603 3.254 1.00 0.00 N ATOM 1893 CA VAL B 70 -1.533 -1.123 4.135 1.00 0.00 C ATOM 1894 C VAL B 70 -1.694 -1.694 5.541 1.00 0.00 C ATOM 1895 O VAL B 70 -2.750 -1.560 6.157 1.00 0.00 O ATOM 1896 CB VAL B 70 -1.522 0.418 4.204 1.00 0.00 C ATOM 1897 CG1 VAL B 70 -0.455 0.909 5.171 1.00 0.00 C ATOM 1898 CG2 VAL B 70 -1.306 1.013 2.818 1.00 0.00 C ATOM 0 H VAL B 70 -3.525 -1.273 3.498 1.00 0.00 H new ATOM 0 HA VAL B 70 -0.585 -1.463 3.719 1.00 0.00 H new ATOM 0 HB VAL B 70 -2.492 0.750 4.574 1.00 0.00 H new ATOM 0 HG11 VAL B 70 -0.466 1.998 5.203 1.00 0.00 H new ATOM 0 HG12 VAL B 70 -0.657 0.515 6.167 1.00 0.00 H new ATOM 0 HG13 VAL B 70 0.524 0.566 4.837 1.00 0.00 H new ATOM 0 HG21 VAL B 70 -1.301 2.101 2.886 1.00 0.00 H new ATOM 0 HG22 VAL B 70 -0.351 0.670 2.420 1.00 0.00 H new ATOM 0 HG23 VAL B 70 -2.111 0.694 2.156 1.00 0.00 H new ATOM 1908 N LEU B 71 -0.640 -2.331 6.044 1.00 0.00 N ATOM 1909 CA LEU B 71 -0.668 -2.921 7.378 1.00 0.00 C ATOM 1910 C LEU B 71 -0.010 -1.997 8.397 1.00 0.00 C ATOM 1911 O LEU B 71 1.102 -1.516 8.184 1.00 0.00 O ATOM 1912 CB LEU B 71 0.033 -4.285 7.384 1.00 0.00 C ATOM 1913 CG LEU B 71 -0.642 -5.378 6.550 1.00 0.00 C ATOM 1914 CD1 LEU B 71 -0.567 -5.056 5.065 1.00 0.00 C ATOM 1915 CD2 LEU B 71 -0.007 -6.732 6.833 1.00 0.00 C ATOM 0 H LEU B 71 0.243 -2.451 5.548 1.00 0.00 H new ATOM 0 HA LEU B 71 -1.713 -3.060 7.657 1.00 0.00 H new ATOM 0 HB2 LEU B 71 1.052 -4.152 7.020 1.00 0.00 H new ATOM 0 HB3 LEU B 71 0.106 -4.632 8.415 1.00 0.00 H new ATOM 0 HG LEU B 71 -1.693 -5.419 6.835 1.00 0.00 H new ATOM 0 HD11 LEU B 71 -1.054 -5.848 4.496 1.00 0.00 H new ATOM 0 HD12 LEU B 71 -1.071 -4.109 4.872 1.00 0.00 H new ATOM 0 HD13 LEU B 71 0.477 -4.980 4.761 1.00 0.00 H new ATOM 0 HD21 LEU B 71 -0.499 -7.497 6.232 1.00 0.00 H new ATOM 0 HD22 LEU B 71 1.053 -6.697 6.580 1.00 0.00 H new ATOM 0 HD23 LEU B 71 -0.120 -6.973 7.890 1.00 0.00 H new ATOM 1927 N ARG B 72 -0.703 -1.756 9.505 1.00 0.00 N ATOM 1928 CA ARG B 72 -0.183 -0.891 10.558 1.00 0.00 C ATOM 1929 C ARG B 72 0.941 -1.581 11.325 1.00 0.00 C ATOM 1930 O ARG B 72 0.805 -2.728 11.751 1.00 0.00 O ATOM 1931 CB ARG B 72 -1.303 -0.485 11.517 1.00 0.00 C ATOM 1932 CG ARG B 72 -2.421 0.297 10.846 1.00 0.00 C ATOM 1933 CD ARG B 72 -3.488 0.715 11.845 1.00 0.00 C ATOM 1934 NE ARG B 72 -4.568 1.468 11.211 1.00 0.00 N ATOM 1935 CZ ARG B 72 -5.612 1.959 11.874 1.00 0.00 C ATOM 1936 NH1 ARG B 72 -5.716 1.780 13.184 1.00 0.00 N ATOM 1937 NH2 ARG B 72 -6.553 2.630 11.224 1.00 0.00 N ATOM 0 H ARG B 72 -1.625 -2.147 9.697 1.00 0.00 H new ATOM 0 HA ARG B 72 0.222 0.006 10.089 1.00 0.00 H new ATOM 0 HB2 ARG B 72 -1.721 -1.381 11.975 1.00 0.00 H new ATOM 0 HB3 ARG B 72 -0.881 0.117 12.322 1.00 0.00 H new ATOM 0 HG2 ARG B 72 -2.008 1.182 10.362 1.00 0.00 H new ATOM 0 HG3 ARG B 72 -2.873 -0.312 10.063 1.00 0.00 H new ATOM 0 HD2 ARG B 72 -3.899 -0.171 12.328 1.00 0.00 H new ATOM 0 HD3 ARG B 72 -3.034 1.323 12.628 1.00 0.00 H new ATOM 0 HE ARG B 72 -4.519 1.626 10.205 1.00 0.00 H new ATOM 0 HH11 ARG B 72 -4.994 1.264 13.687 1.00 0.00 H new ATOM 0 HH12 ARG B 72 -6.518 2.158 13.688 1.00 0.00 H new ATOM 0 HH21 ARG B 72 -6.476 2.769 10.216 1.00 0.00 H new ATOM 0 HH22 ARG B 72 -7.354 3.007 11.731 1.00 0.00 H new ATOM 1951 N LEU B 73 2.052 -0.871 11.496 1.00 0.00 N ATOM 1952 CA LEU B 73 3.206 -1.403 12.210 1.00 0.00 C ATOM 1953 C LEU B 73 3.019 -1.269 13.722 1.00 0.00 C ATOM 1954 O LEU B 73 3.837 -0.657 14.410 1.00 0.00 O ATOM 1955 CB LEU B 73 4.482 -0.679 11.763 1.00 0.00 C ATOM 1956 CG LEU B 73 5.788 -1.225 12.348 1.00 0.00 C ATOM 1957 CD1 LEU B 73 6.012 -2.665 11.910 1.00 0.00 C ATOM 1958 CD2 LEU B 73 6.961 -0.350 11.932 1.00 0.00 C ATOM 0 H LEU B 73 2.177 0.079 11.147 1.00 0.00 H new ATOM 0 HA LEU B 73 3.300 -2.463 11.972 1.00 0.00 H new ATOM 0 HB2 LEU B 73 4.544 -0.726 10.676 1.00 0.00 H new ATOM 0 HB3 LEU B 73 4.395 0.374 12.033 1.00 0.00 H new ATOM 0 HG LEU B 73 5.712 -1.208 13.435 1.00 0.00 H new ATOM 0 HD11 LEU B 73 6.945 -3.034 12.336 1.00 0.00 H new ATOM 0 HD12 LEU B 73 5.185 -3.284 12.257 1.00 0.00 H new ATOM 0 HD13 LEU B 73 6.067 -2.710 10.822 1.00 0.00 H new ATOM 0 HD21 LEU B 73 7.882 -0.751 12.355 1.00 0.00 H new ATOM 0 HD22 LEU B 73 7.037 -0.336 10.845 1.00 0.00 H new ATOM 0 HD23 LEU B 73 6.805 0.665 12.297 1.00 0.00 H new ATOM 1970 N ARG B 74 1.932 -1.840 14.235 1.00 0.00 N ATOM 1971 CA ARG B 74 1.639 -1.777 15.663 1.00 0.00 C ATOM 1972 C ARG B 74 1.006 -3.079 16.149 1.00 0.00 C ATOM 1973 O ARG B 74 0.141 -3.645 15.484 1.00 0.00 O ATOM 1974 CB ARG B 74 0.705 -0.602 15.966 1.00 0.00 C ATOM 1975 CG ARG B 74 1.260 0.747 15.538 1.00 0.00 C ATOM 1976 CD ARG B 74 0.298 1.876 15.874 1.00 0.00 C ATOM 1977 NE ARG B 74 0.800 3.177 15.438 1.00 0.00 N ATOM 1978 CZ ARG B 74 1.912 3.740 15.905 1.00 0.00 C ATOM 1979 NH1 ARG B 74 2.632 3.127 16.836 1.00 0.00 N ATOM 1980 NH2 ARG B 74 2.303 4.919 15.443 1.00 0.00 N ATOM 0 H ARG B 74 1.242 -2.350 13.684 1.00 0.00 H new ATOM 0 HA ARG B 74 2.581 -1.630 16.192 1.00 0.00 H new ATOM 0 HB2 ARG B 74 -0.248 -0.768 15.464 1.00 0.00 H new ATOM 0 HB3 ARG B 74 0.502 -0.578 17.037 1.00 0.00 H new ATOM 0 HG2 ARG B 74 2.216 0.922 16.032 1.00 0.00 H new ATOM 0 HG3 ARG B 74 1.453 0.739 14.465 1.00 0.00 H new ATOM 0 HD2 ARG B 74 -0.665 1.683 15.401 1.00 0.00 H new ATOM 0 HD3 ARG B 74 0.126 1.897 16.950 1.00 0.00 H new ATOM 0 HE ARG B 74 0.266 3.685 14.733 1.00 0.00 H new ATOM 0 HH11 ARG B 74 2.334 2.221 17.197 1.00 0.00 H new ATOM 0 HH12 ARG B 74 3.483 3.562 17.191 1.00 0.00 H new ATOM 0 HH21 ARG B 74 1.752 5.395 14.729 1.00 0.00 H new ATOM 0 HH22 ARG B 74 3.155 5.350 15.801 1.00 0.00 H new ATOM 1994 N GLY B 75 1.449 -3.545 17.316 1.00 0.00 N ATOM 1995 CA GLY B 75 0.922 -4.776 17.879 1.00 0.00 C ATOM 1996 C GLY B 75 -0.525 -4.646 18.318 1.00 0.00 C ATOM 1997 O GLY B 75 -1.360 -4.120 17.582 1.00 0.00 O ATOM 0 H GLY B 75 2.165 -3.090 17.882 1.00 0.00 H new ATOM 0 HA2 GLY B 75 1.003 -5.573 17.140 1.00 0.00 H new ATOM 0 HA3 GLY B 75 1.532 -5.070 18.733 1.00 0.00 H new ATOM 2001 N GLY B 76 -0.821 -5.131 19.520 1.00 0.00 N ATOM 2002 CA GLY B 76 -2.176 -5.061 20.039 1.00 0.00 C ATOM 2003 C GLY B 76 -2.677 -3.635 20.163 1.00 0.00 C ATOM 2004 O GLY B 76 -3.620 -3.272 19.430 1.00 0.00 O ATOM 2005 OXT GLY B 76 -2.127 -2.882 20.994 1.00 0.00 O ATOM 0 H GLY B 76 -0.146 -5.572 20.145 1.00 0.00 H new ATOM 0 HA2 GLY B 76 -2.842 -5.621 19.383 1.00 0.00 H new ATOM 0 HA3 GLY B 76 -2.213 -5.542 21.016 1.00 0.00 H new TER 2009 GLY B 76