USER MOD reduce.3.24.130724 H: found=0, std=0, add=879, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 881 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 114 THR OG1 : rot 78:sc= 0.877 USER MOD Set 1.2: A 135 ASN : amide:sc= -0.553 K(o=0.32,f=-3.9!) USER MOD Set 2.1: A 99 TYR OH : rot 180:sc= 0.213 USER MOD Set 2.2: A 117 LYS NZ :NH3+ -177:sc= 1.1 (180deg=0.825) USER MOD Set 3.1: A 97 ASN : amide:sc= 0 X(o=0.89,f=0.89) USER MOD Set 3.2: A 102 THR OG1 : rot -69:sc= 0.886 USER MOD Set 4.1: A 70 THR OG1 : rot 21:sc= 0.746 USER MOD Set 4.2: A 72 SER OG : rot -89:sc= 0.876 USER MOD Single : A 2 GLN : amide:sc= 0 K(o=0,f=-0.77) USER MOD Single : A 4 THR OG1 : rot 180:sc= -0.0726 USER MOD Single : A 7 ASN : amide:sc= 0.618 K(o=0.62,f=-3.5!) USER MOD Single : A 13 SER OG : rot -69:sc= 0.547 USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 20 SER OG : rot 180:sc=-0.00856 USER MOD Single : A 47 THR OG1 : rot 126:sc= 0.905 USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 63 SER OG : rot 47:sc= 0.525 USER MOD Single : A 64 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 66 SER OG : rot 180:sc= -0.135 USER MOD Single : A 81 SER OG : rot 180:sc= -0.0974 USER MOD Single : A 82 GLN : amide:sc= 0.588 K(o=0.59,f=0) USER MOD Single : A 84 LYS NZ :NH3+ -169:sc= 1.22 (180deg=1.17) USER MOD Single : A 88 SER OG : rot 180:sc= -0.0869 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 115 TYR OH : rot 180:sc= 0 USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 119 TYR OH : rot 180:sc= 0 USER MOD Single : A 127 SER OG : rot -110:sc= 1.65 USER MOD Single : A 136 HIS : no HE2:sc= 0.832 K(o=0.83,f=-2.9!) USER MOD Single : A 139 THR OG1 : rot 180:sc=-0.00937 USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 144 ASN : amide:sc= 0.549 K(o=0.55,f=-1.2!) USER MOD ----------------------------------------------------------------- ATOM 13 N GLN A 2 -12.239 14.258 3.444 1.00 25.00 N ATOM 14 CA GLN A 2 -10.856 14.132 2.940 1.00 25.00 C ATOM 15 C GLN A 2 -9.876 15.038 3.717 1.00 25.00 C ATOM 16 O GLN A 2 -10.296 15.899 4.492 1.00 25.00 O ATOM 17 CB GLN A 2 -10.804 14.327 1.405 1.00 25.00 C ATOM 18 CG GLN A 2 -10.152 15.627 0.896 1.00 25.00 C ATOM 19 CD GLN A 2 -10.212 15.753 -0.609 1.00 25.00 C ATOM 20 OE1 GLN A 2 -11.122 15.259 -1.255 1.00 25.00 O ATOM 21 NE2 GLN A 2 -9.232 16.407 -1.174 1.00 25.00 N ATOM 0 HA GLN A 2 -10.514 13.114 3.128 1.00 25.00 H new ATOM 0 HB2 GLN A 2 -10.265 13.484 0.973 1.00 25.00 H new ATOM 0 HB3 GLN A 2 -11.823 14.284 1.022 1.00 25.00 H new ATOM 0 HG2 GLN A 2 -10.653 16.483 1.349 1.00 25.00 H new ATOM 0 HG3 GLN A 2 -9.111 15.659 1.219 1.00 25.00 H new ATOM 0 HE21 GLN A 2 -8.488 16.806 -0.601 1.00 25.00 H new ATOM 0 HE22 GLN A 2 -9.211 16.518 -2.188 1.00 25.00 H new ATOM 30 N GLY A 3 -8.585 14.768 3.588 1.00 25.00 N ATOM 31 CA GLY A 3 -7.579 15.503 4.338 1.00 25.00 C ATOM 32 C GLY A 3 -7.011 16.695 3.594 1.00 25.00 C ATOM 33 O GLY A 3 -7.181 16.831 2.383 1.00 25.00 O ATOM 0 H GLY A 3 -8.211 14.046 2.972 1.00 25.00 H new ATOM 0 HA2 GLY A 3 -8.017 15.847 5.275 1.00 25.00 H new ATOM 0 HA3 GLY A 3 -6.765 14.826 4.596 1.00 25.00 H new ATOM 37 N THR A 4 -6.292 17.533 4.322 1.00 25.00 N ATOM 38 CA THR A 4 -5.601 18.691 3.746 1.00 25.00 C ATOM 39 C THR A 4 -4.147 18.255 3.509 1.00 25.00 C ATOM 40 O THR A 4 -3.813 17.096 3.730 1.00 25.00 O ATOM 41 CB THR A 4 -5.721 19.929 4.696 1.00 25.00 C ATOM 42 OG1 THR A 4 -5.007 21.044 4.153 1.00 25.00 O ATOM 43 CG2 THR A 4 -5.184 19.632 6.098 1.00 25.00 C ATOM 0 H THR A 4 -6.166 17.436 5.330 1.00 25.00 H new ATOM 0 HA THR A 4 -6.046 19.006 2.802 1.00 25.00 H new ATOM 0 HB THR A 4 -6.782 20.165 4.777 1.00 25.00 H new ATOM 0 HG1 THR A 4 -5.092 21.812 4.756 1.00 25.00 H new ATOM 0 HG21 THR A 4 -5.287 20.519 6.723 1.00 25.00 H new ATOM 0 HG22 THR A 4 -5.750 18.811 6.538 1.00 25.00 H new ATOM 0 HG23 THR A 4 -4.132 19.354 6.033 1.00 25.00 H new ATOM 51 N ASP A 5 -3.270 19.145 3.077 1.00 25.00 N ATOM 52 CA ASP A 5 -1.873 18.766 2.815 1.00 25.00 C ATOM 53 C ASP A 5 -1.008 18.795 4.069 1.00 25.00 C ATOM 54 O ASP A 5 0.179 18.478 4.049 1.00 25.00 O ATOM 55 CB ASP A 5 -1.285 19.638 1.708 1.00 25.00 C ATOM 56 CG ASP A 5 -1.770 19.218 0.332 1.00 25.00 C ATOM 57 OD1 ASP A 5 -1.855 17.987 0.081 1.00 25.00 O ATOM 58 OD2 ASP A 5 -2.083 20.096 -0.488 1.00 25.00 O ATOM 0 H ASP A 5 -3.487 20.126 2.899 1.00 25.00 H new ATOM 0 HA ASP A 5 -1.877 17.730 2.477 1.00 25.00 H new ATOM 0 HB2 ASP A 5 -1.555 20.679 1.885 1.00 25.00 H new ATOM 0 HB3 ASP A 5 -0.197 19.581 1.741 1.00 25.00 H new ATOM 63 N GLY A 6 -1.666 19.065 5.180 1.00 25.00 N ATOM 64 CA GLY A 6 -1.049 18.952 6.495 1.00 25.00 C ATOM 65 C GLY A 6 -1.162 17.514 6.971 1.00 25.00 C ATOM 66 O GLY A 6 -1.503 16.636 6.183 1.00 25.00 O ATOM 0 H GLY A 6 -2.640 19.368 5.201 1.00 25.00 H new ATOM 0 HA2 GLY A 6 -0.002 19.252 6.447 1.00 25.00 H new ATOM 0 HA3 GLY A 6 -1.540 19.622 7.200 1.00 25.00 H new ATOM 70 N ASN A 7 -0.919 17.250 8.246 1.00 25.00 N ATOM 71 CA ASN A 7 -1.073 15.890 8.778 1.00 25.00 C ATOM 72 C ASN A 7 -2.521 15.732 9.245 1.00 25.00 C ATOM 73 O ASN A 7 -3.028 16.594 9.954 1.00 25.00 O ATOM 74 CB ASN A 7 -0.123 15.656 9.960 1.00 25.00 C ATOM 75 CG ASN A 7 1.333 15.739 9.567 1.00 25.00 C ATOM 76 OD1 ASN A 7 1.706 15.524 8.422 1.00 25.00 O ATOM 77 ND2 ASN A 7 2.165 16.077 10.512 1.00 25.00 N ATOM 0 H ASN A 7 -0.618 17.944 8.930 1.00 25.00 H new ATOM 0 HA ASN A 7 -0.831 15.162 8.003 1.00 25.00 H new ATOM 0 HB2 ASN A 7 -0.328 16.394 10.736 1.00 25.00 H new ATOM 0 HB3 ASN A 7 -0.323 14.675 10.392 1.00 25.00 H new ATOM 0 HD21 ASN A 7 3.160 16.169 10.307 1.00 25.00 H new ATOM 0 HD22 ASN A 7 1.821 16.249 11.457 1.00 25.00 H new ATOM 84 N ASP A 8 -3.186 14.659 8.835 1.00 25.00 N ATOM 85 CA ASP A 8 -4.598 14.436 9.174 1.00 25.00 C ATOM 86 C ASP A 8 -4.805 13.093 9.855 1.00 25.00 C ATOM 87 O ASP A 8 -4.123 12.117 9.547 1.00 25.00 O ATOM 88 CB ASP A 8 -5.472 14.430 7.913 1.00 25.00 C ATOM 89 CG ASP A 8 -5.429 15.733 7.159 1.00 25.00 C ATOM 90 OD1 ASP A 8 -4.587 15.840 6.245 1.00 50.00 O ATOM 91 OD2 ASP A 8 -6.296 16.597 7.362 1.00 50.00 O ATOM 0 H ASP A 8 -2.773 13.922 8.264 1.00 25.00 H new ATOM 0 HA ASP A 8 -4.880 15.249 9.842 1.00 25.00 H new ATOM 0 HB2 ASP A 8 -5.145 13.625 7.255 1.00 25.00 H new ATOM 0 HB3 ASP A 8 -6.503 14.213 8.193 1.00 25.00 H new ATOM 96 N VAL A 9 -5.809 13.025 10.714 1.00 25.00 N ATOM 97 CA VAL A 9 -6.245 11.767 11.315 1.00 25.00 C ATOM 98 C VAL A 9 -7.740 11.693 11.057 1.00 25.00 C ATOM 99 O VAL A 9 -8.510 12.460 11.630 1.00 25.00 O ATOM 100 CB VAL A 9 -5.953 11.709 12.844 1.00 25.00 C ATOM 101 CG1 VAL A 9 -6.490 10.401 13.449 1.00 25.00 C ATOM 102 CG2 VAL A 9 -4.436 11.817 13.103 1.00 25.00 C ATOM 0 H VAL A 9 -6.347 13.837 11.017 1.00 25.00 H new ATOM 0 HA VAL A 9 -5.704 10.926 10.881 1.00 25.00 H new ATOM 0 HB VAL A 9 -6.458 12.550 13.319 1.00 25.00 H new ATOM 0 HG11 VAL A 9 -6.276 10.380 14.518 1.00 25.00 H new ATOM 0 HG12 VAL A 9 -7.567 10.343 13.293 1.00 25.00 H new ATOM 0 HG13 VAL A 9 -6.008 9.552 12.965 1.00 25.00 H new ATOM 0 HG21 VAL A 9 -4.246 11.775 14.176 1.00 25.00 H new ATOM 0 HG22 VAL A 9 -3.923 10.990 12.611 1.00 25.00 H new ATOM 0 HG23 VAL A 9 -4.065 12.762 12.706 1.00 25.00 H new ATOM 112 N LEU A 10 -8.137 10.831 10.132 1.00 25.00 N ATOM 113 CA LEU A 10 -9.541 10.724 9.731 1.00 25.00 C ATOM 114 C LEU A 10 -10.048 9.310 9.929 1.00 25.00 C ATOM 115 O LEU A 10 -9.320 8.350 9.699 1.00 25.00 O ATOM 116 CB LEU A 10 -9.702 11.107 8.255 1.00 25.00 C ATOM 117 CG LEU A 10 -9.303 12.544 7.879 1.00 25.00 C ATOM 118 CD1 LEU A 10 -9.427 12.717 6.376 1.00 25.00 C ATOM 119 CD2 LEU A 10 -10.176 13.589 8.583 1.00 25.00 C ATOM 0 H LEU A 10 -7.510 10.193 9.642 1.00 25.00 H new ATOM 0 HA LEU A 10 -10.121 11.405 10.354 1.00 25.00 H new ATOM 0 HB2 LEU A 10 -9.107 10.418 7.655 1.00 25.00 H new ATOM 0 HB3 LEU A 10 -10.744 10.956 7.974 1.00 25.00 H new ATOM 0 HG LEU A 10 -8.274 12.701 8.203 1.00 25.00 H new ATOM 0 HD11 LEU A 10 -9.146 13.734 6.102 1.00 25.00 H new ATOM 0 HD12 LEU A 10 -8.767 12.010 5.873 1.00 25.00 H new ATOM 0 HD13 LEU A 10 -10.457 12.531 6.072 1.00 25.00 H new ATOM 0 HD21 LEU A 10 -9.857 14.588 8.287 1.00 25.00 H new ATOM 0 HD22 LEU A 10 -11.218 13.442 8.301 1.00 25.00 H new ATOM 0 HD23 LEU A 10 -10.074 13.481 9.663 1.00 25.00 H new ATOM 131 N ILE A 11 -11.306 9.190 10.329 1.00 25.00 N ATOM 132 CA ILE A 11 -11.952 7.893 10.513 1.00 25.00 C ATOM 133 C ILE A 11 -13.287 7.956 9.782 1.00 25.00 C ATOM 134 O ILE A 11 -14.072 8.880 9.998 1.00 25.00 O ATOM 135 CB ILE A 11 -12.180 7.560 12.029 1.00 25.00 C ATOM 136 CG1 ILE A 11 -10.830 7.562 12.786 1.00 25.00 C ATOM 137 CG2 ILE A 11 -12.885 6.178 12.186 1.00 25.00 C ATOM 138 CD1 ILE A 11 -10.947 7.432 14.315 1.00 25.00 C ATOM 0 H ILE A 11 -11.909 9.986 10.536 1.00 25.00 H new ATOM 0 HA ILE A 11 -11.314 7.103 10.116 1.00 25.00 H new ATOM 0 HB ILE A 11 -12.825 8.327 12.458 1.00 25.00 H new ATOM 0 HG12 ILE A 11 -10.218 6.741 12.411 1.00 25.00 H new ATOM 0 HG13 ILE A 11 -10.301 8.486 12.554 1.00 25.00 H new ATOM 0 HG21 ILE A 11 -13.035 5.964 13.244 1.00 25.00 H new ATOM 0 HG22 ILE A 11 -13.850 6.203 11.681 1.00 25.00 H new ATOM 0 HG23 ILE A 11 -12.263 5.400 11.743 1.00 25.00 H new ATOM 0 HD11 ILE A 11 -9.951 7.443 14.758 1.00 25.00 H new ATOM 0 HD12 ILE A 11 -11.528 8.266 14.708 1.00 25.00 H new ATOM 0 HD13 ILE A 11 -11.445 6.495 14.563 1.00 25.00 H new ATOM 150 N GLY A 12 -13.513 7.009 8.885 1.00 25.00 N ATOM 151 CA GLY A 12 -14.730 6.985 8.096 1.00 25.00 C ATOM 152 C GLY A 12 -15.910 6.383 8.830 1.00 25.00 C ATOM 153 O GLY A 12 -15.757 5.618 9.784 1.00 25.00 O ATOM 0 H GLY A 12 -12.866 6.246 8.686 1.00 25.00 H new ATOM 0 HA2 GLY A 12 -14.979 8.003 7.795 1.00 25.00 H new ATOM 0 HA3 GLY A 12 -14.551 6.417 7.183 1.00 25.00 H new ATOM 157 N SER A 13 -17.095 6.728 8.359 1.00 25.00 N ATOM 158 CA SER A 13 -18.351 6.233 8.910 1.00 25.00 C ATOM 159 C SER A 13 -18.670 4.851 8.336 1.00 25.00 C ATOM 160 O SER A 13 -17.910 4.301 7.535 1.00 25.00 O ATOM 161 CB SER A 13 -19.469 7.212 8.561 1.00 25.00 C ATOM 162 OG SER A 13 -19.633 7.306 7.159 1.00 25.00 O ATOM 0 H SER A 13 -17.217 7.367 7.574 1.00 25.00 H new ATOM 0 HA SER A 13 -18.263 6.147 9.993 1.00 25.00 H new ATOM 0 HB2 SER A 13 -20.402 6.885 9.020 1.00 25.00 H new ATOM 0 HB3 SER A 13 -19.239 8.195 8.972 1.00 25.00 H new ATOM 0 HG SER A 13 -18.854 7.754 6.768 1.00 25.00 H new ATOM 168 N ASP A 14 -19.794 4.282 8.740 1.00 25.00 N ATOM 169 CA ASP A 14 -20.170 2.929 8.325 1.00 25.00 C ATOM 170 C ASP A 14 -20.630 2.800 6.872 1.00 25.00 C ATOM 171 O ASP A 14 -20.702 1.695 6.341 1.00 25.00 O ATOM 172 CB ASP A 14 -21.273 2.413 9.243 1.00 25.00 C ATOM 173 CG ASP A 14 -20.817 2.308 10.678 1.00 25.00 C ATOM 174 OD1 ASP A 14 -19.801 1.625 10.933 1.00 25.00 O ATOM 175 OD2 ASP A 14 -21.424 2.975 11.538 1.00 25.00 O ATOM 0 H ASP A 14 -20.468 4.734 9.358 1.00 25.00 H new ATOM 0 HA ASP A 14 -19.260 2.334 8.402 1.00 25.00 H new ATOM 0 HB2 ASP A 14 -22.133 3.080 9.185 1.00 25.00 H new ATOM 0 HB3 ASP A 14 -21.604 1.434 8.896 1.00 25.00 H new ATOM 180 N VAL A 15 -20.928 3.914 6.217 1.00 25.00 N ATOM 181 CA VAL A 15 -21.336 3.873 4.809 1.00 25.00 C ATOM 182 C VAL A 15 -20.086 3.875 3.930 1.00 25.00 C ATOM 183 O VAL A 15 -18.977 4.117 4.419 1.00 25.00 O ATOM 184 CB VAL A 15 -22.267 5.069 4.426 1.00 25.00 C ATOM 185 CG1 VAL A 15 -23.567 5.008 5.244 1.00 25.00 C ATOM 186 CG2 VAL A 15 -21.577 6.418 4.645 1.00 25.00 C ATOM 0 H VAL A 15 -20.897 4.848 6.626 1.00 25.00 H new ATOM 0 HA VAL A 15 -21.911 2.961 4.648 1.00 25.00 H new ATOM 0 HB VAL A 15 -22.498 4.981 3.364 1.00 25.00 H new ATOM 0 HG11 VAL A 15 -24.209 5.845 4.970 1.00 25.00 H new ATOM 0 HG12 VAL A 15 -24.084 4.071 5.036 1.00 25.00 H new ATOM 0 HG13 VAL A 15 -23.331 5.064 6.307 1.00 25.00 H new ATOM 0 HG21 VAL A 15 -22.257 7.224 4.367 1.00 25.00 H new ATOM 0 HG22 VAL A 15 -21.303 6.520 5.695 1.00 25.00 H new ATOM 0 HG23 VAL A 15 -20.680 6.472 4.029 1.00 25.00 H new ATOM 196 N GLY A 16 -20.251 3.593 2.645 1.00 25.00 N ATOM 197 CA GLY A 16 -19.115 3.600 1.738 1.00 25.00 C ATOM 198 C GLY A 16 -18.633 5.012 1.470 1.00 25.00 C ATOM 199 O GLY A 16 -19.449 5.919 1.306 1.00 25.00 O ATOM 0 H GLY A 16 -21.145 3.360 2.214 1.00 25.00 H new ATOM 0 HA2 GLY A 16 -18.303 3.011 2.164 1.00 25.00 H new ATOM 0 HA3 GLY A 16 -19.394 3.124 0.798 1.00 25.00 H new ATOM 203 N GLU A 17 -17.321 5.213 1.470 1.00 25.00 N ATOM 204 CA GLU A 17 -16.731 6.548 1.324 1.00 25.00 C ATOM 205 C GLU A 17 -15.467 6.512 0.472 1.00 25.00 C ATOM 206 O GLU A 17 -14.820 5.478 0.340 1.00 25.00 O ATOM 207 CB GLU A 17 -16.331 7.096 2.703 1.00 25.00 C ATOM 208 CG GLU A 17 -17.497 7.406 3.637 1.00 25.00 C ATOM 209 CD GLU A 17 -17.114 7.253 5.090 1.00 25.00 C ATOM 210 OE1 GLU A 17 -16.623 6.160 5.456 1.00 50.00 O ATOM 211 OE2 GLU A 17 -17.352 8.178 5.896 1.00 50.00 O ATOM 0 H GLU A 17 -16.636 4.464 1.570 1.00 25.00 H new ATOM 0 HA GLU A 17 -17.481 7.178 0.846 1.00 25.00 H new ATOM 0 HB2 GLU A 17 -15.678 6.371 3.190 1.00 25.00 H new ATOM 0 HB3 GLU A 17 -15.748 8.006 2.560 1.00 25.00 H new ATOM 0 HG2 GLU A 17 -17.844 8.424 3.459 1.00 25.00 H new ATOM 0 HG3 GLU A 17 -18.330 6.741 3.410 1.00 25.00 H new ATOM 218 N GLN A 18 -15.078 7.674 -0.032 1.00 25.00 N ATOM 219 CA GLN A 18 -13.809 7.846 -0.726 1.00 25.00 C ATOM 220 C GLN A 18 -13.040 8.876 0.090 1.00 25.00 C ATOM 221 O GLN A 18 -13.519 9.998 0.281 1.00 25.00 O ATOM 222 CB GLN A 18 -14.046 8.340 -2.154 1.00 25.00 C ATOM 223 CG GLN A 18 -12.771 8.545 -2.959 1.00 25.00 C ATOM 224 CD GLN A 18 -13.059 9.075 -4.339 1.00 25.00 C ATOM 225 OE1 GLN A 18 -13.675 8.412 -5.158 1.00 25.00 O ATOM 226 NE2 GLN A 18 -12.643 10.284 -4.595 1.00 25.00 N ATOM 0 H GLN A 18 -15.635 8.527 0.029 1.00 25.00 H new ATOM 0 HA GLN A 18 -13.256 6.910 -0.810 1.00 25.00 H new ATOM 0 HB2 GLN A 18 -14.681 7.623 -2.675 1.00 25.00 H new ATOM 0 HB3 GLN A 18 -14.594 9.281 -2.115 1.00 25.00 H new ATOM 0 HG2 GLN A 18 -12.117 9.240 -2.432 1.00 25.00 H new ATOM 0 HG3 GLN A 18 -12.235 7.599 -3.038 1.00 25.00 H new ATOM 0 HE21 GLN A 18 -12.131 10.808 -3.885 1.00 25.00 H new ATOM 0 HE22 GLN A 18 -12.830 10.706 -5.505 1.00 25.00 H new ATOM 235 N ILE A 19 -11.898 8.485 0.633 1.00 25.00 N ATOM 236 CA ILE A 19 -11.130 9.355 1.520 1.00 25.00 C ATOM 237 C ILE A 19 -9.698 9.472 1.017 1.00 25.00 C ATOM 238 O ILE A 19 -8.957 8.494 0.964 1.00 25.00 O ATOM 239 CB ILE A 19 -11.103 8.814 2.986 1.00 25.00 C ATOM 240 CG1 ILE A 19 -12.537 8.493 3.481 1.00 25.00 C ATOM 241 CG2 ILE A 19 -10.433 9.853 3.930 1.00 25.00 C ATOM 242 CD1 ILE A 19 -12.602 7.793 4.853 1.00 25.00 C ATOM 0 H ILE A 19 -11.479 7.569 0.476 1.00 25.00 H new ATOM 0 HA ILE A 19 -11.617 10.330 1.520 1.00 25.00 H new ATOM 0 HB ILE A 19 -10.520 7.893 3.000 1.00 25.00 H new ATOM 0 HG12 ILE A 19 -13.105 9.422 3.535 1.00 25.00 H new ATOM 0 HG13 ILE A 19 -13.029 7.861 2.742 1.00 25.00 H new ATOM 0 HG21 ILE A 19 -10.420 9.464 4.948 1.00 25.00 H new ATOM 0 HG22 ILE A 19 -9.411 10.039 3.600 1.00 25.00 H new ATOM 0 HG23 ILE A 19 -10.998 10.785 3.904 1.00 25.00 H new ATOM 0 HD11 ILE A 19 -13.643 7.608 5.118 1.00 25.00 H new ATOM 0 HD12 ILE A 19 -12.066 6.845 4.804 1.00 25.00 H new ATOM 0 HD13 ILE A 19 -12.143 8.430 5.609 1.00 25.00 H new ATOM 254 N SER A 20 -9.302 10.684 0.675 1.00 25.00 N ATOM 255 CA SER A 20 -7.945 10.950 0.225 1.00 25.00 C ATOM 256 C SER A 20 -7.214 11.725 1.312 1.00 25.00 C ATOM 257 O SER A 20 -7.807 12.560 1.996 1.00 25.00 O ATOM 258 CB SER A 20 -7.969 11.732 -1.089 1.00 25.00 C ATOM 259 OG SER A 20 -8.676 12.950 -0.938 1.00 25.00 O ATOM 0 H SER A 20 -9.905 11.507 0.700 1.00 25.00 H new ATOM 0 HA SER A 20 -7.420 10.012 0.041 1.00 25.00 H new ATOM 0 HB2 SER A 20 -6.949 11.937 -1.414 1.00 25.00 H new ATOM 0 HB3 SER A 20 -8.437 11.129 -1.867 1.00 25.00 H new ATOM 0 HG SER A 20 -8.678 13.435 -1.790 1.00 25.00 H new ATOM 265 N GLY A 21 -5.943 11.415 1.510 1.00 25.00 N ATOM 266 CA GLY A 21 -5.170 12.042 2.570 1.00 25.00 C ATOM 267 C GLY A 21 -4.369 13.248 2.134 1.00 25.00 C ATOM 268 O GLY A 21 -4.016 14.085 2.963 1.00 25.00 O ATOM 0 H GLY A 21 -5.426 10.735 0.953 1.00 25.00 H new ATOM 0 HA2 GLY A 21 -5.849 12.342 3.368 1.00 25.00 H new ATOM 0 HA3 GLY A 21 -4.489 11.303 2.992 1.00 25.00 H new ATOM 272 N GLY A 22 -4.043 13.336 0.853 1.00 25.00 N ATOM 273 CA GLY A 22 -3.213 14.431 0.366 1.00 25.00 C ATOM 274 C GLY A 22 -1.780 14.306 0.865 1.00 25.00 C ATOM 275 O GLY A 22 -1.346 13.211 1.270 1.00 25.00 O ATOM 0 H GLY A 22 -4.336 12.671 0.138 1.00 25.00 H new ATOM 0 HA2 GLY A 22 -3.221 14.439 -0.724 1.00 25.00 H new ATOM 0 HA3 GLY A 22 -3.633 15.382 0.695 1.00 25.00 H new ATOM 279 N ALA A 23 -1.036 15.401 0.863 1.00 25.00 N ATOM 280 CA ALA A 23 0.336 15.395 1.368 1.00 25.00 C ATOM 281 C ALA A 23 0.321 15.259 2.897 1.00 25.00 C ATOM 282 O ALA A 23 -0.744 15.164 3.513 1.00 25.00 O ATOM 283 CB ALA A 23 1.069 16.675 0.942 1.00 25.00 C ATOM 0 H ALA A 23 -1.355 16.306 0.518 1.00 25.00 H new ATOM 0 HA ALA A 23 0.870 14.545 0.944 1.00 25.00 H new ATOM 0 HB1 ALA A 23 2.089 16.655 1.326 1.00 25.00 H new ATOM 0 HB2 ALA A 23 1.092 16.736 -0.146 1.00 25.00 H new ATOM 0 HB3 ALA A 23 0.547 17.544 1.343 1.00 25.00 H new ATOM 289 N GLY A 24 1.499 15.211 3.495 1.00 25.00 N ATOM 290 CA GLY A 24 1.604 15.048 4.937 1.00 25.00 C ATOM 291 C GLY A 24 1.468 13.598 5.358 1.00 25.00 C ATOM 292 O GLY A 24 1.062 12.737 4.561 1.00 25.00 O ATOM 0 H GLY A 24 2.393 15.282 3.008 1.00 25.00 H new ATOM 0 HA2 GLY A 24 2.565 15.435 5.276 1.00 25.00 H new ATOM 0 HA3 GLY A 24 0.831 15.641 5.426 1.00 25.00 H new ATOM 296 N ASP A 25 1.816 13.323 6.602 1.00 25.00 N ATOM 297 CA ASP A 25 1.766 11.972 7.157 1.00 25.00 C ATOM 298 C ASP A 25 0.400 11.793 7.801 1.00 25.00 C ATOM 299 O ASP A 25 0.078 12.463 8.777 1.00 25.00 O ATOM 300 CB ASP A 25 2.865 11.780 8.210 1.00 25.00 C ATOM 301 CG ASP A 25 4.256 11.619 7.600 1.00 25.00 C ATOM 302 OD1 ASP A 25 4.399 11.577 6.353 1.00 25.00 O ATOM 303 OD2 ASP A 25 5.215 11.439 8.391 1.00 25.00 O ATOM 0 H ASP A 25 2.143 14.029 7.262 1.00 25.00 H new ATOM 0 HA ASP A 25 1.925 11.236 6.369 1.00 25.00 H new ATOM 0 HB2 ASP A 25 2.867 12.636 8.885 1.00 25.00 H new ATOM 0 HB3 ASP A 25 2.634 10.901 8.811 1.00 25.00 H new ATOM 308 N ASP A 26 -0.424 10.931 7.226 1.00 25.00 N ATOM 309 CA ASP A 26 -1.827 10.815 7.630 1.00 25.00 C ATOM 310 C ASP A 26 -2.215 9.456 8.196 1.00 25.00 C ATOM 311 O ASP A 26 -1.549 8.449 7.951 1.00 25.00 O ATOM 312 CB ASP A 26 -2.708 11.067 6.403 1.00 25.00 C ATOM 313 CG ASP A 26 -2.379 12.367 5.719 1.00 25.00 C ATOM 314 OD1 ASP A 26 -2.373 13.415 6.383 1.00 50.00 O ATOM 315 OD2 ASP A 26 -2.142 12.370 4.486 1.00 50.00 O ATOM 0 H ASP A 26 -0.150 10.297 6.475 1.00 25.00 H new ATOM 0 HA ASP A 26 -1.971 11.547 8.425 1.00 25.00 H new ATOM 0 HB2 ASP A 26 -2.586 10.246 5.696 1.00 25.00 H new ATOM 0 HB3 ASP A 26 -3.755 11.073 6.706 1.00 25.00 H new ATOM 320 N ARG A 27 -3.361 9.414 8.857 1.00 25.00 N ATOM 321 CA ARG A 27 -4.009 8.157 9.224 1.00 25.00 C ATOM 322 C ARG A 27 -5.387 8.259 8.622 1.00 25.00 C ATOM 323 O ARG A 27 -6.098 9.230 8.870 1.00 25.00 O ATOM 324 CB ARG A 27 -4.110 7.975 10.740 1.00 25.00 C ATOM 325 CG ARG A 27 -4.961 6.758 11.135 1.00 25.00 C ATOM 326 CD ARG A 27 -5.110 6.628 12.637 1.00 25.00 C ATOM 327 NE ARG A 27 -6.172 5.666 12.980 1.00 25.00 N ATOM 328 CZ ARG A 27 -6.603 5.403 14.207 1.00 25.00 C ATOM 329 NH1 ARG A 27 -6.098 5.987 15.268 1.00 25.00 N ATOM 330 NH2 ARG A 27 -7.562 4.545 14.377 1.00 25.00 N ATOM 0 H ARG A 27 -3.870 10.246 9.155 1.00 25.00 H new ATOM 0 HA ARG A 27 -3.440 7.300 8.864 1.00 25.00 H new ATOM 0 HB2 ARG A 27 -3.109 7.864 11.156 1.00 25.00 H new ATOM 0 HB3 ARG A 27 -4.541 8.873 11.182 1.00 25.00 H new ATOM 0 HG2 ARG A 27 -5.948 6.843 10.680 1.00 25.00 H new ATOM 0 HG3 ARG A 27 -4.504 5.852 10.737 1.00 25.00 H new ATOM 0 HD2 ARG A 27 -4.165 6.303 13.073 1.00 25.00 H new ATOM 0 HD3 ARG A 27 -5.343 7.601 13.069 1.00 25.00 H new ATOM 0 HE ARG A 27 -6.612 5.161 12.211 1.00 25.00 H new ATOM 0 HH11 ARG A 27 -5.347 6.670 15.166 1.00 25.00 H new ATOM 0 HH12 ARG A 27 -6.456 5.758 16.195 1.00 25.00 H new ATOM 0 HH21 ARG A 27 -7.978 4.079 13.571 1.00 25.00 H new ATOM 0 HH22 ARG A 27 -7.899 4.337 15.317 1.00 25.00 H new ATOM 344 N LEU A 28 -5.739 7.280 7.815 1.00 25.00 N ATOM 345 CA LEU A 28 -7.037 7.234 7.169 1.00 25.00 C ATOM 346 C LEU A 28 -7.663 5.903 7.522 1.00 25.00 C ATOM 347 O LEU A 28 -7.180 4.865 7.091 1.00 25.00 O ATOM 348 CB LEU A 28 -6.891 7.325 5.641 1.00 25.00 C ATOM 349 CG LEU A 28 -6.145 8.529 5.050 1.00 25.00 C ATOM 350 CD1 LEU A 28 -6.116 8.369 3.530 1.00 25.00 C ATOM 351 CD2 LEU A 28 -6.789 9.860 5.427 1.00 25.00 C ATOM 0 H LEU A 28 -5.133 6.492 7.587 1.00 25.00 H new ATOM 0 HA LEU A 28 -7.649 8.072 7.504 1.00 25.00 H new ATOM 0 HB2 LEU A 28 -6.385 6.421 5.301 1.00 25.00 H new ATOM 0 HB3 LEU A 28 -7.892 7.311 5.210 1.00 25.00 H new ATOM 0 HG LEU A 28 -5.136 8.548 5.461 1.00 25.00 H new ATOM 0 HD11 LEU A 28 -5.590 9.214 3.085 1.00 25.00 H new ATOM 0 HD12 LEU A 28 -5.601 7.444 3.271 1.00 25.00 H new ATOM 0 HD13 LEU A 28 -7.136 8.335 3.148 1.00 25.00 H new ATOM 0 HD21 LEU A 28 -6.221 10.678 4.983 1.00 25.00 H new ATOM 0 HD22 LEU A 28 -7.814 9.886 5.056 1.00 25.00 H new ATOM 0 HD23 LEU A 28 -6.793 9.968 6.512 1.00 25.00 H new ATOM 363 N ASP A 29 -8.733 5.928 8.289 1.00 25.00 N ATOM 364 CA ASP A 29 -9.462 4.707 8.599 1.00 25.00 C ATOM 365 C ASP A 29 -10.734 4.785 7.778 1.00 25.00 C ATOM 366 O ASP A 29 -11.346 5.834 7.691 1.00 25.00 O ATOM 367 CB ASP A 29 -9.804 4.601 10.090 1.00 25.00 C ATOM 368 CG ASP A 29 -8.602 4.253 10.964 1.00 25.00 C ATOM 369 OD1 ASP A 29 -7.438 4.547 10.612 1.00 25.00 O ATOM 370 OD2 ASP A 29 -8.840 3.711 12.058 1.00 25.00 O ATOM 0 H ASP A 29 -9.119 6.773 8.709 1.00 25.00 H new ATOM 0 HA ASP A 29 -8.861 3.828 8.366 1.00 25.00 H new ATOM 0 HB2 ASP A 29 -10.227 5.548 10.426 1.00 25.00 H new ATOM 0 HB3 ASP A 29 -10.574 3.842 10.225 1.00 25.00 H new ATOM 375 N GLY A 30 -11.115 3.684 7.154 1.00 25.00 N ATOM 376 CA GLY A 30 -12.300 3.657 6.314 1.00 25.00 C ATOM 377 C GLY A 30 -13.545 3.282 7.093 1.00 25.00 C ATOM 378 O GLY A 30 -14.661 3.656 6.728 1.00 25.00 O ATOM 0 H GLY A 30 -10.619 2.794 7.213 1.00 25.00 H new ATOM 0 HA2 GLY A 30 -12.441 4.636 5.856 1.00 25.00 H new ATOM 0 HA3 GLY A 30 -12.152 2.944 5.503 1.00 25.00 H new ATOM 382 N GLY A 31 -13.364 2.524 8.164 1.00 25.00 N ATOM 383 CA GLY A 31 -14.496 2.054 8.945 1.00 25.00 C ATOM 384 C GLY A 31 -15.249 0.965 8.196 1.00 25.00 C ATOM 385 O GLY A 31 -14.699 0.338 7.274 1.00 25.00 O ATOM 0 H GLY A 31 -12.452 2.224 8.509 1.00 25.00 H new ATOM 0 HA2 GLY A 31 -14.148 1.669 9.904 1.00 25.00 H new ATOM 0 HA3 GLY A 31 -15.167 2.886 9.159 1.00 25.00 H new ATOM 389 N ALA A 32 -16.501 0.733 8.562 1.00 25.00 N ATOM 390 CA ALA A 32 -17.314 -0.263 7.874 1.00 25.00 C ATOM 391 C ALA A 32 -17.734 0.278 6.497 1.00 25.00 C ATOM 392 O ALA A 32 -17.466 1.444 6.157 1.00 25.00 O ATOM 393 CB ALA A 32 -18.540 -0.632 8.720 1.00 25.00 C ATOM 0 H ALA A 32 -16.975 1.216 9.325 1.00 25.00 H new ATOM 0 HA ALA A 32 -16.727 -1.170 7.728 1.00 25.00 H new ATOM 0 HB1 ALA A 32 -19.136 -1.376 8.192 1.00 25.00 H new ATOM 0 HB2 ALA A 32 -18.213 -1.041 9.676 1.00 25.00 H new ATOM 0 HB3 ALA A 32 -19.143 0.259 8.894 1.00 25.00 H new ATOM 399 N GLY A 33 -18.345 -0.585 5.702 1.00 25.00 N ATOM 400 CA GLY A 33 -18.729 -0.227 4.348 1.00 25.00 C ATOM 401 C GLY A 33 -17.546 -0.374 3.417 1.00 25.00 C ATOM 402 O GLY A 33 -16.405 -0.536 3.873 1.00 25.00 O ATOM 0 H GLY A 33 -18.586 -1.539 5.972 1.00 25.00 H new ATOM 0 HA2 GLY A 33 -19.547 -0.865 4.013 1.00 25.00 H new ATOM 0 HA3 GLY A 33 -19.095 0.799 4.325 1.00 25.00 H new ATOM 406 N ASP A 34 -17.800 -0.347 2.122 1.00 0.00 N ATOM 407 CA ASP A 34 -16.737 -0.511 1.137 1.00 25.00 C ATOM 408 C ASP A 34 -16.115 0.858 0.902 1.00 25.00 C ATOM 409 O ASP A 34 -16.838 1.831 0.739 1.00 25.00 O ATOM 410 CB ASP A 34 -17.301 -1.081 -0.169 1.00 25.00 C ATOM 411 CG ASP A 34 -17.858 -2.494 -0.001 1.00 25.00 C ATOM 412 OD1 ASP A 34 -17.587 -3.148 1.037 1.00 25.00 O ATOM 413 OD2 ASP A 34 -18.605 -2.936 -0.894 1.00 25.00 O ATOM 0 H ASP A 34 -18.730 -0.214 1.724 1.00 0.00 H new ATOM 0 HA ASP A 34 -15.984 -1.211 1.499 1.00 25.00 H new ATOM 0 HB2 ASP A 34 -18.090 -0.425 -0.537 1.00 25.00 H new ATOM 0 HB3 ASP A 34 -16.516 -1.091 -0.925 1.00 25.00 H new ATOM 418 N ASP A 35 -14.796 0.967 0.980 1.00 25.00 N ATOM 419 CA ASP A 35 -14.148 2.286 0.950 1.00 25.00 C ATOM 420 C ASP A 35 -12.979 2.386 -0.020 1.00 25.00 C ATOM 421 O ASP A 35 -12.293 1.403 -0.310 1.00 25.00 O ATOM 422 CB ASP A 35 -13.643 2.657 2.349 1.00 25.00 C ATOM 423 CG ASP A 35 -14.750 2.688 3.382 1.00 25.00 C ATOM 424 OD1 ASP A 35 -15.681 3.511 3.277 1.00 50.00 O ATOM 425 OD2 ASP A 35 -14.666 1.919 4.371 1.00 50.00 O ATOM 0 H ASP A 35 -14.156 0.177 1.063 1.00 25.00 H new ATOM 0 HA ASP A 35 -14.917 2.977 0.603 1.00 25.00 H new ATOM 0 HB2 ASP A 35 -12.883 1.939 2.658 1.00 25.00 H new ATOM 0 HB3 ASP A 35 -13.161 3.634 2.309 1.00 25.00 H new ATOM 430 N LEU A 36 -12.729 3.604 -0.474 1.00 25.00 N ATOM 431 CA LEU A 36 -11.596 3.908 -1.345 1.00 25.00 C ATOM 432 C LEU A 36 -10.662 4.810 -0.550 1.00 25.00 C ATOM 433 O LEU A 36 -11.111 5.808 0.020 1.00 25.00 O ATOM 434 CB LEU A 36 -12.061 4.640 -2.613 1.00 25.00 C ATOM 435 CG LEU A 36 -13.049 3.913 -3.540 1.00 25.00 C ATOM 436 CD1 LEU A 36 -14.510 4.251 -3.207 1.00 25.00 C ATOM 437 CD2 LEU A 36 -12.761 4.307 -4.991 1.00 25.00 C ATOM 0 H LEU A 36 -13.306 4.415 -0.250 1.00 25.00 H new ATOM 0 HA LEU A 36 -11.100 2.989 -1.658 1.00 25.00 H new ATOM 0 HB2 LEU A 36 -12.519 5.581 -2.307 1.00 25.00 H new ATOM 0 HB3 LEU A 36 -11.176 4.891 -3.198 1.00 25.00 H new ATOM 0 HG LEU A 36 -12.913 2.841 -3.395 1.00 25.00 H new ATOM 0 HD11 LEU A 36 -15.172 3.715 -3.887 1.00 25.00 H new ATOM 0 HD12 LEU A 36 -14.727 3.955 -2.181 1.00 25.00 H new ATOM 0 HD13 LEU A 36 -14.669 5.324 -3.316 1.00 25.00 H new ATOM 0 HD21 LEU A 36 -13.459 3.794 -5.653 1.00 25.00 H new ATOM 0 HD22 LEU A 36 -12.878 5.385 -5.105 1.00 25.00 H new ATOM 0 HD23 LEU A 36 -11.741 4.023 -5.249 1.00 25.00 H new ATOM 449 N LEU A 37 -9.388 4.450 -0.470 1.00 25.00 N ATOM 450 CA LEU A 37 -8.426 5.212 0.328 1.00 25.00 C ATOM 451 C LEU A 37 -7.198 5.599 -0.502 1.00 25.00 C ATOM 452 O LEU A 37 -6.501 4.733 -1.037 1.00 25.00 O ATOM 453 CB LEU A 37 -7.978 4.401 1.556 1.00 25.00 C ATOM 454 CG LEU A 37 -9.035 4.052 2.628 1.00 25.00 C ATOM 455 CD1 LEU A 37 -9.798 2.753 2.316 1.00 25.00 C ATOM 456 CD2 LEU A 37 -8.347 3.899 3.984 1.00 25.00 C ATOM 0 H LEU A 37 -8.994 3.638 -0.945 1.00 25.00 H new ATOM 0 HA LEU A 37 -8.925 6.123 0.659 1.00 25.00 H new ATOM 0 HB2 LEU A 37 -7.546 3.466 1.198 1.00 25.00 H new ATOM 0 HB3 LEU A 37 -7.177 4.955 2.046 1.00 25.00 H new ATOM 0 HG LEU A 37 -9.759 4.867 2.638 1.00 25.00 H new ATOM 0 HD11 LEU A 37 -10.526 2.560 3.104 1.00 25.00 H new ATOM 0 HD12 LEU A 37 -10.315 2.855 1.362 1.00 25.00 H new ATOM 0 HD13 LEU A 37 -9.095 1.922 2.261 1.00 25.00 H new ATOM 0 HD21 LEU A 37 -9.090 3.653 4.743 1.00 25.00 H new ATOM 0 HD22 LEU A 37 -7.607 3.101 3.928 1.00 25.00 H new ATOM 0 HD23 LEU A 37 -7.853 4.834 4.249 1.00 25.00 H new ATOM 468 N ASP A 38 -6.931 6.897 -0.587 1.00 25.00 N ATOM 469 CA ASP A 38 -5.779 7.417 -1.343 1.00 25.00 C ATOM 470 C ASP A 38 -4.759 8.032 -0.380 1.00 25.00 C ATOM 471 O ASP A 38 -5.038 9.046 0.268 1.00 25.00 O ATOM 472 CB ASP A 38 -6.220 8.503 -2.333 1.00 25.00 C ATOM 473 CG ASP A 38 -7.284 8.025 -3.302 1.00 25.00 C ATOM 474 OD1 ASP A 38 -7.060 7.031 -4.020 1.00 25.00 O ATOM 475 OD2 ASP A 38 -8.342 8.690 -3.371 1.00 25.00 O ATOM 0 H ASP A 38 -7.496 7.620 -0.141 1.00 25.00 H new ATOM 0 HA ASP A 38 -5.335 6.585 -1.890 1.00 25.00 H new ATOM 0 HB2 ASP A 38 -6.601 9.360 -1.778 1.00 25.00 H new ATOM 0 HB3 ASP A 38 -5.352 8.848 -2.896 1.00 25.00 H new ATOM 480 N GLY A 39 -3.585 7.431 -0.257 1.00 25.00 N ATOM 481 CA GLY A 39 -2.607 7.906 0.720 1.00 25.00 C ATOM 482 C GLY A 39 -2.045 9.300 0.465 1.00 25.00 C ATOM 483 O GLY A 39 -1.958 10.140 1.384 1.00 25.00 O ATOM 0 H GLY A 39 -3.286 6.627 -0.809 1.00 25.00 H new ATOM 0 HA2 GLY A 39 -3.071 7.896 1.706 1.00 25.00 H new ATOM 0 HA3 GLY A 39 -1.778 7.199 0.750 1.00 25.00 H new ATOM 487 N GLY A 40 -1.629 9.556 -0.764 1.00 25.00 N ATOM 488 CA GLY A 40 -1.014 10.830 -1.100 1.00 25.00 C ATOM 489 C GLY A 40 0.440 10.878 -0.662 1.00 25.00 C ATOM 490 O GLY A 40 0.959 9.926 -0.066 1.00 25.00 O ATOM 0 H GLY A 40 -1.705 8.902 -1.543 1.00 25.00 H new ATOM 0 HA2 GLY A 40 -1.077 10.993 -2.176 1.00 25.00 H new ATOM 0 HA3 GLY A 40 -1.566 11.639 -0.622 1.00 25.00 H new ATOM 494 N ALA A 41 1.108 11.991 -0.927 1.00 25.00 N ATOM 495 CA ALA A 41 2.508 12.147 -0.536 1.00 25.00 C ATOM 496 C ALA A 41 2.647 11.985 0.988 1.00 25.00 C ATOM 497 O ALA A 41 1.686 12.208 1.737 1.00 25.00 O ATOM 498 CB ALA A 41 3.035 13.516 -0.994 1.00 25.00 C ATOM 0 H ALA A 41 0.709 12.797 -1.408 1.00 25.00 H new ATOM 0 HA ALA A 41 3.105 11.374 -1.020 1.00 25.00 H new ATOM 0 HB1 ALA A 41 4.079 13.622 -0.698 1.00 25.00 H new ATOM 0 HB2 ALA A 41 2.956 13.592 -2.078 1.00 25.00 H new ATOM 0 HB3 ALA A 41 2.444 14.307 -0.531 1.00 25.00 H new ATOM 504 N GLY A 42 3.825 11.564 1.426 1.00 25.00 N ATOM 505 CA GLY A 42 4.067 11.292 2.838 1.00 25.00 C ATOM 506 C GLY A 42 3.814 9.831 3.162 1.00 25.00 C ATOM 507 O GLY A 42 3.282 9.088 2.321 1.00 25.00 O ATOM 0 H GLY A 42 4.631 11.403 0.823 1.00 25.00 H new ATOM 0 HA2 GLY A 42 5.095 11.551 3.091 1.00 25.00 H new ATOM 0 HA3 GLY A 42 3.420 11.921 3.449 1.00 25.00 H new ATOM 511 N ARG A 43 4.200 9.417 4.362 1.00 25.00 N ATOM 512 CA ARG A 43 4.016 8.032 4.828 1.00 25.00 C ATOM 513 C ARG A 43 2.717 8.011 5.606 1.00 25.00 C ATOM 514 O ARG A 43 2.487 8.853 6.466 1.00 25.00 O ATOM 515 CB ARG A 43 5.188 7.569 5.715 1.00 25.00 C ATOM 516 CG ARG A 43 5.702 8.653 6.639 1.00 25.00 C ATOM 517 CD ARG A 43 6.816 8.225 7.548 1.00 25.00 C ATOM 518 NE ARG A 43 7.133 9.363 8.423 1.00 25.00 N ATOM 519 CZ ARG A 43 8.139 9.438 9.277 1.00 25.00 C ATOM 520 NH1 ARG A 43 8.996 8.460 9.446 1.00 25.00 N ATOM 521 NH2 ARG A 43 8.280 10.529 9.974 1.00 25.00 N ATOM 0 H ARG A 43 4.650 10.025 5.046 1.00 25.00 H new ATOM 0 HA ARG A 43 3.986 7.346 3.981 1.00 25.00 H new ATOM 0 HB2 ARG A 43 4.868 6.714 6.311 1.00 25.00 H new ATOM 0 HB3 ARG A 43 6.004 7.227 5.078 1.00 25.00 H new ATOM 0 HG2 ARG A 43 6.046 9.493 6.036 1.00 25.00 H new ATOM 0 HG3 ARG A 43 4.874 9.016 7.248 1.00 25.00 H new ATOM 0 HD2 ARG A 43 6.518 7.359 8.138 1.00 25.00 H new ATOM 0 HD3 ARG A 43 7.692 7.930 6.969 1.00 25.00 H new ATOM 0 HE ARG A 43 6.517 10.174 8.365 1.00 25.00 H new ATOM 0 HH11 ARG A 43 8.900 7.599 8.907 1.00 25.00 H new ATOM 0 HH12 ARG A 43 9.758 8.560 10.116 1.00 25.00 H new ATOM 0 HH21 ARG A 43 7.623 11.300 9.854 1.00 25.00 H new ATOM 0 HH22 ARG A 43 9.048 10.613 10.640 1.00 25.00 H new ATOM 535 N ASP A 44 1.838 7.099 5.248 1.00 25.00 N ATOM 536 CA ASP A 44 0.477 7.096 5.761 1.00 25.00 C ATOM 537 C ASP A 44 0.096 5.745 6.348 1.00 25.00 C ATOM 538 O ASP A 44 0.803 4.757 6.158 1.00 25.00 O ATOM 539 CB ASP A 44 -0.472 7.447 4.616 1.00 25.00 C ATOM 540 CG ASP A 44 -0.105 8.751 3.944 1.00 25.00 C ATOM 541 OD1 ASP A 44 -0.165 9.801 4.605 1.00 50.00 O ATOM 542 OD2 ASP A 44 0.233 8.762 2.736 1.00 50.00 O ATOM 0 H ASP A 44 2.041 6.341 4.597 1.00 25.00 H new ATOM 0 HA ASP A 44 0.405 7.831 6.563 1.00 25.00 H new ATOM 0 HB2 ASP A 44 -0.460 6.645 3.878 1.00 25.00 H new ATOM 0 HB3 ASP A 44 -1.491 7.512 4.999 1.00 25.00 H new ATOM 547 N ARG A 45 -1.030 5.707 7.049 1.00 25.00 N ATOM 548 CA ARG A 45 -1.574 4.465 7.612 1.00 25.00 C ATOM 549 C ARG A 45 -2.998 4.358 7.107 1.00 25.00 C ATOM 550 O ARG A 45 -3.805 5.241 7.383 1.00 25.00 O ATOM 551 CB ARG A 45 -1.559 4.478 9.147 1.00 25.00 C ATOM 552 CG ARG A 45 -0.172 4.660 9.750 1.00 25.00 C ATOM 553 CD ARG A 45 0.063 6.118 10.125 1.00 25.00 C ATOM 554 NE ARG A 45 1.481 6.493 9.997 1.00 25.00 N ATOM 555 CZ ARG A 45 1.925 7.654 9.523 1.00 25.00 C ATOM 556 NH1 ARG A 45 1.123 8.601 9.122 1.00 25.00 N ATOM 557 NH2 ARG A 45 3.209 7.862 9.449 1.00 25.00 N ATOM 0 H ARG A 45 -1.596 6.532 7.247 1.00 25.00 H new ATOM 0 HA ARG A 45 -0.966 3.614 7.305 1.00 25.00 H new ATOM 0 HB2 ARG A 45 -2.206 5.281 9.500 1.00 25.00 H new ATOM 0 HB3 ARG A 45 -1.983 3.543 9.513 1.00 25.00 H new ATOM 0 HG2 ARG A 45 -0.068 4.030 10.634 1.00 25.00 H new ATOM 0 HG3 ARG A 45 0.586 4.336 9.037 1.00 25.00 H new ATOM 0 HD2 ARG A 45 -0.542 6.760 9.485 1.00 25.00 H new ATOM 0 HD3 ARG A 45 -0.267 6.288 11.150 1.00 25.00 H new ATOM 0 HE ARG A 45 2.177 5.809 10.295 1.00 25.00 H new ATOM 0 HH11 ARG A 45 0.113 8.466 9.165 1.00 25.00 H new ATOM 0 HH12 ARG A 45 1.506 9.476 8.765 1.00 25.00 H new ATOM 0 HH21 ARG A 45 3.861 7.139 9.753 1.00 25.00 H new ATOM 0 HH22 ARG A 45 3.562 8.748 9.087 1.00 25.00 H new ATOM 571 N LEU A 46 -3.273 3.346 6.305 1.00 25.00 N ATOM 572 CA LEU A 46 -4.574 3.203 5.646 1.00 25.00 C ATOM 573 C LEU A 46 -5.296 1.979 6.198 1.00 25.00 C ATOM 574 O LEU A 46 -4.984 0.852 5.840 1.00 25.00 O ATOM 575 CB LEU A 46 -4.383 3.078 4.124 1.00 25.00 C ATOM 576 CG LEU A 46 -4.376 4.395 3.312 1.00 25.00 C ATOM 577 CD1 LEU A 46 -3.316 5.389 3.780 1.00 25.00 C ATOM 578 CD2 LEU A 46 -4.141 4.098 1.829 1.00 25.00 C ATOM 0 H LEU A 46 -2.611 2.601 6.088 1.00 25.00 H new ATOM 0 HA LEU A 46 -5.179 4.087 5.845 1.00 25.00 H new ATOM 0 HB2 LEU A 46 -3.441 2.561 3.941 1.00 25.00 H new ATOM 0 HB3 LEU A 46 -5.177 2.442 3.733 1.00 25.00 H new ATOM 0 HG LEU A 46 -5.353 4.852 3.471 1.00 25.00 H new ATOM 0 HD11 LEU A 46 -3.366 6.290 3.168 1.00 25.00 H new ATOM 0 HD12 LEU A 46 -3.496 5.649 4.823 1.00 25.00 H new ATOM 0 HD13 LEU A 46 -2.328 4.939 3.683 1.00 25.00 H new ATOM 0 HD21 LEU A 46 -4.138 5.032 1.267 1.00 25.00 H new ATOM 0 HD22 LEU A 46 -3.181 3.597 1.706 1.00 25.00 H new ATOM 0 HD23 LEU A 46 -4.937 3.453 1.457 1.00 25.00 H new ATOM 590 N THR A 47 -6.240 2.208 7.095 1.00 25.00 N ATOM 591 CA THR A 47 -6.985 1.129 7.740 1.00 25.00 C ATOM 592 C THR A 47 -8.281 0.880 6.986 1.00 25.00 C ATOM 593 O THR A 47 -9.157 1.735 6.961 1.00 25.00 O ATOM 594 CB THR A 47 -7.333 1.512 9.193 1.00 25.00 C ATOM 595 OG1 THR A 47 -6.204 2.146 9.800 1.00 25.00 O ATOM 596 CG2 THR A 47 -7.720 0.312 10.018 1.00 25.00 C ATOM 0 H THR A 47 -6.514 3.142 7.399 1.00 25.00 H new ATOM 0 HA THR A 47 -6.365 0.232 7.735 1.00 25.00 H new ATOM 0 HB THR A 47 -8.187 2.189 9.159 1.00 25.00 H new ATOM 0 HG1 THR A 47 -6.472 3.017 10.159 1.00 25.00 H new ATOM 0 HG21 THR A 47 -7.957 0.630 11.034 1.00 25.00 H new ATOM 0 HG22 THR A 47 -8.593 -0.168 9.575 1.00 25.00 H new ATOM 0 HG23 THR A 47 -6.891 -0.395 10.043 1.00 25.00 H new ATOM 604 N GLY A 48 -8.415 -0.267 6.342 1.00 25.00 N ATOM 605 CA GLY A 48 -9.615 -0.509 5.553 1.00 25.00 C ATOM 606 C GLY A 48 -10.837 -0.823 6.393 1.00 25.00 C ATOM 607 O GLY A 48 -11.946 -0.336 6.118 1.00 25.00 O ATOM 0 H GLY A 48 -7.733 -1.025 6.346 1.00 25.00 H new ATOM 0 HA2 GLY A 48 -9.821 0.369 4.940 1.00 25.00 H new ATOM 0 HA3 GLY A 48 -9.430 -1.338 4.870 1.00 25.00 H new ATOM 611 N GLY A 49 -10.653 -1.644 7.415 1.00 25.00 N ATOM 612 CA GLY A 49 -11.760 -2.058 8.257 1.00 25.00 C ATOM 613 C GLY A 49 -12.637 -3.073 7.548 1.00 25.00 C ATOM 614 O GLY A 49 -12.242 -3.656 6.524 1.00 25.00 O ATOM 0 H GLY A 49 -9.749 -2.035 7.680 1.00 25.00 H new ATOM 0 HA2 GLY A 49 -11.376 -2.488 9.182 1.00 25.00 H new ATOM 0 HA3 GLY A 49 -12.356 -1.188 8.533 1.00 25.00 H new ATOM 618 N LEU A 50 -13.841 -3.269 8.066 1.00 25.00 N ATOM 619 CA LEU A 50 -14.808 -4.184 7.456 1.00 25.00 C ATOM 620 C LEU A 50 -15.205 -3.691 6.075 1.00 25.00 C ATOM 621 O LEU A 50 -15.119 -2.493 5.779 1.00 25.00 O ATOM 622 CB LEU A 50 -16.066 -4.295 8.325 1.00 25.00 C ATOM 623 CG LEU A 50 -15.883 -4.997 9.678 1.00 25.00 C ATOM 624 CD1 LEU A 50 -17.131 -4.789 10.532 1.00 25.00 C ATOM 625 CD2 LEU A 50 -15.619 -6.496 9.503 1.00 25.00 C ATOM 0 H LEU A 50 -14.177 -2.807 8.911 1.00 25.00 H new ATOM 0 HA LEU A 50 -14.337 -5.164 7.373 1.00 25.00 H new ATOM 0 HB2 LEU A 50 -16.449 -3.291 8.507 1.00 25.00 H new ATOM 0 HB3 LEU A 50 -16.829 -4.830 7.760 1.00 25.00 H new ATOM 0 HG LEU A 50 -15.016 -4.560 10.173 1.00 25.00 H new ATOM 0 HD11 LEU A 50 -17.002 -5.287 11.493 1.00 25.00 H new ATOM 0 HD12 LEU A 50 -17.287 -3.723 10.694 1.00 25.00 H new ATOM 0 HD13 LEU A 50 -17.997 -5.208 10.019 1.00 25.00 H new ATOM 0 HD21 LEU A 50 -15.495 -6.960 10.481 1.00 25.00 H new ATOM 0 HD22 LEU A 50 -16.462 -6.956 8.988 1.00 25.00 H new ATOM 0 HD23 LEU A 50 -14.712 -6.640 8.915 1.00 25.00 H new ATOM 637 N GLY A 51 -15.651 -4.617 5.244 1.00 25.00 N ATOM 638 CA GLY A 51 -16.041 -4.299 3.878 1.00 25.00 C ATOM 639 C GLY A 51 -14.863 -4.427 2.934 1.00 25.00 C ATOM 640 O GLY A 51 -13.714 -4.568 3.385 1.00 25.00 O ATOM 0 H GLY A 51 -15.753 -5.601 5.492 1.00 25.00 H new ATOM 0 HA2 GLY A 51 -16.841 -4.967 3.559 1.00 25.00 H new ATOM 0 HA3 GLY A 51 -16.437 -3.284 3.836 1.00 25.00 H new ATOM 644 N ALA A 52 -15.138 -4.391 1.642 1.00 25.00 N ATOM 645 CA ALA A 52 -14.106 -4.483 0.621 1.00 25.00 C ATOM 646 C ALA A 52 -13.474 -3.102 0.495 1.00 25.00 C ATOM 647 O ALA A 52 -14.175 -2.105 0.451 1.00 25.00 O ATOM 648 CB ALA A 52 -14.726 -4.918 -0.713 1.00 25.00 C ATOM 0 H ALA A 52 -16.083 -4.297 1.270 1.00 25.00 H new ATOM 0 HA ALA A 52 -13.352 -5.223 0.891 1.00 25.00 H new ATOM 0 HB1 ALA A 52 -13.947 -4.984 -1.472 1.00 25.00 H new ATOM 0 HB2 ALA A 52 -15.200 -5.892 -0.593 1.00 25.00 H new ATOM 0 HB3 ALA A 52 -15.473 -4.187 -1.023 1.00 25.00 H new ATOM 654 N ASP A 53 -12.159 -3.030 0.488 1.00 25.00 N ATOM 655 CA ASP A 53 -11.485 -1.736 0.452 1.00 25.00 C ATOM 656 C ASP A 53 -10.428 -1.716 -0.625 1.00 25.00 C ATOM 657 O ASP A 53 -9.741 -2.712 -0.849 1.00 25.00 O ATOM 658 CB ASP A 53 -10.841 -1.448 1.806 1.00 25.00 C ATOM 659 CG ASP A 53 -11.850 -1.428 2.928 1.00 25.00 C ATOM 660 OD1 ASP A 53 -12.759 -0.574 2.935 1.00 50.00 O ATOM 661 OD2 ASP A 53 -11.738 -2.272 3.845 1.00 50.00 O ATOM 0 H ASP A 53 -11.537 -3.838 0.506 1.00 25.00 H new ATOM 0 HA ASP A 53 -12.226 -0.968 0.230 1.00 25.00 H new ATOM 0 HB2 ASP A 53 -10.085 -2.205 2.014 1.00 25.00 H new ATOM 0 HB3 ASP A 53 -10.328 -0.487 1.765 1.00 25.00 H new ATOM 666 N THR A 54 -10.269 -0.577 -1.275 1.00 25.00 N ATOM 667 CA THR A 54 -9.226 -0.428 -2.281 1.00 25.00 C ATOM 668 C THR A 54 -8.303 0.696 -1.852 1.00 25.00 C ATOM 669 O THR A 54 -8.738 1.768 -1.421 1.00 25.00 O ATOM 670 CB THR A 54 -9.797 -0.219 -3.715 1.00 25.00 C ATOM 671 OG1 THR A 54 -8.719 -0.110 -4.648 1.00 25.00 O ATOM 672 CG2 THR A 54 -10.653 1.029 -3.827 1.00 25.00 C ATOM 0 H THR A 54 -10.842 0.254 -1.128 1.00 25.00 H new ATOM 0 HA THR A 54 -8.657 -1.356 -2.344 1.00 25.00 H new ATOM 0 HB THR A 54 -10.425 -1.082 -3.934 1.00 25.00 H new ATOM 0 HG1 THR A 54 -9.079 0.020 -5.550 1.00 25.00 H new ATOM 0 HG21 THR A 54 -11.025 1.125 -4.847 1.00 25.00 H new ATOM 0 HG22 THR A 54 -11.496 0.955 -3.139 1.00 25.00 H new ATOM 0 HG23 THR A 54 -10.055 1.904 -3.575 1.00 25.00 H new ATOM 680 N PHE A 55 -7.017 0.409 -1.908 1.00 25.00 N ATOM 681 CA PHE A 55 -5.990 1.341 -1.482 1.00 25.00 C ATOM 682 C PHE A 55 -5.239 1.722 -2.740 1.00 25.00 C ATOM 683 O PHE A 55 -4.710 0.853 -3.439 1.00 25.00 O ATOM 684 CB PHE A 55 -5.085 0.672 -0.455 1.00 25.00 C ATOM 685 CG PHE A 55 -5.844 0.031 0.680 1.00 25.00 C ATOM 686 CD1 PHE A 55 -6.324 0.803 1.754 1.00 25.00 C ATOM 687 CD2 PHE A 55 -6.106 -1.350 0.669 1.00 25.00 C ATOM 688 CE1 PHE A 55 -7.041 0.201 2.817 1.00 25.00 C ATOM 689 CE2 PHE A 55 -6.825 -1.956 1.724 1.00 25.00 C ATOM 690 CZ PHE A 55 -7.289 -1.183 2.795 1.00 25.00 C ATOM 0 H PHE A 55 -6.653 -0.480 -2.251 1.00 25.00 H new ATOM 0 HA PHE A 55 -6.399 2.229 -1.000 1.00 25.00 H new ATOM 0 HB2 PHE A 55 -4.480 -0.086 -0.953 1.00 25.00 H new ATOM 0 HB3 PHE A 55 -4.396 1.413 -0.050 1.00 25.00 H new ATOM 0 HD1 PHE A 55 -6.144 1.868 1.768 1.00 25.00 H new ATOM 0 HD2 PHE A 55 -5.754 -1.954 -0.154 1.00 25.00 H new ATOM 0 HE1 PHE A 55 -7.396 0.802 3.641 1.00 25.00 H new ATOM 0 HE2 PHE A 55 -7.017 -3.019 1.704 1.00 25.00 H new ATOM 0 HZ PHE A 55 -7.836 -1.648 3.602 1.00 25.00 H new ATOM 700 N ARG A 56 -5.300 2.993 -3.101 1.00 25.00 N ATOM 701 CA ARG A 56 -4.840 3.429 -4.415 1.00 25.00 C ATOM 702 C ARG A 56 -3.828 4.559 -4.332 1.00 25.00 C ATOM 703 O ARG A 56 -3.825 5.361 -3.401 1.00 25.00 O ATOM 704 CB ARG A 56 -6.072 3.847 -5.232 1.00 25.00 C ATOM 705 CG ARG A 56 -5.799 4.175 -6.692 1.00 25.00 C ATOM 706 CD ARG A 56 -7.088 4.397 -7.449 1.00 25.00 C ATOM 707 NE ARG A 56 -6.815 4.795 -8.839 1.00 25.00 N ATOM 708 CZ ARG A 56 -6.712 3.969 -9.876 1.00 25.00 C ATOM 709 NH1 ARG A 56 -6.863 2.672 -9.778 1.00 25.00 N ATOM 710 NH2 ARG A 56 -6.450 4.469 -11.053 1.00 25.00 N ATOM 0 H ARG A 56 -5.661 3.740 -2.508 1.00 25.00 H new ATOM 0 HA ARG A 56 -4.321 2.604 -4.902 1.00 25.00 H new ATOM 0 HB2 ARG A 56 -6.807 3.044 -5.188 1.00 25.00 H new ATOM 0 HB3 ARG A 56 -6.524 4.719 -4.758 1.00 25.00 H new ATOM 0 HG2 ARG A 56 -5.177 5.068 -6.757 1.00 25.00 H new ATOM 0 HG3 ARG A 56 -5.239 3.361 -7.152 1.00 25.00 H new ATOM 0 HD2 ARG A 56 -7.684 3.484 -7.438 1.00 25.00 H new ATOM 0 HD3 ARG A 56 -7.678 5.169 -6.954 1.00 25.00 H new ATOM 0 HE ARG A 56 -6.694 5.791 -9.023 1.00 25.00 H new ATOM 0 HH11 ARG A 56 -7.070 2.250 -8.873 1.00 25.00 H new ATOM 0 HH12 ARG A 56 -6.773 2.084 -10.607 1.00 25.00 H new ATOM 0 HH21 ARG A 56 -6.328 5.476 -11.164 1.00 25.00 H new ATOM 0 HH22 ARG A 56 -6.367 3.853 -11.862 1.00 25.00 H new ATOM 724 N PHE A 57 -2.948 4.588 -5.317 1.00 25.00 N ATOM 725 CA PHE A 57 -1.964 5.649 -5.437 1.00 25.00 C ATOM 726 C PHE A 57 -2.647 6.977 -5.775 1.00 25.00 C ATOM 727 O PHE A 57 -3.636 7.012 -6.505 1.00 25.00 O ATOM 728 CB PHE A 57 -0.970 5.306 -6.565 1.00 25.00 C ATOM 729 CG PHE A 57 -1.587 5.342 -7.952 1.00 25.00 C ATOM 730 CD1 PHE A 57 -1.631 6.546 -8.687 1.00 25.00 C ATOM 731 CD2 PHE A 57 -2.150 4.185 -8.520 1.00 25.00 C ATOM 732 CE1 PHE A 57 -2.239 6.594 -9.968 1.00 25.00 C ATOM 733 CE2 PHE A 57 -2.761 4.221 -9.796 1.00 25.00 C ATOM 734 CZ PHE A 57 -2.798 5.426 -10.523 1.00 25.00 C ATOM 0 H PHE A 57 -2.895 3.882 -6.051 1.00 25.00 H new ATOM 0 HA PHE A 57 -1.440 5.743 -4.486 1.00 25.00 H new ATOM 0 HB2 PHE A 57 -0.137 6.008 -6.529 1.00 25.00 H new ATOM 0 HB3 PHE A 57 -0.558 4.313 -6.385 1.00 25.00 H new ATOM 0 HD1 PHE A 57 -1.196 7.442 -8.269 1.00 25.00 H new ATOM 0 HD2 PHE A 57 -2.115 3.254 -7.974 1.00 25.00 H new ATOM 0 HE1 PHE A 57 -2.273 7.524 -10.516 1.00 25.00 H new ATOM 0 HE2 PHE A 57 -3.198 3.325 -10.212 1.00 25.00 H new ATOM 0 HZ PHE A 57 -3.253 5.455 -11.502 1.00 25.00 H new ATOM 744 N ALA A 58 -2.043 8.069 -5.336 1.00 25.00 N ATOM 745 CA ALA A 58 -2.414 9.404 -5.799 1.00 25.00 C ATOM 746 C ALA A 58 -1.221 9.982 -6.578 1.00 25.00 C ATOM 747 O ALA A 58 -1.383 10.765 -7.505 1.00 25.00 O ATOM 748 CB ALA A 58 -2.781 10.290 -4.613 1.00 25.00 C ATOM 0 H ALA A 58 -1.286 8.060 -4.653 1.00 25.00 H new ATOM 0 HA ALA A 58 -3.287 9.356 -6.450 1.00 25.00 H new ATOM 0 HB1 ALA A 58 -3.056 11.282 -4.971 1.00 25.00 H new ATOM 0 HB2 ALA A 58 -3.623 9.851 -4.078 1.00 25.00 H new ATOM 0 HB3 ALA A 58 -1.927 10.371 -3.941 1.00 25.00 H new ATOM 754 N LEU A 59 -0.024 9.552 -6.198 1.00 25.00 N ATOM 755 CA LEU A 59 1.223 9.936 -6.870 1.00 25.00 C ATOM 756 C LEU A 59 1.966 8.628 -7.089 1.00 25.00 C ATOM 757 O LEU A 59 1.686 7.664 -6.407 1.00 25.00 O ATOM 758 CB LEU A 59 2.093 10.853 -5.980 1.00 25.00 C ATOM 759 CG LEU A 59 1.688 12.311 -5.665 1.00 25.00 C ATOM 760 CD1 LEU A 59 1.341 13.085 -6.937 1.00 25.00 C ATOM 761 CD2 LEU A 59 0.537 12.410 -4.663 1.00 25.00 C ATOM 0 H LEU A 59 0.116 8.921 -5.409 1.00 25.00 H new ATOM 0 HA LEU A 59 1.014 10.483 -7.790 1.00 25.00 H new ATOM 0 HB2 LEU A 59 2.208 10.345 -5.023 1.00 25.00 H new ATOM 0 HB3 LEU A 59 3.080 10.893 -6.440 1.00 25.00 H new ATOM 0 HG LEU A 59 2.563 12.765 -5.201 1.00 25.00 H new ATOM 0 HD11 LEU A 59 1.061 14.106 -6.677 1.00 25.00 H new ATOM 0 HD12 LEU A 59 2.207 13.104 -7.599 1.00 25.00 H new ATOM 0 HD13 LEU A 59 0.508 12.598 -7.443 1.00 25.00 H new ATOM 0 HD21 LEU A 59 0.300 13.459 -4.484 1.00 25.00 H new ATOM 0 HD22 LEU A 59 -0.340 11.903 -5.065 1.00 25.00 H new ATOM 0 HD23 LEU A 59 0.830 11.939 -3.725 1.00 25.00 H new ATOM 773 N ARG A 60 2.962 8.587 -7.965 1.00 25.00 N ATOM 774 CA ARG A 60 3.763 7.357 -8.105 1.00 25.00 C ATOM 775 C ARG A 60 4.655 7.158 -6.877 1.00 25.00 C ATOM 776 O ARG A 60 5.133 6.079 -6.605 1.00 25.00 O ATOM 777 CB ARG A 60 4.618 7.380 -9.384 1.00 25.00 C ATOM 778 CG ARG A 60 5.806 8.335 -9.341 1.00 25.00 C ATOM 779 CD ARG A 60 6.705 8.139 -10.535 1.00 25.00 C ATOM 780 NE ARG A 60 7.944 8.927 -10.401 1.00 25.00 N ATOM 781 CZ ARG A 60 9.024 8.782 -11.159 1.00 25.00 C ATOM 782 NH1 ARG A 60 9.094 7.898 -12.121 1.00 25.00 N ATOM 783 NH2 ARG A 60 10.063 9.535 -10.941 1.00 25.00 N ATOM 0 H ARG A 60 3.236 9.358 -8.575 1.00 25.00 H new ATOM 0 HA ARG A 60 3.070 6.519 -8.182 1.00 25.00 H new ATOM 0 HB2 ARG A 60 4.986 6.372 -9.576 1.00 25.00 H new ATOM 0 HB3 ARG A 60 3.981 7.652 -10.225 1.00 25.00 H new ATOM 0 HG2 ARG A 60 5.448 9.364 -9.317 1.00 25.00 H new ATOM 0 HG3 ARG A 60 6.373 8.173 -8.425 1.00 25.00 H new ATOM 0 HD2 ARG A 60 6.952 7.082 -10.639 1.00 25.00 H new ATOM 0 HD3 ARG A 60 6.179 8.434 -11.443 1.00 25.00 H new ATOM 0 HE ARG A 60 7.973 9.638 -9.670 1.00 25.00 H new ATOM 0 HH11 ARG A 60 8.299 7.288 -12.312 1.00 25.00 H new ATOM 0 HH12 ARG A 60 9.943 7.819 -12.680 1.00 25.00 H new ATOM 0 HH21 ARG A 60 10.042 10.229 -10.193 1.00 25.00 H new ATOM 0 HH22 ARG A 60 10.898 9.432 -11.518 1.00 25.00 H new ATOM 797 N GLU A 61 4.881 8.233 -6.144 1.00 25.00 N ATOM 798 CA GLU A 61 5.795 8.227 -5.001 1.00 25.00 C ATOM 799 C GLU A 61 5.055 7.992 -3.691 1.00 25.00 C ATOM 800 O GLU A 61 5.587 8.191 -2.606 1.00 25.00 O ATOM 801 CB GLU A 61 6.519 9.562 -4.957 1.00 25.00 C ATOM 802 CG GLU A 61 7.207 9.873 -6.291 1.00 25.00 C ATOM 803 CD GLU A 61 8.197 11.016 -6.230 1.00 25.00 C ATOM 804 OE1 GLU A 61 8.461 11.556 -5.147 1.00 25.00 O ATOM 805 OE2 GLU A 61 8.818 11.286 -7.288 1.00 25.00 O ATOM 0 H GLU A 61 4.440 9.136 -6.318 1.00 25.00 H new ATOM 0 HA GLU A 61 6.506 7.410 -5.122 1.00 25.00 H new ATOM 0 HB2 GLU A 61 5.809 10.354 -4.719 1.00 25.00 H new ATOM 0 HB3 GLU A 61 7.261 9.549 -4.158 1.00 25.00 H new ATOM 0 HG2 GLU A 61 7.724 8.978 -6.637 1.00 25.00 H new ATOM 0 HG3 GLU A 61 6.444 10.108 -7.034 1.00 25.00 H new ATOM 812 N ASP A 62 3.803 7.584 -3.819 1.00 25.00 N ATOM 813 CA ASP A 62 2.927 7.339 -2.670 1.00 25.00 C ATOM 814 C ASP A 62 3.484 6.313 -1.687 1.00 25.00 C ATOM 815 O ASP A 62 3.245 6.412 -0.481 1.00 25.00 O ATOM 816 CB ASP A 62 1.569 6.846 -3.156 1.00 25.00 C ATOM 817 CG ASP A 62 0.435 7.446 -2.386 1.00 25.00 C ATOM 818 OD1 ASP A 62 0.445 7.373 -1.142 1.00 25.00 O ATOM 819 OD2 ASP A 62 -0.423 8.094 -3.018 1.00 25.00 O ATOM 0 H ASP A 62 3.359 7.411 -4.721 1.00 25.00 H new ATOM 0 HA ASP A 62 2.845 8.290 -2.143 1.00 25.00 H new ATOM 0 HB2 ASP A 62 1.455 7.087 -4.213 1.00 25.00 H new ATOM 0 HB3 ASP A 62 1.528 5.760 -3.071 1.00 25.00 H new ATOM 824 N SER A 63 4.222 5.341 -2.208 1.00 25.00 N ATOM 825 CA SER A 63 4.843 4.290 -1.401 1.00 25.00 C ATOM 826 C SER A 63 6.302 4.137 -1.845 1.00 25.00 C ATOM 827 O SER A 63 6.622 3.368 -2.751 1.00 25.00 O ATOM 828 CB SER A 63 4.073 2.982 -1.574 1.00 25.00 C ATOM 829 OG SER A 63 3.960 2.640 -2.946 1.00 25.00 O ATOM 0 H SER A 63 4.410 5.256 -3.207 1.00 25.00 H new ATOM 0 HA SER A 63 4.817 4.554 -0.344 1.00 25.00 H new ATOM 0 HB2 SER A 63 4.582 2.182 -1.036 1.00 25.00 H new ATOM 0 HB3 SER A 63 3.080 3.079 -1.136 1.00 25.00 H new ATOM 0 HG SER A 63 4.834 2.733 -3.379 1.00 25.00 H new ATOM 835 N HIS A 64 7.165 4.961 -1.271 1.00 25.00 N ATOM 836 CA HIS A 64 8.545 5.084 -1.734 1.00 25.00 C ATOM 837 C HIS A 64 9.520 5.215 -0.560 1.00 25.00 C ATOM 838 O HIS A 64 9.182 5.802 0.460 1.00 25.00 O ATOM 839 CB HIS A 64 8.612 6.330 -2.626 1.00 25.00 C ATOM 840 CG HIS A 64 9.961 6.594 -3.211 1.00 25.00 C ATOM 841 ND1 HIS A 64 10.763 7.646 -2.853 1.00 25.00 N ATOM 842 CD2 HIS A 64 10.656 5.929 -4.173 1.00 25.00 C ATOM 843 CE1 HIS A 64 11.877 7.585 -3.571 1.00 25.00 C ATOM 844 NE2 HIS A 64 11.862 6.561 -4.400 1.00 25.00 N ATOM 0 H HIS A 64 6.935 5.560 -0.478 1.00 25.00 H new ATOM 0 HA HIS A 64 8.836 4.190 -2.286 1.00 25.00 H new ATOM 0 HB2 HIS A 64 7.892 6.221 -3.437 1.00 25.00 H new ATOM 0 HB3 HIS A 64 8.306 7.198 -2.042 1.00 25.00 H new ATOM 0 HD2 HIS A 64 10.315 5.040 -4.683 1.00 25.00 H new ATOM 0 HE1 HIS A 64 12.694 8.287 -3.487 1.00 25.00 H new ATOM 0 HE2 HIS A 64 12.586 6.293 -5.066 1.00 25.00 H new ATOM 852 N ARG A 65 10.733 4.697 -0.709 1.00 25.00 N ATOM 853 CA ARG A 65 11.786 4.845 0.301 1.00 25.00 C ATOM 854 C ARG A 65 12.951 5.582 -0.335 1.00 25.00 C ATOM 855 O ARG A 65 13.128 5.541 -1.541 1.00 25.00 O ATOM 856 CB ARG A 65 12.294 3.489 0.802 1.00 25.00 C ATOM 857 CG ARG A 65 11.240 2.558 1.373 1.00 25.00 C ATOM 858 CD ARG A 65 11.910 1.566 2.330 1.00 25.00 C ATOM 859 NE ARG A 65 11.146 0.320 2.496 1.00 25.00 N ATOM 860 CZ ARG A 65 10.142 0.117 3.336 1.00 25.00 C ATOM 861 NH1 ARG A 65 9.709 1.041 4.154 1.00 25.00 N ATOM 862 NH2 ARG A 65 9.568 -1.052 3.342 1.00 25.00 N ATOM 0 H ARG A 65 11.019 4.163 -1.530 1.00 25.00 H new ATOM 0 HA ARG A 65 11.372 5.389 1.150 1.00 25.00 H new ATOM 0 HB2 ARG A 65 12.791 2.981 -0.024 1.00 25.00 H new ATOM 0 HB3 ARG A 65 13.049 3.666 1.568 1.00 25.00 H new ATOM 0 HG2 ARG A 65 10.478 3.132 1.900 1.00 25.00 H new ATOM 0 HG3 ARG A 65 10.736 2.022 0.568 1.00 25.00 H new ATOM 0 HD2 ARG A 65 12.906 1.328 1.958 1.00 25.00 H new ATOM 0 HD3 ARG A 65 12.038 2.039 3.304 1.00 25.00 H new ATOM 0 HE ARG A 65 11.416 -0.466 1.905 1.00 25.00 H new ATOM 0 HH11 ARG A 65 10.148 1.962 4.162 1.00 25.00 H new ATOM 0 HH12 ARG A 65 8.932 0.841 4.784 1.00 25.00 H new ATOM 0 HH21 ARG A 65 9.894 -1.783 2.710 1.00 25.00 H new ATOM 0 HH22 ARG A 65 8.793 -1.236 3.979 1.00 25.00 H new ATOM 876 N SER A 66 13.752 6.229 0.488 1.00 25.00 N ATOM 877 CA SER A 66 14.921 6.970 0.035 1.00 25.00 C ATOM 878 C SER A 66 15.902 6.886 1.196 1.00 25.00 C ATOM 879 O SER A 66 15.474 6.728 2.342 1.00 25.00 O ATOM 880 CB SER A 66 14.516 8.429 -0.238 1.00 25.00 C ATOM 881 OG SER A 66 15.637 9.268 -0.456 1.00 25.00 O ATOM 0 H SER A 66 13.612 6.258 1.498 1.00 25.00 H new ATOM 0 HA SER A 66 15.353 6.576 -0.885 1.00 25.00 H new ATOM 0 HB2 SER A 66 13.863 8.465 -1.110 1.00 25.00 H new ATOM 0 HB3 SER A 66 13.941 8.808 0.607 1.00 25.00 H new ATOM 0 HG SER A 66 15.332 10.184 -0.627 1.00 25.00 H new ATOM 887 N PRO A 67 17.220 7.024 0.945 1.00 25.00 N ATOM 888 CA PRO A 67 18.089 7.059 2.129 1.00 25.00 C ATOM 889 C PRO A 67 17.868 8.320 2.974 1.00 25.00 C ATOM 890 O PRO A 67 18.282 8.387 4.121 1.00 25.00 O ATOM 891 CB PRO A 67 19.495 7.033 1.522 1.00 25.00 C ATOM 892 CG PRO A 67 19.330 7.687 0.198 1.00 25.00 C ATOM 893 CD PRO A 67 18.004 7.176 -0.300 1.00 25.00 C ATOM 0 HA PRO A 67 17.897 6.235 2.816 1.00 25.00 H new ATOM 0 HB2 PRO A 67 20.209 7.571 2.146 1.00 25.00 H new ATOM 0 HB3 PRO A 67 19.866 6.013 1.419 1.00 25.00 H new ATOM 0 HG2 PRO A 67 19.331 8.773 0.287 1.00 25.00 H new ATOM 0 HG3 PRO A 67 20.140 7.422 -0.481 1.00 25.00 H new ATOM 0 HD2 PRO A 67 17.534 7.877 -0.990 1.00 25.00 H new ATOM 0 HD3 PRO A 67 18.109 6.229 -0.830 1.00 25.00 H new ATOM 901 N LEU A 68 17.175 9.300 2.404 1.00 25.00 N ATOM 902 CA LEU A 68 16.860 10.546 3.101 1.00 25.00 C ATOM 903 C LEU A 68 15.575 10.436 3.934 1.00 25.00 C ATOM 904 O LEU A 68 15.174 11.392 4.588 1.00 25.00 O ATOM 905 CB LEU A 68 16.699 11.678 2.076 1.00 25.00 C ATOM 906 CG LEU A 68 17.899 11.931 1.145 1.00 25.00 C ATOM 907 CD1 LEU A 68 17.528 12.999 0.119 1.00 25.00 C ATOM 908 CD2 LEU A 68 19.143 12.371 1.922 1.00 25.00 C ATOM 0 H LEU A 68 16.816 9.256 1.450 1.00 25.00 H new ATOM 0 HA LEU A 68 17.683 10.758 3.783 1.00 25.00 H new ATOM 0 HB2 LEU A 68 15.827 11.459 1.459 1.00 25.00 H new ATOM 0 HB3 LEU A 68 16.484 12.600 2.616 1.00 25.00 H new ATOM 0 HG LEU A 68 18.138 10.993 0.643 1.00 25.00 H new ATOM 0 HD11 LEU A 68 18.376 13.180 -0.541 1.00 25.00 H new ATOM 0 HD12 LEU A 68 16.676 12.658 -0.470 1.00 25.00 H new ATOM 0 HD13 LEU A 68 17.266 13.923 0.634 1.00 25.00 H new ATOM 0 HD21 LEU A 68 19.966 12.539 1.227 1.00 25.00 H new ATOM 0 HD22 LEU A 68 18.928 13.295 2.460 1.00 25.00 H new ATOM 0 HD23 LEU A 68 19.422 11.593 2.633 1.00 25.00 H new ATOM 920 N GLY A 69 14.924 9.279 3.895 1.00 25.00 N ATOM 921 CA GLY A 69 13.692 9.076 4.644 1.00 25.00 C ATOM 922 C GLY A 69 12.718 8.185 3.901 1.00 25.00 C ATOM 923 O GLY A 69 12.879 7.943 2.711 1.00 25.00 O ATOM 0 H GLY A 69 15.229 8.470 3.354 1.00 25.00 H new ATOM 0 HA2 GLY A 69 13.925 8.631 5.612 1.00 25.00 H new ATOM 0 HA3 GLY A 69 13.224 10.041 4.841 1.00 25.00 H new ATOM 927 N THR A 70 11.707 7.679 4.592 1.00 25.00 N ATOM 928 CA THR A 70 10.737 6.780 3.968 1.00 25.00 C ATOM 929 C THR A 70 9.354 7.411 3.925 1.00 25.00 C ATOM 930 O THR A 70 8.947 8.131 4.837 1.00 25.00 O ATOM 931 CB THR A 70 10.697 5.399 4.686 1.00 25.00 C ATOM 932 OG1 THR A 70 9.866 4.501 3.946 1.00 25.00 O ATOM 933 CG2 THR A 70 10.152 5.492 6.112 1.00 25.00 C ATOM 0 H THR A 70 11.534 7.872 5.579 1.00 25.00 H new ATOM 0 HA THR A 70 11.062 6.610 2.942 1.00 25.00 H new ATOM 0 HB THR A 70 11.724 5.039 4.738 1.00 25.00 H new ATOM 0 HG1 THR A 70 9.784 4.817 3.022 1.00 25.00 H new ATOM 0 HG21 THR A 70 10.147 4.501 6.565 1.00 25.00 H new ATOM 0 HG22 THR A 70 10.785 6.156 6.701 1.00 25.00 H new ATOM 0 HG23 THR A 70 9.136 5.886 6.088 1.00 25.00 H new ATOM 941 N PHE A 71 8.656 7.143 2.834 1.00 25.00 N ATOM 942 CA PHE A 71 7.328 7.678 2.573 1.00 25.00 C ATOM 943 C PHE A 71 6.403 6.503 2.279 1.00 25.00 C ATOM 944 O PHE A 71 5.305 6.667 1.772 1.00 25.00 O ATOM 945 CB PHE A 71 7.396 8.633 1.382 1.00 25.00 C ATOM 946 CG PHE A 71 8.528 9.620 1.482 1.00 25.00 C ATOM 947 CD1 PHE A 71 8.406 10.771 2.281 1.00 25.00 C ATOM 948 CD2 PHE A 71 9.742 9.385 0.802 1.00 25.00 C ATOM 949 CE1 PHE A 71 9.482 11.687 2.403 1.00 25.00 C ATOM 950 CE2 PHE A 71 10.826 10.288 0.919 1.00 25.00 C ATOM 951 CZ PHE A 71 10.695 11.441 1.722 1.00 25.00 C ATOM 0 H PHE A 71 9.002 6.536 2.091 1.00 25.00 H new ATOM 0 HA PHE A 71 6.949 8.234 3.431 1.00 25.00 H new ATOM 0 HB2 PHE A 71 7.506 8.054 0.465 1.00 25.00 H new ATOM 0 HB3 PHE A 71 6.454 9.176 1.305 1.00 25.00 H new ATOM 0 HD1 PHE A 71 7.482 10.960 2.808 1.00 25.00 H new ATOM 0 HD2 PHE A 71 9.845 8.505 0.184 1.00 25.00 H new ATOM 0 HE1 PHE A 71 9.374 12.570 3.015 1.00 25.00 H new ATOM 0 HE2 PHE A 71 11.751 10.095 0.395 1.00 25.00 H new ATOM 0 HZ PHE A 71 11.519 12.133 1.816 1.00 25.00 H new ATOM 961 N SER A 72 6.894 5.307 2.577 1.00 25.00 N ATOM 962 CA SER A 72 6.138 4.076 2.368 1.00 25.00 C ATOM 963 C SER A 72 4.937 4.053 3.296 1.00 25.00 C ATOM 964 O SER A 72 5.043 4.440 4.462 1.00 25.00 O ATOM 965 CB SER A 72 7.018 2.873 2.686 1.00 25.00 C ATOM 966 OG SER A 72 7.458 2.957 4.035 1.00 25.00 O ATOM 0 H SER A 72 7.824 5.162 2.969 1.00 25.00 H new ATOM 0 HA SER A 72 5.810 4.034 1.329 1.00 25.00 H new ATOM 0 HB2 SER A 72 6.461 1.949 2.530 1.00 25.00 H new ATOM 0 HB3 SER A 72 7.875 2.846 2.013 1.00 25.00 H new ATOM 0 HG SER A 72 8.296 3.463 4.075 1.00 25.00 H new ATOM 972 N ASP A 73 3.813 3.577 2.792 1.00 25.00 N ATOM 973 CA ASP A 73 2.593 3.504 3.588 1.00 25.00 C ATOM 974 C ASP A 73 2.468 2.144 4.237 1.00 25.00 C ATOM 975 O ASP A 73 3.043 1.161 3.761 1.00 25.00 O ATOM 976 CB ASP A 73 1.364 3.750 2.709 1.00 25.00 C ATOM 977 CG ASP A 73 1.273 5.180 2.243 1.00 25.00 C ATOM 978 OD1 ASP A 73 2.076 6.015 2.704 1.00 50.00 O ATOM 979 OD2 ASP A 73 0.429 5.505 1.394 1.00 50.00 O ATOM 0 H ASP A 73 3.716 3.234 1.836 1.00 25.00 H new ATOM 0 HA ASP A 73 2.648 4.273 4.359 1.00 25.00 H new ATOM 0 HB2 ASP A 73 1.401 3.089 1.843 1.00 25.00 H new ATOM 0 HB3 ASP A 73 0.463 3.494 3.267 1.00 25.00 H new ATOM 984 N LEU A 74 1.680 2.100 5.301 1.00 25.00 N ATOM 985 CA LEU A 74 1.324 0.856 5.970 1.00 25.00 C ATOM 986 C LEU A 74 -0.170 0.702 5.762 1.00 25.00 C ATOM 987 O LEU A 74 -0.922 1.656 5.972 1.00 25.00 O ATOM 988 CB LEU A 74 1.621 0.910 7.473 1.00 25.00 C ATOM 989 CG LEU A 74 3.035 0.493 7.916 1.00 25.00 C ATOM 990 CD1 LEU A 74 4.113 1.500 7.489 1.00 25.00 C ATOM 991 CD2 LEU A 74 3.053 0.342 9.438 1.00 25.00 C ATOM 0 H LEU A 74 1.267 2.930 5.727 1.00 25.00 H new ATOM 0 HA LEU A 74 1.901 0.025 5.565 1.00 25.00 H new ATOM 0 HB2 LEU A 74 1.443 1.929 7.818 1.00 25.00 H new ATOM 0 HB3 LEU A 74 0.902 0.270 7.985 1.00 25.00 H new ATOM 0 HG LEU A 74 3.269 -0.452 7.426 1.00 25.00 H new ATOM 0 HD11 LEU A 74 5.089 1.154 7.829 1.00 25.00 H new ATOM 0 HD12 LEU A 74 4.117 1.590 6.403 1.00 25.00 H new ATOM 0 HD13 LEU A 74 3.899 2.472 7.932 1.00 25.00 H new ATOM 0 HD21 LEU A 74 4.051 0.047 9.763 1.00 25.00 H new ATOM 0 HD22 LEU A 74 2.787 1.292 9.901 1.00 25.00 H new ATOM 0 HD23 LEU A 74 2.334 -0.421 9.736 1.00 25.00 H new ATOM 1003 N ILE A 75 -0.608 -0.473 5.355 1.00 25.00 N ATOM 1004 CA ILE A 75 -2.034 -0.731 5.193 1.00 25.00 C ATOM 1005 C ILE A 75 -2.405 -1.649 6.336 1.00 25.00 C ATOM 1006 O ILE A 75 -1.618 -2.510 6.733 1.00 25.00 O ATOM 1007 CB ILE A 75 -2.382 -1.366 3.839 1.00 25.00 C ATOM 1008 CG1 ILE A 75 -1.719 -0.555 2.693 1.00 25.00 C ATOM 1009 CG2 ILE A 75 -3.907 -1.431 3.645 1.00 25.00 C ATOM 1010 CD1 ILE A 75 -1.999 -1.070 1.266 1.00 25.00 C ATOM 0 H ILE A 75 -0.004 -1.264 5.130 1.00 25.00 H new ATOM 0 HA ILE A 75 -2.595 0.204 5.209 1.00 25.00 H new ATOM 0 HB ILE A 75 -1.997 -2.386 3.819 1.00 25.00 H new ATOM 0 HG12 ILE A 75 -2.058 0.479 2.760 1.00 25.00 H new ATOM 0 HG13 ILE A 75 -0.641 -0.548 2.853 1.00 25.00 H new ATOM 0 HG21 ILE A 75 -4.132 -1.884 2.680 1.00 25.00 H new ATOM 0 HG22 ILE A 75 -4.350 -2.032 4.440 1.00 25.00 H new ATOM 0 HG23 ILE A 75 -4.321 -0.423 3.678 1.00 25.00 H new ATOM 0 HD11 ILE A 75 -1.490 -0.433 0.543 1.00 25.00 H new ATOM 0 HD12 ILE A 75 -1.633 -2.092 1.170 1.00 25.00 H new ATOM 0 HD13 ILE A 75 -3.072 -1.049 1.076 1.00 25.00 H new ATOM 1022 N LEU A 76 -3.571 -1.402 6.893 1.00 25.00 N ATOM 1023 CA LEU A 76 -4.041 -2.057 8.108 1.00 25.00 C ATOM 1024 C LEU A 76 -5.431 -2.633 7.865 1.00 25.00 C ATOM 1025 O LEU A 76 -6.149 -2.165 6.973 1.00 25.00 O ATOM 1026 CB LEU A 76 -4.095 -1.037 9.256 1.00 25.00 C ATOM 1027 CG LEU A 76 -2.795 -0.287 9.601 1.00 25.00 C ATOM 1028 CD1 LEU A 76 -3.089 0.815 10.617 1.00 25.00 C ATOM 1029 CD2 LEU A 76 -1.746 -1.223 10.161 1.00 25.00 C ATOM 0 H LEU A 76 -4.236 -0.729 6.512 1.00 25.00 H new ATOM 0 HA LEU A 76 -3.357 -2.862 8.377 1.00 25.00 H new ATOM 0 HB2 LEU A 76 -4.856 -0.296 9.012 1.00 25.00 H new ATOM 0 HB3 LEU A 76 -4.432 -1.557 10.153 1.00 25.00 H new ATOM 0 HG LEU A 76 -2.405 0.149 8.681 1.00 25.00 H new ATOM 0 HD11 LEU A 76 -2.166 1.343 10.858 1.00 25.00 H new ATOM 0 HD12 LEU A 76 -3.809 1.516 10.195 1.00 25.00 H new ATOM 0 HD13 LEU A 76 -3.502 0.373 11.524 1.00 25.00 H new ATOM 0 HD21 LEU A 76 -0.842 -0.660 10.393 1.00 25.00 H new ATOM 0 HD22 LEU A 76 -2.124 -1.692 11.069 1.00 25.00 H new ATOM 0 HD23 LEU A 76 -1.515 -1.993 9.425 1.00 25.00 H new ATOM 1041 N ASP A 77 -5.789 -3.646 8.651 1.00 25.00 N ATOM 1042 CA ASP A 77 -7.082 -4.353 8.542 1.00 25.00 C ATOM 1043 C ASP A 77 -7.275 -4.881 7.119 1.00 25.00 C ATOM 1044 O ASP A 77 -8.372 -4.818 6.547 1.00 25.00 O ATOM 1045 CB ASP A 77 -8.273 -3.456 8.934 1.00 25.00 C ATOM 1046 CG ASP A 77 -8.304 -3.113 10.412 1.00 25.00 C ATOM 1047 OD1 ASP A 77 -7.343 -3.413 11.150 1.00 25.00 O ATOM 1048 OD2 ASP A 77 -9.322 -2.519 10.830 1.00 25.00 O ATOM 0 H ASP A 77 -5.190 -4.010 9.392 1.00 25.00 H new ATOM 0 HA ASP A 77 -7.054 -5.187 9.244 1.00 25.00 H new ATOM 0 HB2 ASP A 77 -8.231 -2.534 8.355 1.00 25.00 H new ATOM 0 HB3 ASP A 77 -9.202 -3.959 8.665 1.00 25.00 H new ATOM 1053 N PHE A 78 -6.185 -5.357 6.535 1.00 25.00 N ATOM 1054 CA PHE A 78 -6.213 -5.854 5.166 1.00 25.00 C ATOM 1055 C PHE A 78 -6.786 -7.261 5.121 1.00 25.00 C ATOM 1056 O PHE A 78 -6.238 -8.211 5.698 1.00 25.00 O ATOM 1057 CB PHE A 78 -4.816 -5.851 4.563 1.00 25.00 C ATOM 1058 CG PHE A 78 -4.806 -6.018 3.068 1.00 25.00 C ATOM 1059 CD1 PHE A 78 -4.958 -4.900 2.229 1.00 25.00 C ATOM 1060 CD2 PHE A 78 -4.658 -7.291 2.488 1.00 25.00 C ATOM 1061 CE1 PHE A 78 -4.965 -5.044 0.820 1.00 25.00 C ATOM 1062 CE2 PHE A 78 -4.665 -7.449 1.075 1.00 25.00 C ATOM 1063 CZ PHE A 78 -4.819 -6.322 0.242 1.00 25.00 C ATOM 0 H PHE A 78 -5.272 -5.410 6.986 1.00 25.00 H new ATOM 0 HA PHE A 78 -6.851 -5.191 4.581 1.00 25.00 H new ATOM 0 HB2 PHE A 78 -4.321 -4.914 4.819 1.00 25.00 H new ATOM 0 HB3 PHE A 78 -4.233 -6.654 5.014 1.00 25.00 H new ATOM 0 HD1 PHE A 78 -5.071 -3.918 2.665 1.00 25.00 H new ATOM 0 HD2 PHE A 78 -4.538 -8.157 3.122 1.00 25.00 H new ATOM 0 HE1 PHE A 78 -5.082 -4.176 0.189 1.00 25.00 H new ATOM 0 HE2 PHE A 78 -4.552 -8.431 0.640 1.00 25.00 H new ATOM 0 HZ PHE A 78 -4.825 -6.437 -0.832 1.00 25.00 H new ATOM 1073 N ASP A 79 -7.899 -7.380 4.427 1.00 25.00 N ATOM 1074 CA ASP A 79 -8.590 -8.658 4.258 1.00 25.00 C ATOM 1075 C ASP A 79 -7.833 -9.486 3.229 1.00 25.00 C ATOM 1076 O ASP A 79 -7.322 -8.947 2.254 1.00 25.00 O ATOM 1077 CB ASP A 79 -10.022 -8.448 3.776 1.00 25.00 C ATOM 1078 CG ASP A 79 -10.942 -7.993 4.882 1.00 25.00 C ATOM 1079 OD1 ASP A 79 -11.018 -8.675 5.914 1.00 25.00 O ATOM 1080 OD2 ASP A 79 -11.591 -6.933 4.721 1.00 25.00 O ATOM 0 H ASP A 79 -8.357 -6.597 3.961 1.00 25.00 H new ATOM 0 HA ASP A 79 -8.624 -9.171 5.219 1.00 25.00 H new ATOM 0 HB2 ASP A 79 -10.028 -7.708 2.975 1.00 25.00 H new ATOM 0 HB3 ASP A 79 -10.400 -9.379 3.353 1.00 25.00 H new ATOM 1085 N PRO A 80 -7.765 -10.812 3.417 1.00 25.00 N ATOM 1086 CA PRO A 80 -6.907 -11.585 2.512 1.00 25.00 C ATOM 1087 C PRO A 80 -7.470 -11.833 1.116 1.00 25.00 C ATOM 1088 O PRO A 80 -6.752 -12.310 0.240 1.00 25.00 O ATOM 1089 CB PRO A 80 -6.753 -12.906 3.258 1.00 25.00 C ATOM 1090 CG PRO A 80 -8.032 -13.066 3.980 1.00 25.00 C ATOM 1091 CD PRO A 80 -8.366 -11.674 4.455 1.00 25.00 C ATOM 0 HA PRO A 80 -5.985 -11.042 2.305 1.00 25.00 H new ATOM 0 HB2 PRO A 80 -6.578 -13.733 2.571 1.00 25.00 H new ATOM 0 HB3 PRO A 80 -5.908 -12.879 3.946 1.00 25.00 H new ATOM 0 HG2 PRO A 80 -8.811 -13.462 3.328 1.00 25.00 H new ATOM 0 HG3 PRO A 80 -7.934 -13.759 4.816 1.00 25.00 H new ATOM 0 HD2 PRO A 80 -9.443 -11.522 4.532 1.00 25.00 H new ATOM 0 HD3 PRO A 80 -7.945 -11.472 5.440 1.00 25.00 H new ATOM 1099 N SER A 81 -8.751 -11.559 0.911 1.00 25.00 N ATOM 1100 CA SER A 81 -9.393 -11.823 -0.383 1.00 25.00 C ATOM 1101 C SER A 81 -10.520 -10.848 -0.708 1.00 25.00 C ATOM 1102 O SER A 81 -11.379 -11.141 -1.535 1.00 25.00 O ATOM 1103 CB SER A 81 -9.965 -13.240 -0.384 1.00 25.00 C ATOM 1104 OG SER A 81 -8.984 -14.173 0.036 1.00 25.00 O ATOM 0 H SER A 81 -9.369 -11.156 1.616 1.00 25.00 H new ATOM 0 HA SER A 81 -8.622 -11.700 -1.144 1.00 25.00 H new ATOM 0 HB2 SER A 81 -10.829 -13.290 0.278 1.00 25.00 H new ATOM 0 HB3 SER A 81 -10.314 -13.497 -1.384 1.00 25.00 H new ATOM 0 HG SER A 81 -9.367 -15.075 0.031 1.00 25.00 H new ATOM 1110 N GLN A 82 -10.556 -9.720 -0.010 1.00 25.00 N ATOM 1111 CA GLN A 82 -11.617 -8.721 -0.214 1.00 25.00 C ATOM 1112 C GLN A 82 -11.056 -7.314 -0.357 1.00 25.00 C ATOM 1113 O GLN A 82 -11.783 -6.393 -0.698 1.00 25.00 O ATOM 1114 CB GLN A 82 -12.616 -8.741 0.955 1.00 25.00 C ATOM 1115 CG GLN A 82 -13.421 -10.036 1.087 1.00 25.00 C ATOM 1116 CD GLN A 82 -14.551 -10.124 0.077 1.00 25.00 C ATOM 1117 OE1 GLN A 82 -15.663 -9.701 0.345 1.00 25.00 O ATOM 1118 NE2 GLN A 82 -14.278 -10.681 -1.073 1.00 25.00 N ATOM 0 H GLN A 82 -9.870 -9.467 0.701 1.00 25.00 H new ATOM 0 HA GLN A 82 -12.124 -8.989 -1.141 1.00 25.00 H new ATOM 0 HB2 GLN A 82 -12.071 -8.572 1.884 1.00 25.00 H new ATOM 0 HB3 GLN A 82 -13.310 -7.909 0.836 1.00 25.00 H new ATOM 0 HG2 GLN A 82 -12.755 -10.889 0.957 1.00 25.00 H new ATOM 0 HG3 GLN A 82 -13.832 -10.103 2.094 1.00 25.00 H new ATOM 0 HE21 GLN A 82 -13.336 -11.024 -1.263 1.00 25.00 H new ATOM 0 HE22 GLN A 82 -15.007 -10.773 -1.781 1.00 25.00 H new ATOM 1127 N ASP A 83 -9.770 -7.144 -0.100 1.00 25.00 N ATOM 1128 CA ASP A 83 -9.152 -5.826 -0.183 1.00 25.00 C ATOM 1129 C ASP A 83 -8.156 -5.842 -1.328 1.00 25.00 C ATOM 1130 O ASP A 83 -7.643 -6.896 -1.684 1.00 25.00 O ATOM 1131 CB ASP A 83 -8.465 -5.467 1.130 1.00 25.00 C ATOM 1132 CG ASP A 83 -9.455 -5.105 2.229 1.00 25.00 C ATOM 1133 OD1 ASP A 83 -10.667 -4.996 1.974 1.00 50.00 O ATOM 1134 OD2 ASP A 83 -9.034 -4.945 3.389 1.00 50.00 O ATOM 0 H ASP A 83 -9.134 -7.896 0.167 1.00 25.00 H new ATOM 0 HA ASP A 83 -9.914 -5.068 -0.366 1.00 25.00 H new ATOM 0 HB2 ASP A 83 -7.855 -6.308 1.458 1.00 25.00 H new ATOM 0 HB3 ASP A 83 -7.789 -4.628 0.965 1.00 25.00 H new ATOM 1139 N LYS A 84 -7.946 -4.692 -1.952 1.00 25.00 N ATOM 1140 CA LYS A 84 -7.173 -4.612 -3.196 1.00 25.00 C ATOM 1141 C LYS A 84 -6.211 -3.430 -3.196 1.00 25.00 C ATOM 1142 O LYS A 84 -6.512 -2.381 -2.637 1.00 25.00 O ATOM 1143 CB LYS A 84 -8.179 -4.500 -4.345 1.00 25.00 C ATOM 1144 CG LYS A 84 -7.600 -4.558 -5.745 1.00 25.00 C ATOM 1145 CD LYS A 84 -8.731 -4.808 -6.737 1.00 25.00 C ATOM 1146 CE LYS A 84 -8.282 -4.654 -8.177 1.00 25.00 C ATOM 1147 NZ LYS A 84 -8.162 -3.204 -8.541 1.00 25.00 N ATOM 0 H LYS A 84 -8.299 -3.794 -1.620 1.00 25.00 H new ATOM 0 HA LYS A 84 -6.553 -5.502 -3.306 1.00 25.00 H new ATOM 0 HB2 LYS A 84 -8.909 -5.303 -4.242 1.00 25.00 H new ATOM 0 HB3 LYS A 84 -8.721 -3.561 -4.236 1.00 25.00 H new ATOM 0 HG2 LYS A 84 -7.091 -3.624 -5.981 1.00 25.00 H new ATOM 0 HG3 LYS A 84 -6.857 -5.352 -5.813 1.00 25.00 H new ATOM 0 HD2 LYS A 84 -9.126 -5.813 -6.588 1.00 25.00 H new ATOM 0 HD3 LYS A 84 -9.546 -4.113 -6.537 1.00 25.00 H new ATOM 0 HE2 LYS A 84 -7.322 -5.151 -8.319 1.00 25.00 H new ATOM 0 HE3 LYS A 84 -8.995 -5.143 -8.840 1.00 25.00 H new ATOM 0 HZ1 LYS A 84 -8.037 -3.113 -9.570 1.00 25.00 H new ATOM 0 HZ2 LYS A 84 -9.025 -2.701 -8.251 1.00 25.00 H new ATOM 0 HZ3 LYS A 84 -7.340 -2.791 -8.055 1.00 25.00 H new ATOM 1161 N ILE A 85 -5.053 -3.606 -3.817 1.00 25.00 N ATOM 1162 CA ILE A 85 -4.030 -2.559 -3.872 1.00 25.00 C ATOM 1163 C ILE A 85 -3.786 -2.146 -5.328 1.00 25.00 C ATOM 1164 O ILE A 85 -3.471 -2.982 -6.185 1.00 25.00 O ATOM 1165 CB ILE A 85 -2.690 -3.044 -3.230 1.00 25.00 C ATOM 1166 CG1 ILE A 85 -2.938 -3.577 -1.801 1.00 25.00 C ATOM 1167 CG2 ILE A 85 -1.663 -1.885 -3.191 1.00 25.00 C ATOM 1168 CD1 ILE A 85 -1.719 -4.258 -1.151 1.00 25.00 C ATOM 0 H ILE A 85 -4.793 -4.469 -4.294 1.00 25.00 H new ATOM 0 HA ILE A 85 -4.391 -1.702 -3.303 1.00 25.00 H new ATOM 0 HB ILE A 85 -2.288 -3.852 -3.841 1.00 25.00 H new ATOM 0 HG12 ILE A 85 -3.255 -2.748 -1.168 1.00 25.00 H new ATOM 0 HG13 ILE A 85 -3.763 -4.289 -1.831 1.00 25.00 H new ATOM 0 HG21 ILE A 85 -0.734 -2.237 -2.741 1.00 25.00 H new ATOM 0 HG22 ILE A 85 -1.467 -1.539 -4.206 1.00 25.00 H new ATOM 0 HG23 ILE A 85 -2.064 -1.063 -2.598 1.00 25.00 H new ATOM 0 HD11 ILE A 85 -1.984 -4.601 -0.151 1.00 25.00 H new ATOM 0 HD12 ILE A 85 -1.412 -5.110 -1.757 1.00 25.00 H new ATOM 0 HD13 ILE A 85 -0.897 -3.545 -1.084 1.00 25.00 H new ATOM 1180 N ASP A 86 -3.917 -0.856 -5.608 1.00 25.00 N ATOM 1181 CA ASP A 86 -3.741 -0.336 -6.962 1.00 25.00 C ATOM 1182 C ASP A 86 -2.484 0.527 -7.046 1.00 25.00 C ATOM 1183 O ASP A 86 -2.402 1.591 -6.437 1.00 25.00 O ATOM 1184 CB ASP A 86 -4.959 0.494 -7.384 1.00 25.00 C ATOM 1185 CG ASP A 86 -6.175 -0.361 -7.723 1.00 25.00 C ATOM 1186 OD1 ASP A 86 -6.137 -1.598 -7.556 1.00 25.00 O ATOM 1187 OD2 ASP A 86 -7.155 0.209 -8.248 1.00 25.00 O ATOM 0 H ASP A 86 -4.146 -0.145 -4.913 1.00 25.00 H new ATOM 0 HA ASP A 86 -3.637 -1.185 -7.637 1.00 25.00 H new ATOM 0 HB2 ASP A 86 -5.219 1.182 -6.580 1.00 25.00 H new ATOM 0 HB3 ASP A 86 -4.696 1.101 -8.250 1.00 25.00 H new ATOM 1192 N VAL A 87 -1.511 0.051 -7.817 1.00 25.00 N ATOM 1193 CA VAL A 87 -0.206 0.718 -7.983 1.00 25.00 C ATOM 1194 C VAL A 87 0.124 0.918 -9.471 1.00 25.00 C ATOM 1195 O VAL A 87 1.273 0.828 -9.899 1.00 25.00 O ATOM 1196 CB VAL A 87 0.931 -0.107 -7.291 1.00 25.00 C ATOM 1197 CG1 VAL A 87 0.783 -0.036 -5.770 1.00 25.00 C ATOM 1198 CG2 VAL A 87 0.904 -1.587 -7.745 1.00 25.00 C ATOM 0 H VAL A 87 -1.598 -0.813 -8.351 1.00 25.00 H new ATOM 0 HA VAL A 87 -0.270 1.696 -7.506 1.00 25.00 H new ATOM 0 HB VAL A 87 1.886 0.328 -7.586 1.00 25.00 H new ATOM 0 HG11 VAL A 87 1.579 -0.613 -5.300 1.00 25.00 H new ATOM 0 HG12 VAL A 87 0.848 1.003 -5.446 1.00 25.00 H new ATOM 0 HG13 VAL A 87 -0.184 -0.447 -5.479 1.00 25.00 H new ATOM 0 HG21 VAL A 87 1.705 -2.135 -7.248 1.00 25.00 H new ATOM 0 HG22 VAL A 87 -0.056 -2.031 -7.482 1.00 25.00 H new ATOM 0 HG23 VAL A 87 1.045 -1.639 -8.825 1.00 25.00 H new ATOM 1208 N SER A 88 -0.900 1.206 -10.260 1.00 25.00 N ATOM 1209 CA SER A 88 -0.746 1.378 -11.711 1.00 25.00 C ATOM 1210 C SER A 88 0.200 2.507 -12.137 1.00 25.00 C ATOM 1211 O SER A 88 0.604 2.565 -13.288 1.00 25.00 O ATOM 1212 CB SER A 88 -2.115 1.656 -12.324 1.00 25.00 C ATOM 1213 OG SER A 88 -3.126 1.000 -11.579 1.00 25.00 O ATOM 0 H SER A 88 -1.856 1.328 -9.924 1.00 25.00 H new ATOM 0 HA SER A 88 -0.300 0.450 -12.068 1.00 25.00 H new ATOM 0 HB2 SER A 88 -2.303 2.729 -12.340 1.00 25.00 H new ATOM 0 HB3 SER A 88 -2.135 1.313 -13.359 1.00 25.00 H new ATOM 0 HG SER A 88 -4.001 1.186 -11.980 1.00 25.00 H new ATOM 1219 N ALA A 89 0.538 3.403 -11.218 1.00 25.00 N ATOM 1220 CA ALA A 89 1.426 4.527 -11.524 1.00 25.00 C ATOM 1221 C ALA A 89 2.904 4.126 -11.623 1.00 25.00 C ATOM 1222 O ALA A 89 3.750 4.972 -11.917 1.00 25.00 O ATOM 1223 CB ALA A 89 1.259 5.607 -10.465 1.00 25.00 C ATOM 0 H ALA A 89 0.212 3.376 -10.252 1.00 25.00 H new ATOM 0 HA ALA A 89 1.137 4.900 -12.507 1.00 25.00 H new ATOM 0 HB1 ALA A 89 1.919 6.444 -10.692 1.00 25.00 H new ATOM 0 HB2 ALA A 89 0.225 5.952 -10.457 1.00 25.00 H new ATOM 0 HB3 ALA A 89 1.513 5.199 -9.486 1.00 25.00 H new ATOM 1229 N LEU A 90 3.215 2.870 -11.332 1.00 25.00 N ATOM 1230 CA LEU A 90 4.600 2.392 -11.393 1.00 25.00 C ATOM 1231 C LEU A 90 4.796 1.555 -12.645 1.00 25.00 C ATOM 1232 O LEU A 90 5.524 1.926 -13.560 1.00 25.00 O ATOM 1233 CB LEU A 90 4.948 1.534 -10.155 1.00 25.00 C ATOM 1234 CG LEU A 90 4.521 2.088 -8.799 1.00 25.00 C ATOM 1235 CD1 LEU A 90 4.901 1.110 -7.693 1.00 25.00 C ATOM 1236 CD2 LEU A 90 5.145 3.440 -8.514 1.00 25.00 C ATOM 0 H LEU A 90 2.535 2.163 -11.052 1.00 25.00 H new ATOM 0 HA LEU A 90 5.258 3.261 -11.413 1.00 25.00 H new ATOM 0 HB2 LEU A 90 4.491 0.552 -10.281 1.00 25.00 H new ATOM 0 HB3 LEU A 90 6.027 1.383 -10.137 1.00 25.00 H new ATOM 0 HG LEU A 90 3.439 2.218 -8.827 1.00 25.00 H new ATOM 0 HD11 LEU A 90 4.592 1.514 -6.729 1.00 25.00 H new ATOM 0 HD12 LEU A 90 4.402 0.156 -7.864 1.00 25.00 H new ATOM 0 HD13 LEU A 90 5.981 0.960 -7.695 1.00 25.00 H new ATOM 0 HD21 LEU A 90 4.813 3.796 -7.539 1.00 25.00 H new ATOM 0 HD22 LEU A 90 6.231 3.347 -8.516 1.00 25.00 H new ATOM 0 HD23 LEU A 90 4.840 4.151 -9.282 1.00 25.00 H new ATOM 1248 N GLY A 91 4.136 0.409 -12.647 1.00 25.00 N ATOM 1249 CA GLY A 91 4.349 -0.590 -13.682 1.00 25.00 C ATOM 1250 C GLY A 91 5.551 -1.418 -13.265 1.00 25.00 C ATOM 1251 O GLY A 91 6.325 -0.976 -12.427 1.00 25.00 O ATOM 0 H GLY A 91 3.447 0.147 -11.942 1.00 25.00 H new ATOM 0 HA2 GLY A 91 3.467 -1.221 -13.795 1.00 25.00 H new ATOM 0 HA3 GLY A 91 4.526 -0.114 -14.646 1.00 25.00 H new ATOM 1327 N ASN A 97 12.637 -10.743 -8.339 1.00 25.00 N ATOM 1328 CA ASN A 97 13.833 -10.359 -7.565 1.00 25.00 C ATOM 1329 C ASN A 97 13.555 -9.389 -6.418 1.00 25.00 C ATOM 1330 O ASN A 97 14.305 -9.346 -5.452 1.00 25.00 O ATOM 1331 CB ASN A 97 14.903 -9.724 -8.469 1.00 25.00 C ATOM 1332 CG ASN A 97 15.211 -10.557 -9.684 1.00 25.00 C ATOM 1333 OD1 ASN A 97 15.460 -11.745 -9.595 1.00 25.00 O ATOM 1334 ND2 ASN A 97 15.197 -9.933 -10.832 1.00 25.00 N ATOM 0 HA ASN A 97 14.186 -11.296 -7.135 1.00 25.00 H new ATOM 0 HB2 ASN A 97 14.565 -8.738 -8.787 1.00 25.00 H new ATOM 0 HB3 ASN A 97 15.817 -9.577 -7.894 1.00 25.00 H new ATOM 0 HD21 ASN A 97 15.399 -10.443 -11.692 1.00 25.00 H new ATOM 0 HD22 ASN A 97 14.984 -8.936 -10.868 1.00 25.00 H new ATOM 1341 N GLY A 98 12.525 -8.566 -6.553 1.00 25.00 N ATOM 1342 CA GLY A 98 12.246 -7.538 -5.555 1.00 25.00 C ATOM 1343 C GLY A 98 13.075 -6.295 -5.771 1.00 25.00 C ATOM 1344 O GLY A 98 13.013 -5.343 -4.991 1.00 25.00 O ATOM 0 H GLY A 98 11.872 -8.587 -7.336 1.00 25.00 H new ATOM 0 HA2 GLY A 98 11.188 -7.278 -5.590 1.00 25.00 H new ATOM 0 HA3 GLY A 98 12.444 -7.937 -4.560 1.00 25.00 H new ATOM 1348 N TYR A 99 13.868 -6.326 -6.827 1.00 25.00 N ATOM 1349 CA TYR A 99 14.751 -5.230 -7.193 1.00 25.00 C ATOM 1350 C TYR A 99 14.701 -5.123 -8.704 1.00 25.00 C ATOM 1351 O TYR A 99 14.272 -6.073 -9.367 1.00 25.00 O ATOM 1352 CB TYR A 99 16.183 -5.495 -6.703 1.00 25.00 C ATOM 1353 CG TYR A 99 16.284 -5.599 -5.189 1.00 25.00 C ATOM 1354 CD1 TYR A 99 16.481 -4.450 -4.397 1.00 25.00 C ATOM 1355 CD2 TYR A 99 16.169 -6.844 -4.539 1.00 25.00 C ATOM 1356 CE1 TYR A 99 16.528 -4.538 -2.978 1.00 25.00 C ATOM 1357 CE2 TYR A 99 16.220 -6.938 -3.123 1.00 25.00 C ATOM 1358 CZ TYR A 99 16.391 -5.782 -2.357 1.00 25.00 C ATOM 1359 OH TYR A 99 16.422 -5.879 -0.986 1.00 25.00 O ATOM 0 H TYR A 99 13.918 -7.122 -7.463 1.00 25.00 H new ATOM 0 HA TYR A 99 14.433 -4.297 -6.728 1.00 25.00 H new ATOM 0 HB2 TYR A 99 16.549 -6.419 -7.150 1.00 25.00 H new ATOM 0 HB3 TYR A 99 16.834 -4.693 -7.051 1.00 25.00 H new ATOM 0 HD1 TYR A 99 16.598 -3.488 -4.875 1.00 25.00 H new ATOM 0 HD2 TYR A 99 16.040 -7.741 -5.127 1.00 25.00 H new ATOM 0 HE1 TYR A 99 16.669 -3.647 -2.384 1.00 25.00 H new ATOM 0 HE2 TYR A 99 16.127 -7.899 -2.640 1.00 25.00 H new ATOM 0 HH TYR A 99 16.311 -6.816 -0.722 1.00 25.00 H new ATOM 1369 N ALA A 100 15.136 -3.986 -9.231 1.00 25.00 N ATOM 1370 CA ALA A 100 15.171 -3.721 -10.674 1.00 25.00 C ATOM 1371 C ALA A 100 13.776 -3.809 -11.317 1.00 25.00 C ATOM 1372 O ALA A 100 13.600 -4.373 -12.391 1.00 25.00 O ATOM 1373 CB ALA A 100 16.179 -4.663 -11.378 1.00 25.00 C ATOM 0 H ALA A 100 15.480 -3.209 -8.667 1.00 25.00 H new ATOM 0 HA ALA A 100 15.511 -2.694 -10.809 1.00 25.00 H new ATOM 0 HB1 ALA A 100 16.190 -4.451 -12.447 1.00 25.00 H new ATOM 0 HB2 ALA A 100 17.175 -4.503 -10.966 1.00 25.00 H new ATOM 0 HB3 ALA A 100 15.882 -5.699 -11.217 1.00 25.00 H new ATOM 1379 N GLY A 101 12.784 -3.249 -10.635 1.00 25.00 N ATOM 1380 CA GLY A 101 11.444 -3.173 -11.194 1.00 25.00 C ATOM 1381 C GLY A 101 10.730 -4.504 -11.222 1.00 25.00 C ATOM 1382 O GLY A 101 9.788 -4.699 -11.996 1.00 25.00 O ATOM 0 H GLY A 101 12.882 -2.845 -9.703 1.00 25.00 H new ATOM 0 HA2 GLY A 101 10.855 -2.465 -10.611 1.00 25.00 H new ATOM 0 HA3 GLY A 101 11.503 -2.779 -12.209 1.00 25.00 H new ATOM 1386 N THR A 102 11.173 -5.439 -10.397 1.00 25.00 N ATOM 1387 CA THR A 102 10.544 -6.750 -10.331 1.00 25.00 C ATOM 1388 C THR A 102 10.045 -6.945 -8.919 1.00 25.00 C ATOM 1389 O THR A 102 10.671 -6.476 -7.981 1.00 25.00 O ATOM 1390 CB THR A 102 11.512 -7.893 -10.702 1.00 25.00 C ATOM 1391 OG1 THR A 102 12.474 -8.060 -9.669 1.00 25.00 O ATOM 1392 CG2 THR A 102 12.266 -7.600 -11.988 1.00 25.00 C ATOM 0 H THR A 102 11.964 -5.316 -9.765 1.00 25.00 H new ATOM 0 HA THR A 102 9.730 -6.784 -11.056 1.00 25.00 H new ATOM 0 HB THR A 102 10.911 -8.792 -10.835 1.00 25.00 H new ATOM 0 HG1 THR A 102 13.073 -7.284 -9.651 1.00 25.00 H new ATOM 0 HG21 THR A 102 12.937 -8.429 -12.214 1.00 25.00 H new ATOM 0 HG22 THR A 102 11.556 -7.475 -12.806 1.00 25.00 H new ATOM 0 HG23 THR A 102 12.847 -6.686 -11.869 1.00 25.00 H new ATOM 1400 N LEU A 103 8.905 -7.593 -8.757 1.00 25.00 N ATOM 1401 CA LEU A 103 8.311 -7.742 -7.431 1.00 25.00 C ATOM 1402 C LEU A 103 8.981 -8.810 -6.578 1.00 25.00 C ATOM 1403 O LEU A 103 9.567 -9.753 -7.092 1.00 25.00 O ATOM 1404 CB LEU A 103 6.816 -8.105 -7.532 1.00 25.00 C ATOM 1405 CG LEU A 103 5.787 -7.075 -8.035 1.00 25.00 C ATOM 1406 CD1 LEU A 103 6.025 -5.683 -7.449 1.00 25.00 C ATOM 1407 CD2 LEU A 103 5.752 -7.001 -9.550 1.00 25.00 C ATOM 0 H LEU A 103 8.373 -8.022 -9.515 1.00 25.00 H new ATOM 0 HA LEU A 103 8.453 -6.773 -6.952 1.00 25.00 H new ATOM 0 HB2 LEU A 103 6.741 -8.976 -8.182 1.00 25.00 H new ATOM 0 HB3 LEU A 103 6.495 -8.420 -6.539 1.00 25.00 H new ATOM 0 HG LEU A 103 4.817 -7.427 -7.685 1.00 25.00 H new ATOM 0 HD11 LEU A 103 5.274 -4.993 -7.834 1.00 25.00 H new ATOM 0 HD12 LEU A 103 5.953 -5.729 -6.362 1.00 25.00 H new ATOM 0 HD13 LEU A 103 7.018 -5.334 -7.733 1.00 25.00 H new ATOM 0 HD21 LEU A 103 5.013 -6.263 -9.861 1.00 25.00 H new ATOM 0 HD22 LEU A 103 6.734 -6.711 -9.923 1.00 25.00 H new ATOM 0 HD23 LEU A 103 5.484 -7.976 -9.956 1.00 25.00 H new ATOM 1419 N ALA A 104 8.769 -8.688 -5.274 1.00 25.00 N ATOM 1420 CA ALA A 104 9.004 -9.763 -4.303 1.00 25.00 C ATOM 1421 C ALA A 104 8.156 -9.423 -3.081 1.00 25.00 C ATOM 1422 O ALA A 104 7.753 -8.265 -2.905 1.00 25.00 O ATOM 1423 CB ALA A 104 10.473 -9.876 -3.908 1.00 25.00 C ATOM 0 H ALA A 104 8.423 -7.828 -4.849 1.00 25.00 H new ATOM 0 HA ALA A 104 8.734 -10.725 -4.738 1.00 25.00 H new ATOM 0 HB1 ALA A 104 10.595 -10.685 -3.188 1.00 25.00 H new ATOM 0 HB2 ALA A 104 11.073 -10.085 -4.794 1.00 25.00 H new ATOM 0 HB3 ALA A 104 10.802 -8.939 -3.459 1.00 25.00 H new ATOM 1429 N VAL A 105 7.917 -10.414 -2.234 1.00 25.00 N ATOM 1430 CA VAL A 105 7.143 -10.237 -1.013 1.00 25.00 C ATOM 1431 C VAL A 105 7.949 -10.827 0.147 1.00 25.00 C ATOM 1432 O VAL A 105 8.802 -11.692 -0.057 1.00 25.00 O ATOM 1433 CB VAL A 105 5.742 -10.919 -1.172 1.00 25.00 C ATOM 1434 CG1 VAL A 105 5.854 -12.455 -1.183 1.00 25.00 C ATOM 1435 CG2 VAL A 105 4.764 -10.462 -0.079 1.00 25.00 C ATOM 0 H VAL A 105 8.255 -11.366 -2.374 1.00 25.00 H new ATOM 0 HA VAL A 105 6.960 -9.182 -0.809 1.00 25.00 H new ATOM 0 HB VAL A 105 5.346 -10.602 -2.137 1.00 25.00 H new ATOM 0 HG11 VAL A 105 4.861 -12.891 -1.295 1.00 25.00 H new ATOM 0 HG12 VAL A 105 6.484 -12.768 -2.016 1.00 25.00 H new ATOM 0 HG13 VAL A 105 6.296 -12.794 -0.246 1.00 25.00 H new ATOM 0 HG21 VAL A 105 3.803 -10.956 -0.221 1.00 25.00 H new ATOM 0 HG22 VAL A 105 5.165 -10.724 0.900 1.00 25.00 H new ATOM 0 HG23 VAL A 105 4.630 -9.382 -0.139 1.00 25.00 H new ATOM 1445 N SER A 106 7.721 -10.328 1.351 1.00 25.00 N ATOM 1446 CA SER A 106 8.404 -10.808 2.546 1.00 25.00 C ATOM 1447 C SER A 106 7.436 -10.709 3.715 1.00 25.00 C ATOM 1448 O SER A 106 6.455 -9.976 3.636 1.00 25.00 O ATOM 1449 CB SER A 106 9.640 -9.954 2.822 1.00 25.00 C ATOM 1450 OG SER A 106 10.510 -9.971 1.703 1.00 25.00 O ATOM 0 H SER A 106 7.055 -9.576 1.530 1.00 25.00 H new ATOM 0 HA SER A 106 8.724 -11.840 2.406 1.00 25.00 H new ATOM 0 HB2 SER A 106 9.341 -8.929 3.043 1.00 25.00 H new ATOM 0 HB3 SER A 106 10.161 -10.330 3.702 1.00 25.00 H new ATOM 0 HG SER A 106 11.297 -9.419 1.892 1.00 25.00 H new ATOM 1456 N LEU A 107 7.716 -11.422 4.794 1.00 25.00 N ATOM 1457 CA LEU A 107 6.876 -11.394 5.992 1.00 25.00 C ATOM 1458 C LEU A 107 7.745 -11.050 7.186 1.00 25.00 C ATOM 1459 O LEU A 107 8.964 -11.210 7.142 1.00 25.00 O ATOM 1460 CB LEU A 107 6.219 -12.763 6.226 1.00 25.00 C ATOM 1461 CG LEU A 107 5.124 -13.184 5.230 1.00 25.00 C ATOM 1462 CD1 LEU A 107 4.781 -14.658 5.437 1.00 25.00 C ATOM 1463 CD2 LEU A 107 3.865 -12.341 5.413 1.00 25.00 C ATOM 0 H LEU A 107 8.527 -12.036 4.869 1.00 25.00 H new ATOM 0 HA LEU A 107 6.091 -10.649 5.860 1.00 25.00 H new ATOM 0 HB2 LEU A 107 7.001 -13.522 6.213 1.00 25.00 H new ATOM 0 HB3 LEU A 107 5.788 -12.767 7.227 1.00 25.00 H new ATOM 0 HG LEU A 107 5.502 -13.028 4.220 1.00 25.00 H new ATOM 0 HD11 LEU A 107 4.005 -14.954 4.731 1.00 25.00 H new ATOM 0 HD12 LEU A 107 5.671 -15.265 5.274 1.00 25.00 H new ATOM 0 HD13 LEU A 107 4.421 -14.808 6.455 1.00 25.00 H new ATOM 0 HD21 LEU A 107 3.107 -12.659 4.697 1.00 25.00 H new ATOM 0 HD22 LEU A 107 3.484 -12.471 6.426 1.00 25.00 H new ATOM 0 HD23 LEU A 107 4.103 -11.290 5.247 1.00 25.00 H new ATOM 1534 N ARG A 113 2.874 -9.192 9.785 1.00 25.00 N ATOM 1535 CA ARG A 113 3.147 -8.039 8.927 1.00 25.00 C ATOM 1536 C ARG A 113 3.738 -8.533 7.629 1.00 25.00 C ATOM 1537 O ARG A 113 4.357 -9.599 7.587 1.00 25.00 O ATOM 1538 CB ARG A 113 4.125 -7.075 9.626 1.00 25.00 C ATOM 1539 CG ARG A 113 3.993 -7.094 11.152 1.00 25.00 C ATOM 1540 CD ARG A 113 5.042 -6.311 11.883 1.00 25.00 C ATOM 1541 NE ARG A 113 5.009 -6.716 13.298 1.00 25.00 N ATOM 1542 CZ ARG A 113 4.298 -6.134 14.255 1.00 25.00 C ATOM 1543 NH1 ARG A 113 3.557 -5.075 14.054 1.00 25.00 N ATOM 1544 NH2 ARG A 113 4.334 -6.653 15.447 1.00 25.00 N ATOM 0 HA ARG A 113 2.221 -7.499 8.728 1.00 25.00 H new ATOM 0 HB2 ARG A 113 5.146 -7.339 9.351 1.00 25.00 H new ATOM 0 HB3 ARG A 113 3.950 -6.062 9.264 1.00 25.00 H new ATOM 0 HG2 ARG A 113 3.013 -6.702 11.423 1.00 25.00 H new ATOM 0 HG3 ARG A 113 4.028 -8.129 11.493 1.00 25.00 H new ATOM 0 HD2 ARG A 113 6.026 -6.501 11.455 1.00 25.00 H new ATOM 0 HD3 ARG A 113 4.854 -5.241 11.788 1.00 25.00 H new ATOM 0 HE ARG A 113 5.584 -7.515 13.566 1.00 25.00 H new ATOM 0 HH11 ARG A 113 3.506 -4.657 13.125 1.00 25.00 H new ATOM 0 HH12 ARG A 113 3.030 -4.667 14.826 1.00 25.00 H new ATOM 0 HH21 ARG A 113 4.898 -7.484 15.625 1.00 25.00 H new ATOM 0 HH22 ARG A 113 3.798 -6.229 16.204 1.00 25.00 H new ATOM 1558 N THR A 114 3.547 -7.761 6.577 1.00 25.00 N ATOM 1559 CA THR A 114 3.973 -8.144 5.233 1.00 25.00 C ATOM 1560 C THR A 114 4.689 -6.971 4.588 1.00 25.00 C ATOM 1561 O THR A 114 4.358 -5.822 4.848 1.00 25.00 O ATOM 1562 CB THR A 114 2.739 -8.515 4.379 1.00 25.00 C ATOM 1563 OG1 THR A 114 1.873 -9.359 5.141 1.00 25.00 O ATOM 1564 CG2 THR A 114 3.117 -9.248 3.099 1.00 25.00 C ATOM 0 H THR A 114 3.093 -6.849 6.624 1.00 25.00 H new ATOM 0 HA THR A 114 4.641 -9.003 5.295 1.00 25.00 H new ATOM 0 HB THR A 114 2.245 -7.583 4.105 1.00 25.00 H new ATOM 0 HG1 THR A 114 1.365 -8.816 5.779 1.00 25.00 H new ATOM 0 HG21 THR A 114 2.215 -9.486 2.536 1.00 25.00 H new ATOM 0 HG22 THR A 114 3.766 -8.614 2.495 1.00 25.00 H new ATOM 0 HG23 THR A 114 3.642 -10.170 3.349 1.00 25.00 H new ATOM 1572 N TYR A 115 5.662 -7.251 3.740 1.00 25.00 N ATOM 1573 CA TYR A 115 6.403 -6.208 3.044 1.00 25.00 C ATOM 1574 C TYR A 115 6.459 -6.579 1.574 1.00 25.00 C ATOM 1575 O TYR A 115 6.512 -7.756 1.242 1.00 25.00 O ATOM 1576 CB TYR A 115 7.811 -6.095 3.630 1.00 25.00 C ATOM 1577 CG TYR A 115 7.800 -6.059 5.144 1.00 25.00 C ATOM 1578 CD1 TYR A 115 7.287 -4.943 5.838 1.00 25.00 C ATOM 1579 CD2 TYR A 115 8.276 -7.156 5.896 1.00 25.00 C ATOM 1580 CE1 TYR A 115 7.242 -4.926 7.258 1.00 25.00 C ATOM 1581 CE2 TYR A 115 8.241 -7.137 7.313 1.00 25.00 C ATOM 1582 CZ TYR A 115 7.718 -6.025 7.980 1.00 25.00 C ATOM 1583 OH TYR A 115 7.673 -6.010 9.351 1.00 25.00 O ATOM 0 H TYR A 115 5.961 -8.199 3.514 1.00 25.00 H new ATOM 0 HA TYR A 115 5.914 -5.241 3.162 1.00 25.00 H new ATOM 0 HB2 TYR A 115 8.412 -6.940 3.293 1.00 25.00 H new ATOM 0 HB3 TYR A 115 8.289 -5.192 3.250 1.00 25.00 H new ATOM 0 HD1 TYR A 115 6.924 -4.091 5.283 1.00 25.00 H new ATOM 0 HD2 TYR A 115 8.672 -8.021 5.384 1.00 25.00 H new ATOM 0 HE1 TYR A 115 6.842 -4.068 7.778 1.00 25.00 H new ATOM 0 HE2 TYR A 115 8.617 -7.979 7.876 1.00 25.00 H new ATOM 0 HH TYR A 115 8.041 -6.849 9.700 1.00 25.00 H new ATOM 1593 N LEU A 116 6.413 -5.587 0.702 1.00 25.00 N ATOM 1594 CA LEU A 116 6.443 -5.820 -0.742 1.00 25.00 C ATOM 1595 C LEU A 116 7.526 -4.926 -1.313 1.00 25.00 C ATOM 1596 O LEU A 116 7.712 -3.808 -0.831 1.00 25.00 O ATOM 1597 CB LEU A 116 5.099 -5.465 -1.401 1.00 25.00 C ATOM 1598 CG LEU A 116 3.873 -6.363 -1.131 1.00 25.00 C ATOM 1599 CD1 LEU A 116 3.204 -6.097 0.227 1.00 25.00 C ATOM 1600 CD2 LEU A 116 2.845 -6.129 -2.241 1.00 25.00 C ATOM 0 H LEU A 116 6.354 -4.603 0.966 1.00 25.00 H new ATOM 0 HA LEU A 116 6.636 -6.875 -0.938 1.00 25.00 H new ATOM 0 HB2 LEU A 116 4.839 -4.452 -1.093 1.00 25.00 H new ATOM 0 HB3 LEU A 116 5.258 -5.440 -2.479 1.00 25.00 H new ATOM 0 HG LEU A 116 4.228 -7.393 -1.112 1.00 25.00 H new ATOM 0 HD11 LEU A 116 2.350 -6.764 0.349 1.00 25.00 H new ATOM 0 HD12 LEU A 116 3.922 -6.276 1.028 1.00 25.00 H new ATOM 0 HD13 LEU A 116 2.865 -5.062 0.269 1.00 25.00 H new ATOM 0 HD21 LEU A 116 1.971 -6.756 -2.066 1.00 25.00 H new ATOM 0 HD22 LEU A 116 2.545 -5.081 -2.244 1.00 25.00 H new ATOM 0 HD23 LEU A 116 3.286 -6.383 -3.205 1.00 25.00 H new ATOM 1612 N LYS A 117 8.234 -5.401 -2.328 1.00 25.00 N ATOM 1613 CA LYS A 117 9.311 -4.625 -2.950 1.00 25.00 C ATOM 1614 C LYS A 117 9.195 -4.591 -4.460 1.00 25.00 C ATOM 1615 O LYS A 117 8.584 -5.465 -5.053 1.00 25.00 O ATOM 1616 CB LYS A 117 10.675 -5.231 -2.614 1.00 25.00 C ATOM 1617 CG LYS A 117 11.050 -5.186 -1.153 1.00 25.00 C ATOM 1618 CD LYS A 117 12.565 -5.248 -1.025 1.00 25.00 C ATOM 1619 CE LYS A 117 13.006 -5.091 0.415 1.00 25.00 C ATOM 1620 NZ LYS A 117 14.201 -4.185 0.479 1.00 25.00 N ATOM 0 H LYS A 117 8.086 -6.321 -2.743 1.00 25.00 H new ATOM 0 HA LYS A 117 9.221 -3.613 -2.555 1.00 25.00 H new ATOM 0 HB2 LYS A 117 10.686 -6.270 -2.945 1.00 25.00 H new ATOM 0 HB3 LYS A 117 11.440 -4.706 -3.186 1.00 25.00 H new ATOM 0 HG2 LYS A 117 10.671 -4.272 -0.696 1.00 25.00 H new ATOM 0 HG3 LYS A 117 10.593 -6.021 -0.622 1.00 25.00 H new ATOM 0 HD2 LYS A 117 12.926 -6.200 -1.416 1.00 25.00 H new ATOM 0 HD3 LYS A 117 13.015 -4.463 -1.632 1.00 25.00 H new ATOM 0 HE2 LYS A 117 12.192 -4.679 1.012 1.00 25.00 H new ATOM 0 HE3 LYS A 117 13.252 -6.065 0.839 1.00 25.00 H new ATOM 0 HZ1 LYS A 117 14.534 -4.118 1.462 1.00 25.00 H new ATOM 0 HZ2 LYS A 117 14.960 -4.569 -0.119 1.00 25.00 H new ATOM 0 HZ3 LYS A 117 13.938 -3.238 0.138 1.00 25.00 H new ATOM 1634 N SER A 118 9.858 -3.607 -5.050 1.00 25.00 N ATOM 1635 CA SER A 118 10.041 -3.500 -6.503 1.00 25.00 C ATOM 1636 C SER A 118 11.422 -2.891 -6.743 1.00 25.00 C ATOM 1637 O SER A 118 12.187 -3.352 -7.586 1.00 25.00 O ATOM 1638 CB SER A 118 8.975 -2.607 -7.135 1.00 25.00 C ATOM 1639 OG SER A 118 9.174 -2.504 -8.535 1.00 25.00 O ATOM 0 H SER A 118 10.294 -2.845 -4.530 1.00 25.00 H new ATOM 0 HA SER A 118 9.953 -4.487 -6.957 1.00 25.00 H new ATOM 0 HB2 SER A 118 7.985 -3.015 -6.932 1.00 25.00 H new ATOM 0 HB3 SER A 118 9.010 -1.615 -6.684 1.00 25.00 H new ATOM 0 HG SER A 118 8.481 -1.930 -8.923 1.00 25.00 H new ATOM 1645 N TYR A 119 11.736 -1.886 -5.923 1.00 25.00 N ATOM 1646 CA TYR A 119 13.071 -1.266 -5.852 1.00 25.00 C ATOM 1647 C TYR A 119 13.730 -1.015 -7.225 1.00 25.00 C ATOM 1648 O TYR A 119 14.766 -1.592 -7.571 1.00 25.00 O ATOM 1649 CB TYR A 119 13.957 -2.121 -4.944 1.00 25.00 C ATOM 1650 CG TYR A 119 14.961 -1.353 -4.113 1.00 25.00 C ATOM 1651 CD1 TYR A 119 16.085 -0.732 -4.702 1.00 25.00 C ATOM 1652 CD2 TYR A 119 14.811 -1.272 -2.717 1.00 25.00 C ATOM 1653 CE1 TYR A 119 17.044 -0.054 -3.902 1.00 25.00 C ATOM 1654 CE2 TYR A 119 15.765 -0.597 -1.914 1.00 25.00 C ATOM 1655 CZ TYR A 119 16.875 -0.001 -2.514 1.00 25.00 C ATOM 1656 OH TYR A 119 17.795 0.651 -1.734 1.00 25.00 O ATOM 0 H TYR A 119 11.064 -1.470 -5.278 1.00 25.00 H new ATOM 0 HA TYR A 119 12.949 -0.268 -5.431 1.00 25.00 H new ATOM 0 HB2 TYR A 119 13.316 -2.693 -4.273 1.00 25.00 H new ATOM 0 HB3 TYR A 119 14.495 -2.840 -5.561 1.00 25.00 H new ATOM 0 HD1 TYR A 119 16.217 -0.773 -5.773 1.00 25.00 H new ATOM 0 HD2 TYR A 119 13.954 -1.732 -2.248 1.00 25.00 H new ATOM 0 HE1 TYR A 119 17.899 0.418 -4.363 1.00 25.00 H new ATOM 0 HE2 TYR A 119 15.633 -0.544 -0.843 1.00 25.00 H new ATOM 0 HH TYR A 119 17.526 0.594 -0.793 1.00 25.00 H new ATOM 1758 N SER A 127 13.339 3.513 -4.960 1.00 25.00 N ATOM 1759 CA SER A 127 12.980 2.357 -4.166 1.00 25.00 C ATOM 1760 C SER A 127 11.510 2.364 -3.820 1.00 25.00 C ATOM 1761 O SER A 127 11.070 3.006 -2.875 1.00 25.00 O ATOM 1762 CB SER A 127 13.768 2.295 -2.893 1.00 25.00 C ATOM 1763 OG SER A 127 15.152 2.446 -3.154 1.00 25.00 O ATOM 0 HA SER A 127 13.209 1.482 -4.775 1.00 25.00 H new ATOM 0 HB2 SER A 127 13.433 3.079 -2.214 1.00 25.00 H new ATOM 0 HB3 SER A 127 13.589 1.343 -2.394 1.00 25.00 H new ATOM 0 HG SER A 127 15.610 1.594 -2.995 1.00 25.00 H new ATOM 1769 N PHE A 128 10.755 1.622 -4.590 1.00 25.00 N ATOM 1770 CA PHE A 128 9.325 1.488 -4.364 1.00 25.00 C ATOM 1771 C PHE A 128 9.123 0.245 -3.523 1.00 25.00 C ATOM 1772 O PHE A 128 9.523 -0.856 -3.917 1.00 25.00 O ATOM 1773 CB PHE A 128 8.557 1.378 -5.682 1.00 25.00 C ATOM 1774 CG PHE A 128 8.613 2.629 -6.523 1.00 25.00 C ATOM 1775 CD1 PHE A 128 8.180 3.868 -6.003 1.00 25.00 C ATOM 1776 CD2 PHE A 128 9.078 2.574 -7.847 1.00 25.00 C ATOM 1777 CE1 PHE A 128 8.220 5.043 -6.797 1.00 25.00 C ATOM 1778 CE2 PHE A 128 9.119 3.738 -8.654 1.00 25.00 C ATOM 1779 CZ PHE A 128 8.687 4.975 -8.127 1.00 25.00 C ATOM 0 H PHE A 128 11.105 1.093 -5.389 1.00 25.00 H new ATOM 0 HA PHE A 128 8.941 2.372 -3.854 1.00 25.00 H new ATOM 0 HB2 PHE A 128 8.960 0.545 -6.258 1.00 25.00 H new ATOM 0 HB3 PHE A 128 7.515 1.142 -5.466 1.00 25.00 H new ATOM 0 HD1 PHE A 128 7.814 3.922 -4.988 1.00 25.00 H new ATOM 0 HD2 PHE A 128 9.409 1.631 -8.256 1.00 25.00 H new ATOM 0 HE1 PHE A 128 7.894 5.987 -6.385 1.00 25.00 H new ATOM 0 HE2 PHE A 128 9.480 3.679 -9.670 1.00 25.00 H new ATOM 0 HZ PHE A 128 8.714 5.865 -8.739 1.00 25.00 H new ATOM 1789 N GLU A 129 8.554 0.439 -2.343 1.00 25.00 N ATOM 1790 CA GLU A 129 8.276 -0.647 -1.413 1.00 25.00 C ATOM 1791 C GLU A 129 6.995 -0.305 -0.665 1.00 25.00 C ATOM 1792 O GLU A 129 6.679 0.875 -0.469 1.00 25.00 O ATOM 1793 CB GLU A 129 9.401 -0.826 -0.384 1.00 25.00 C ATOM 1794 CG GLU A 129 10.749 -1.280 -0.960 1.00 25.00 C ATOM 1795 CD GLU A 129 11.722 -1.742 0.123 1.00 25.00 C ATOM 1796 OE1 GLU A 129 11.267 -2.183 1.202 1.00 25.00 O ATOM 1797 OE2 GLU A 129 12.944 -1.647 -0.083 1.00 25.00 O ATOM 0 H GLU A 129 8.271 1.357 -2.001 1.00 25.00 H new ATOM 0 HA GLU A 129 8.187 -1.573 -1.981 1.00 25.00 H new ATOM 0 HB2 GLU A 129 9.547 0.119 0.138 1.00 25.00 H new ATOM 0 HB3 GLU A 129 9.078 -1.554 0.360 1.00 25.00 H new ATOM 0 HG2 GLU A 129 10.583 -2.094 -1.666 1.00 25.00 H new ATOM 0 HG3 GLU A 129 11.197 -0.459 -1.520 1.00 25.00 H new ATOM 1804 N LEU A 130 6.288 -1.331 -0.217 1.00 25.00 N ATOM 1805 CA LEU A 130 5.053 -1.175 0.544 1.00 25.00 C ATOM 1806 C LEU A 130 5.159 -2.004 1.808 1.00 25.00 C ATOM 1807 O LEU A 130 5.960 -2.940 1.873 1.00 25.00 O ATOM 1808 CB LEU A 130 3.859 -1.672 -0.280 1.00 25.00 C ATOM 1809 CG LEU A 130 2.902 -0.587 -0.784 1.00 25.00 C ATOM 1810 CD1 LEU A 130 1.908 -1.204 -1.759 1.00 25.00 C ATOM 1811 CD2 LEU A 130 2.142 0.087 0.373 1.00 25.00 C ATOM 0 H LEU A 130 6.555 -2.303 -0.371 1.00 25.00 H new ATOM 0 HA LEU A 130 4.905 -0.123 0.786 1.00 25.00 H new ATOM 0 HB2 LEU A 130 4.239 -2.223 -1.140 1.00 25.00 H new ATOM 0 HB3 LEU A 130 3.292 -2.378 0.326 1.00 25.00 H new ATOM 0 HG LEU A 130 3.494 0.180 -1.284 1.00 25.00 H new ATOM 0 HD11 LEU A 130 1.226 -0.434 -2.119 1.00 25.00 H new ATOM 0 HD12 LEU A 130 2.446 -1.636 -2.603 1.00 25.00 H new ATOM 0 HD13 LEU A 130 1.340 -1.985 -1.254 1.00 25.00 H new ATOM 0 HD21 LEU A 130 1.474 0.850 -0.026 1.00 25.00 H new ATOM 0 HD22 LEU A 130 1.559 -0.661 0.910 1.00 25.00 H new ATOM 0 HD23 LEU A 130 2.855 0.550 1.056 1.00 25.00 H new ATOM 1823 N ALA A 131 4.336 -1.686 2.793 1.00 25.00 N ATOM 1824 CA ALA A 131 4.274 -2.453 4.022 1.00 25.00 C ATOM 1825 C ALA A 131 2.804 -2.640 4.370 1.00 25.00 C ATOM 1826 O ALA A 131 1.977 -1.778 4.087 1.00 25.00 O ATOM 1827 CB ALA A 131 5.010 -1.715 5.144 1.00 25.00 C ATOM 0 H ALA A 131 3.696 -0.893 2.762 1.00 25.00 H new ATOM 0 HA ALA A 131 4.757 -3.422 3.898 1.00 25.00 H new ATOM 0 HB1 ALA A 131 4.956 -2.301 6.061 1.00 25.00 H new ATOM 0 HB2 ALA A 131 6.054 -1.575 4.864 1.00 25.00 H new ATOM 0 HB3 ALA A 131 4.544 -0.743 5.307 1.00 25.00 H new ATOM 1833 N LEU A 132 2.495 -3.758 4.992 1.00 25.00 N ATOM 1834 CA LEU A 132 1.157 -4.058 5.460 1.00 25.00 C ATOM 1835 C LEU A 132 1.390 -4.515 6.895 1.00 25.00 C ATOM 1836 O LEU A 132 2.432 -5.107 7.180 1.00 25.00 O ATOM 1837 CB LEU A 132 0.521 -5.192 4.634 1.00 25.00 C ATOM 1838 CG LEU A 132 0.587 -5.190 3.095 1.00 25.00 C ATOM 1839 CD1 LEU A 132 -0.063 -6.475 2.564 1.00 25.00 C ATOM 1840 CD2 LEU A 132 -0.112 -4.011 2.467 1.00 25.00 C ATOM 0 H LEU A 132 3.174 -4.493 5.190 1.00 25.00 H new ATOM 0 HA LEU A 132 0.478 -3.210 5.376 1.00 25.00 H new ATOM 0 HB2 LEU A 132 0.974 -6.124 4.971 1.00 25.00 H new ATOM 0 HB3 LEU A 132 -0.533 -5.233 4.908 1.00 25.00 H new ATOM 0 HG LEU A 132 1.642 -5.126 2.827 1.00 25.00 H new ATOM 0 HD11 LEU A 132 -0.020 -6.481 1.475 1.00 25.00 H new ATOM 0 HD12 LEU A 132 0.472 -7.341 2.953 1.00 25.00 H new ATOM 0 HD13 LEU A 132 -1.103 -6.517 2.886 1.00 25.00 H new ATOM 0 HD21 LEU A 132 -0.026 -4.073 1.382 1.00 25.00 H new ATOM 0 HD22 LEU A 132 -1.165 -4.020 2.749 1.00 25.00 H new ATOM 0 HD23 LEU A 132 0.349 -3.087 2.815 1.00 25.00 H new ATOM 1852 N ASP A 133 0.462 -4.241 7.796 1.00 25.00 N ATOM 1853 CA ASP A 133 0.600 -4.664 9.195 1.00 25.00 C ATOM 1854 C ASP A 133 -0.795 -5.039 9.700 1.00 25.00 C ATOM 1855 O ASP A 133 -1.790 -4.588 9.136 1.00 25.00 O ATOM 1856 CB ASP A 133 1.227 -3.532 10.027 1.00 25.00 C ATOM 1857 CG ASP A 133 1.964 -4.042 11.258 1.00 25.00 C ATOM 1858 OD1 ASP A 133 1.426 -4.901 11.979 1.00 25.00 O ATOM 1859 OD2 ASP A 133 3.094 -3.569 11.516 1.00 25.00 O ATOM 0 H ASP A 133 -0.396 -3.729 7.593 1.00 25.00 H new ATOM 0 HA ASP A 133 1.262 -5.526 9.286 1.00 25.00 H new ATOM 0 HB2 ASP A 133 1.920 -2.969 9.402 1.00 25.00 H new ATOM 0 HB3 ASP A 133 0.444 -2.840 10.339 1.00 25.00 H new ATOM 1864 N GLY A 134 -0.876 -5.900 10.706 1.00 25.00 N ATOM 1865 CA GLY A 134 -2.168 -6.385 11.177 1.00 25.00 C ATOM 1866 C GLY A 134 -2.812 -7.244 10.106 1.00 25.00 C ATOM 1867 O GLY A 134 -3.958 -7.026 9.714 1.00 25.00 O ATOM 0 H GLY A 134 -0.071 -6.274 11.208 1.00 25.00 H new ATOM 0 HA2 GLY A 134 -2.039 -6.963 12.092 1.00 25.00 H new ATOM 0 HA3 GLY A 134 -2.816 -5.543 11.421 1.00 25.00 H new ATOM 1871 N ASN A 135 -2.032 -8.159 9.548 1.00 25.00 N ATOM 1872 CA ASN A 135 -2.466 -8.910 8.375 1.00 25.00 C ATOM 1873 C ASN A 135 -2.971 -10.312 8.653 1.00 25.00 C ATOM 1874 O ASN A 135 -2.425 -11.044 9.472 1.00 25.00 O ATOM 1875 CB ASN A 135 -1.301 -9.040 7.392 1.00 25.00 C ATOM 1876 CG ASN A 135 -0.731 -7.720 6.998 1.00 25.00 C ATOM 1877 OD1 ASN A 135 0.470 -7.579 6.876 1.00 25.00 O ATOM 1878 ND2 ASN A 135 -1.576 -6.748 6.787 1.00 25.00 N ATOM 0 H ASN A 135 -1.100 -8.400 9.885 1.00 25.00 H new ATOM 0 HA ASN A 135 -3.304 -8.338 7.977 1.00 25.00 H new ATOM 0 HB2 ASN A 135 -0.518 -9.650 7.842 1.00 25.00 H new ATOM 0 HB3 ASN A 135 -1.641 -9.565 6.500 1.00 25.00 H new ATOM 0 HD21 ASN A 135 -1.236 -5.828 6.508 1.00 25.00 H new ATOM 0 HD22 ASN A 135 -2.577 -6.909 6.901 1.00 25.00 H new ATOM 1885 N HIS A 136 -3.915 -10.728 7.825 1.00 25.00 N ATOM 1886 CA HIS A 136 -4.387 -12.110 7.772 1.00 25.00 C ATOM 1887 C HIS A 136 -3.437 -12.928 6.894 1.00 25.00 C ATOM 1888 O HIS A 136 -3.867 -13.669 6.018 1.00 25.00 O ATOM 1889 CB HIS A 136 -5.799 -12.136 7.188 1.00 25.00 C ATOM 1890 CG HIS A 136 -6.794 -11.353 7.988 1.00 25.00 C ATOM 1891 ND1 HIS A 136 -7.174 -10.061 7.714 1.00 25.00 N ATOM 1892 CD2 HIS A 136 -7.517 -11.706 9.086 1.00 25.00 C ATOM 1893 CE1 HIS A 136 -8.082 -9.695 8.614 1.00 25.00 C ATOM 1894 NE2 HIS A 136 -8.323 -10.659 9.480 1.00 25.00 N ATOM 0 H HIS A 136 -4.383 -10.111 7.161 1.00 25.00 H new ATOM 0 HA HIS A 136 -4.409 -12.539 8.774 1.00 25.00 H new ATOM 0 HB2 HIS A 136 -5.770 -11.741 6.173 1.00 25.00 H new ATOM 0 HB3 HIS A 136 -6.135 -13.171 7.118 1.00 25.00 H new ATOM 0 HD1 HIS A 136 -6.821 -9.483 6.952 1.00 25.00 H new ATOM 0 HD2 HIS A 136 -7.467 -12.667 9.577 1.00 25.00 H new ATOM 0 HE1 HIS A 136 -8.562 -8.728 8.633 1.00 25.00 H new ATOM 1902 N ALA A 137 -2.138 -12.766 7.122 1.00 25.00 N ATOM 1903 CA ALA A 137 -1.111 -13.424 6.315 1.00 25.00 C ATOM 1904 C ALA A 137 -1.225 -14.950 6.401 1.00 25.00 C ATOM 1905 O ALA A 137 -0.919 -15.656 5.449 1.00 25.00 O ATOM 1906 CB ALA A 137 0.277 -12.966 6.772 1.00 25.00 C ATOM 0 H ALA A 137 -1.766 -12.178 7.868 1.00 25.00 H new ATOM 0 HA ALA A 137 -1.260 -13.140 5.273 1.00 25.00 H new ATOM 0 HB1 ALA A 137 1.040 -13.458 6.169 1.00 25.00 H new ATOM 0 HB2 ALA A 137 0.361 -11.886 6.653 1.00 25.00 H new ATOM 0 HB3 ALA A 137 0.419 -13.227 7.821 1.00 25.00 H new ATOM 1912 N ALA A 138 -1.710 -15.441 7.532 1.00 25.00 N ATOM 1913 CA ALA A 138 -1.904 -16.875 7.733 1.00 25.00 C ATOM 1914 C ALA A 138 -2.920 -17.460 6.738 1.00 25.00 C ATOM 1915 O ALA A 138 -2.915 -18.658 6.476 1.00 25.00 O ATOM 1916 CB ALA A 138 -2.364 -17.134 9.175 1.00 25.00 C ATOM 0 H ALA A 138 -1.979 -14.866 8.331 1.00 25.00 H new ATOM 0 HA ALA A 138 -0.951 -17.373 7.555 1.00 25.00 H new ATOM 0 HB1 ALA A 138 -2.509 -18.204 9.324 1.00 25.00 H new ATOM 0 HB2 ALA A 138 -1.607 -16.770 9.869 1.00 25.00 H new ATOM 0 HB3 ALA A 138 -3.304 -16.612 9.356 1.00 25.00 H new ATOM 1922 N THR A 139 -3.793 -16.613 6.207 1.00 25.00 N ATOM 1923 CA THR A 139 -4.828 -17.046 5.264 1.00 25.00 C ATOM 1924 C THR A 139 -4.802 -16.201 3.989 1.00 25.00 C ATOM 1925 O THR A 139 -5.844 -15.966 3.384 1.00 25.00 O ATOM 1926 CB THR A 139 -6.232 -16.916 5.907 1.00 25.00 C ATOM 1927 OG1 THR A 139 -6.442 -15.562 6.314 1.00 25.00 O ATOM 1928 CG2 THR A 139 -6.359 -17.800 7.141 1.00 25.00 C ATOM 0 H THR A 139 -3.808 -15.614 6.413 1.00 25.00 H new ATOM 0 HA THR A 139 -4.624 -18.087 5.013 1.00 25.00 H new ATOM 0 HB THR A 139 -6.969 -17.225 5.166 1.00 25.00 H new ATOM 0 HG1 THR A 139 -7.330 -15.476 6.720 1.00 25.00 H new ATOM 0 HG21 THR A 139 -7.355 -17.686 7.569 1.00 25.00 H new ATOM 0 HG22 THR A 139 -6.201 -18.841 6.860 1.00 25.00 H new ATOM 0 HG23 THR A 139 -5.612 -17.506 7.878 1.00 25.00 H new ATOM 1936 N LEU A 140 -3.631 -15.694 3.617 1.00 25.00 N ATOM 1937 CA LEU A 140 -3.514 -14.795 2.459 1.00 25.00 C ATOM 1938 C LEU A 140 -3.907 -15.469 1.141 1.00 25.00 C ATOM 1939 O LEU A 140 -3.910 -16.693 1.026 1.00 25.00 O ATOM 1940 CB LEU A 140 -2.087 -14.212 2.367 1.00 25.00 C ATOM 1941 CG LEU A 140 -0.897 -15.131 2.010 1.00 25.00 C ATOM 1942 CD1 LEU A 140 -0.747 -15.388 0.499 1.00 25.00 C ATOM 1943 CD2 LEU A 140 0.397 -14.478 2.519 1.00 25.00 C ATOM 0 H LEU A 140 -2.750 -15.885 4.094 1.00 25.00 H new ATOM 0 HA LEU A 140 -4.223 -13.983 2.619 1.00 25.00 H new ATOM 0 HB2 LEU A 140 -2.111 -13.412 1.628 1.00 25.00 H new ATOM 0 HB3 LEU A 140 -1.863 -13.751 3.329 1.00 25.00 H new ATOM 0 HG LEU A 140 -1.089 -16.094 2.483 1.00 25.00 H new ATOM 0 HD11 LEU A 140 0.108 -16.041 0.324 1.00 25.00 H new ATOM 0 HD12 LEU A 140 -1.651 -15.865 0.120 1.00 25.00 H new ATOM 0 HD13 LEU A 140 -0.592 -14.441 -0.018 1.00 25.00 H new ATOM 0 HD21 LEU A 140 1.247 -15.115 2.274 1.00 25.00 H new ATOM 0 HD22 LEU A 140 0.525 -13.505 2.044 1.00 25.00 H new ATOM 0 HD23 LEU A 140 0.339 -14.350 3.600 1.00 25.00 H new ATOM 1955 N SER A 141 -4.198 -14.650 0.140 1.00 25.00 N ATOM 1956 CA SER A 141 -4.537 -15.132 -1.196 1.00 25.00 C ATOM 1957 C SER A 141 -3.945 -14.177 -2.231 1.00 25.00 C ATOM 1958 O SER A 141 -3.569 -13.047 -1.903 1.00 25.00 O ATOM 1959 CB SER A 141 -6.056 -15.219 -1.360 1.00 25.00 C ATOM 1960 OG SER A 141 -6.402 -15.891 -2.561 1.00 25.00 O ATOM 0 H SER A 141 -4.206 -13.634 0.229 1.00 25.00 H new ATOM 0 HA SER A 141 -4.123 -16.130 -1.341 1.00 25.00 H new ATOM 0 HB2 SER A 141 -6.487 -15.745 -0.508 1.00 25.00 H new ATOM 0 HB3 SER A 141 -6.483 -14.216 -1.365 1.00 25.00 H new ATOM 0 HG SER A 141 -7.378 -15.935 -2.642 1.00 25.00 H new ATOM 1966 N ALA A 142 -3.832 -14.644 -3.466 1.00 25.00 N ATOM 1967 CA ALA A 142 -3.251 -13.863 -4.555 1.00 25.00 C ATOM 1968 C ALA A 142 -4.346 -13.124 -5.338 1.00 25.00 C ATOM 1969 O ALA A 142 -5.527 -13.398 -5.181 1.00 25.00 O ATOM 1970 CB ALA A 142 -2.467 -14.802 -5.496 1.00 25.00 C ATOM 0 H ALA A 142 -4.140 -15.576 -3.744 1.00 25.00 H new ATOM 0 HA ALA A 142 -2.574 -13.119 -4.135 1.00 25.00 H new ATOM 0 HB1 ALA A 142 -2.032 -14.222 -6.310 1.00 25.00 H new ATOM 0 HB2 ALA A 142 -1.672 -15.296 -4.937 1.00 25.00 H new ATOM 0 HB3 ALA A 142 -3.142 -15.553 -5.906 1.00 25.00 H new ATOM 1976 N GLY A 143 -3.931 -12.226 -6.224 1.00 25.00 N ATOM 1977 CA GLY A 143 -4.867 -11.549 -7.116 1.00 25.00 C ATOM 1978 C GLY A 143 -5.430 -10.236 -6.603 1.00 25.00 C ATOM 1979 O GLY A 143 -6.131 -9.545 -7.334 1.00 25.00 O ATOM 0 H GLY A 143 -2.956 -11.950 -6.344 1.00 25.00 H new ATOM 0 HA2 GLY A 143 -4.365 -11.362 -8.066 1.00 25.00 H new ATOM 0 HA3 GLY A 143 -5.698 -12.224 -7.322 1.00 25.00 H new ATOM 1983 N ASN A 144 -5.090 -9.867 -5.374 1.00 25.00 N ATOM 1984 CA ASN A 144 -5.573 -8.623 -4.745 1.00 25.00 C ATOM 1985 C ASN A 144 -4.864 -7.353 -5.265 1.00 25.00 C ATOM 1986 O ASN A 144 -4.523 -6.455 -4.494 1.00 25.00 O ATOM 1987 CB ASN A 144 -5.371 -8.725 -3.229 1.00 25.00 C ATOM 1988 CG ASN A 144 -6.199 -9.818 -2.604 1.00 25.00 C ATOM 1989 OD1 ASN A 144 -7.392 -9.923 -2.828 1.00 25.00 O ATOM 1990 ND2 ASN A 144 -5.560 -10.653 -1.840 1.00 25.00 N ATOM 0 H ASN A 144 -4.471 -10.416 -4.777 1.00 25.00 H new ATOM 0 HA ASN A 144 -6.627 -8.522 -5.004 1.00 25.00 H new ATOM 0 HB2 ASN A 144 -4.317 -8.908 -3.019 1.00 25.00 H new ATOM 0 HB3 ASN A 144 -5.628 -7.771 -2.767 1.00 25.00 H new ATOM 0 HD21 ASN A 144 -6.058 -11.429 -1.404 1.00 25.00 H new ATOM 0 HD22 ASN A 144 -4.561 -10.532 -1.676 1.00 25.00 H new ATOM 1997 N ILE A 145 -4.615 -7.293 -6.565 1.00 25.00 N ATOM 1998 CA ILE A 145 -3.902 -6.174 -7.180 1.00 25.00 C ATOM 1999 C ILE A 145 -4.570 -5.749 -8.486 1.00 25.00 C ATOM 2000 O ILE A 145 -5.338 -6.500 -9.080 1.00 25.00 O ATOM 2001 CB ILE A 145 -2.381 -6.503 -7.445 1.00 25.00 C ATOM 2002 CG1 ILE A 145 -2.129 -8.005 -7.736 1.00 25.00 C ATOM 2003 CG2 ILE A 145 -1.537 -6.096 -6.220 1.00 25.00 C ATOM 2004 CD1 ILE A 145 -2.681 -8.517 -9.067 1.00 25.00 C ATOM 0 H ILE A 145 -4.900 -8.016 -7.226 1.00 25.00 H new ATOM 0 HA ILE A 145 -3.948 -5.351 -6.467 1.00 25.00 H new ATOM 0 HB ILE A 145 -2.091 -5.936 -8.330 1.00 25.00 H new ATOM 0 HG12 ILE A 145 -1.054 -8.187 -7.714 1.00 25.00 H new ATOM 0 HG13 ILE A 145 -2.568 -8.593 -6.930 1.00 25.00 H new ATOM 0 HG21 ILE A 145 -0.488 -6.325 -6.408 1.00 25.00 H new ATOM 0 HG22 ILE A 145 -1.648 -5.027 -6.041 1.00 25.00 H new ATOM 0 HG23 ILE A 145 -1.877 -6.648 -5.344 1.00 25.00 H new ATOM 0 HD11 ILE A 145 -2.451 -9.577 -9.172 1.00 25.00 H new ATOM 0 HD12 ILE A 145 -3.762 -8.376 -9.091 1.00 25.00 H new ATOM 0 HD13 ILE A 145 -2.224 -7.964 -9.887 1.00 25.00 H new ATOM 2016 N VAL A 146 -4.279 -4.530 -8.919 1.00 25.00 N ATOM 2017 CA VAL A 146 -4.901 -3.938 -10.113 1.00 25.00 C ATOM 2018 C VAL A 146 -4.673 -4.715 -11.421 1.00 25.00 C ATOM 2019 O VAL A 146 -5.449 -4.590 -12.360 1.00 25.00 O ATOM 2020 CB VAL A 146 -4.411 -2.453 -10.279 1.00 25.00 C ATOM 2021 CG1 VAL A 146 -2.946 -2.383 -10.756 1.00 25.00 C ATOM 2022 CG2 VAL A 146 -5.333 -1.655 -11.208 1.00 25.00 C ATOM 0 H VAL A 146 -3.606 -3.917 -8.458 1.00 25.00 H new ATOM 0 HA VAL A 146 -5.976 -3.983 -9.938 1.00 25.00 H new ATOM 0 HB VAL A 146 -4.456 -1.992 -9.292 1.00 25.00 H new ATOM 0 HG11 VAL A 146 -2.646 -1.340 -10.858 1.00 25.00 H new ATOM 0 HG12 VAL A 146 -2.302 -2.876 -10.028 1.00 25.00 H new ATOM 0 HG13 VAL A 146 -2.853 -2.883 -11.720 1.00 25.00 H new ATOM 0 HG21 VAL A 146 -4.963 -0.634 -11.299 1.00 25.00 H new ATOM 0 HG22 VAL A 146 -5.351 -2.123 -12.192 1.00 25.00 H new ATOM 0 HG23 VAL A 146 -6.341 -1.640 -10.795 1.00 25.00 H new ATOM 2032 N PHE A 147 -3.607 -5.497 -11.488 1.00 25.00 N ATOM 2033 CA PHE A 147 -3.240 -6.176 -12.730 1.00 25.00 C ATOM 2034 C PHE A 147 -4.035 -7.451 -12.987 1.00 25.00 C ATOM 2035 O PHE A 147 -4.143 -7.893 -14.128 1.00 25.00 O ATOM 2036 CB PHE A 147 -1.750 -6.519 -12.685 1.00 25.00 C ATOM 2037 CG PHE A 147 -0.885 -5.357 -12.284 1.00 25.00 C ATOM 2038 CD1 PHE A 147 -0.575 -4.340 -13.207 1.00 25.00 C ATOM 2039 CD2 PHE A 147 -0.386 -5.262 -10.970 1.00 25.00 C ATOM 2040 CE1 PHE A 147 0.224 -3.232 -12.825 1.00 25.00 C ATOM 2041 CE2 PHE A 147 0.402 -4.161 -10.574 1.00 25.00 C ATOM 2042 CZ PHE A 147 0.708 -3.140 -11.504 1.00 25.00 C ATOM 0 H PHE A 147 -2.981 -5.679 -10.704 1.00 25.00 H new ATOM 0 HA PHE A 147 -3.472 -5.491 -13.546 1.00 25.00 H new ATOM 0 HB2 PHE A 147 -1.594 -7.339 -11.984 1.00 25.00 H new ATOM 0 HB3 PHE A 147 -1.436 -6.875 -13.666 1.00 25.00 H new ATOM 0 HD1 PHE A 147 -0.950 -4.404 -14.218 1.00 25.00 H new ATOM 0 HD2 PHE A 147 -0.610 -6.042 -10.257 1.00 25.00 H new ATOM 0 HE1 PHE A 147 0.461 -2.461 -13.544 1.00 25.00 H new ATOM 0 HE2 PHE A 147 0.772 -4.098 -9.561 1.00 25.00 H new ATOM 0 HZ PHE A 147 1.309 -2.295 -11.204 1.00 25.00 H new