USER MOD reduce.3.24.130724 H: found=0, std=0, add=533, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 530 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 Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 HIS :FLIP no HE2:sc= 0.217 F(o=-1.6!,f=0.22) USER MOD Single : A 9 GLN : amide:sc= -3.33! C(o=-3.3!,f=-5.2!) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 LYS NZ :NH3+ -159:sc= -0.061 (180deg=-0.34) USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot 180:sc= 0.0481 USER MOD Single : A 27 MET CE :methyl -118:sc= -0.466 (180deg=-1.1) USER MOD Single : A 29 ASN : amide:sc= 0.301 K(o=0.3,f=-0.75) USER MOD Single : A 30 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 ASN : amide:sc= -0.0864 K(o=-0.086,f=-1.3) USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 GLN : amide:sc= 0.197 X(o=0.2,f=0) USER MOD Single : A 58 THR OG1 : rot 73:sc= 0.293 USER MOD Single : A 65 SER OG : rot 22:sc= 1.09 USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -14.292 -10.663 20.407 1.00 0.00 N ATOM 2 CA GLY A 1 -13.448 -9.614 20.949 1.00 0.00 C ATOM 3 C GLY A 1 -12.594 -8.951 19.888 1.00 0.00 C ATOM 4 O GLY A 1 -11.829 -9.618 19.191 1.00 0.00 O ATOM 0 H1 GLY A 1 -14.856 -11.085 21.172 1.00 0.00 H new ATOM 0 H2 GLY A 1 -14.928 -10.261 19.689 1.00 0.00 H new ATOM 0 H3 GLY A 1 -13.697 -11.396 19.971 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -14.073 -8.862 21.430 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -12.803 -10.034 21.721 1.00 0.00 H new ATOM 8 N SER A 2 -12.723 -7.634 19.763 1.00 0.00 N ATOM 9 CA SER A 2 -11.960 -6.881 18.776 1.00 0.00 C ATOM 10 C SER A 2 -11.511 -5.539 19.344 1.00 0.00 C ATOM 11 O SER A 2 -12.226 -4.913 20.128 1.00 0.00 O ATOM 12 CB SER A 2 -12.797 -6.659 17.514 1.00 0.00 C ATOM 13 OG SER A 2 -13.126 -7.891 16.897 1.00 0.00 O ATOM 0 H SER A 2 -13.349 -7.066 20.334 1.00 0.00 H new ATOM 0 HA SER A 2 -11.074 -7.461 18.519 1.00 0.00 H new ATOM 0 HB2 SER A 2 -13.710 -6.121 17.769 1.00 0.00 H new ATOM 0 HB3 SER A 2 -12.244 -6.034 16.813 1.00 0.00 H new ATOM 0 HG SER A 2 -13.662 -7.722 16.094 1.00 0.00 H new ATOM 19 N SER A 3 -10.321 -5.102 18.944 1.00 0.00 N ATOM 20 CA SER A 3 -9.773 -3.835 19.416 1.00 0.00 C ATOM 21 C SER A 3 -9.272 -2.991 18.247 1.00 0.00 C ATOM 22 O SER A 3 -9.037 -3.503 17.154 1.00 0.00 O ATOM 23 CB SER A 3 -8.634 -4.085 20.406 1.00 0.00 C ATOM 24 OG SER A 3 -8.394 -2.941 21.206 1.00 0.00 O ATOM 0 H SER A 3 -9.718 -5.606 18.294 1.00 0.00 H new ATOM 0 HA SER A 3 -10.569 -3.288 19.921 1.00 0.00 H new ATOM 0 HB2 SER A 3 -8.882 -4.933 21.044 1.00 0.00 H new ATOM 0 HB3 SER A 3 -7.727 -4.349 19.862 1.00 0.00 H new ATOM 0 HG SER A 3 -7.663 -3.127 21.832 1.00 0.00 H new ATOM 30 N GLY A 4 -9.110 -1.693 18.490 1.00 0.00 N ATOM 31 CA GLY A 4 -8.637 -0.798 17.449 1.00 0.00 C ATOM 32 C GLY A 4 -7.333 -0.118 17.818 1.00 0.00 C ATOM 33 O GLY A 4 -7.309 1.078 18.106 1.00 0.00 O ATOM 0 H GLY A 4 -9.298 -1.246 19.388 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -8.501 -1.360 16.525 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -9.396 -0.040 17.253 1.00 0.00 H new ATOM 37 N SER A 5 -6.247 -0.884 17.811 1.00 0.00 N ATOM 38 CA SER A 5 -4.934 -0.350 18.152 1.00 0.00 C ATOM 39 C SER A 5 -4.179 0.079 16.897 1.00 0.00 C ATOM 40 O SER A 5 -3.666 -0.756 16.152 1.00 0.00 O ATOM 41 CB SER A 5 -4.119 -1.392 18.920 1.00 0.00 C ATOM 42 OG SER A 5 -4.603 -1.545 20.242 1.00 0.00 O ATOM 0 H SER A 5 -6.250 -1.876 17.573 1.00 0.00 H new ATOM 0 HA SER A 5 -5.079 0.525 18.785 1.00 0.00 H new ATOM 0 HB2 SER A 5 -4.164 -2.349 18.400 1.00 0.00 H new ATOM 0 HB3 SER A 5 -3.071 -1.092 18.945 1.00 0.00 H new ATOM 0 HG SER A 5 -4.066 -2.218 20.711 1.00 0.00 H new ATOM 48 N SER A 6 -4.115 1.388 16.671 1.00 0.00 N ATOM 49 CA SER A 6 -3.427 1.929 15.505 1.00 0.00 C ATOM 50 C SER A 6 -1.946 2.148 15.801 1.00 0.00 C ATOM 51 O SER A 6 -1.563 3.154 16.395 1.00 0.00 O ATOM 52 CB SER A 6 -4.072 3.247 15.071 1.00 0.00 C ATOM 53 OG SER A 6 -3.651 3.616 13.770 1.00 0.00 O ATOM 0 H SER A 6 -4.531 2.093 17.280 1.00 0.00 H new ATOM 0 HA SER A 6 -3.515 1.206 14.694 1.00 0.00 H new ATOM 0 HB2 SER A 6 -5.157 3.148 15.091 1.00 0.00 H new ATOM 0 HB3 SER A 6 -3.810 4.034 15.778 1.00 0.00 H new ATOM 0 HG SER A 6 -4.078 4.460 13.515 1.00 0.00 H new ATOM 59 N GLY A 7 -1.118 1.196 15.383 1.00 0.00 N ATOM 60 CA GLY A 7 0.311 1.302 15.612 1.00 0.00 C ATOM 61 C GLY A 7 1.124 0.624 14.528 1.00 0.00 C ATOM 62 O GLY A 7 1.462 -0.554 14.639 1.00 0.00 O ATOM 0 H GLY A 7 -1.411 0.353 14.890 1.00 0.00 H new ATOM 0 HA2 GLY A 7 0.590 2.354 15.666 1.00 0.00 H new ATOM 0 HA3 GLY A 7 0.555 0.857 16.577 1.00 0.00 H new ATOM 66 N HIS A 8 1.438 1.370 13.472 1.00 0.00 N ATOM 67 CA HIS A 8 2.216 0.833 12.361 1.00 0.00 C ATOM 68 C HIS A 8 3.617 1.435 12.337 1.00 0.00 C ATOM 69 O HIS A 8 3.846 2.517 12.878 1.00 0.00 O ATOM 70 CB HIS A 8 1.507 1.108 11.035 1.00 0.00 C ATOM 71 CG HIS A 8 0.920 2.483 10.943 1.00 0.00 C ATOM 72 ND1 HIS A 8 1.308 3.651 11.507 1.00 0.00 N flip ATOM 73 CD2 HIS A 8 -0.206 2.772 10.203 1.00 0.00 C flip ATOM 74 CE1 HIS A 8 0.419 4.615 11.099 1.00 0.00 C flip ATOM 75 NE2 HIS A 8 -0.484 4.059 10.313 1.00 0.00 N flip ATOM 0 H HIS A 8 1.166 2.347 13.363 1.00 0.00 H new ATOM 0 HA HIS A 8 2.306 -0.244 12.500 1.00 0.00 H new ATOM 0 HB2 HIS A 8 2.215 0.969 10.218 1.00 0.00 H new ATOM 0 HB3 HIS A 8 0.714 0.373 10.898 1.00 0.00 H new ATOM 0 HD1 HIS A 8 2.111 3.789 12.121 1.00 0.00 H new ATOM 0 HD2 HIS A 8 -0.773 2.058 9.624 1.00 0.00 H new ATOM 0 HE1 HIS A 8 0.453 5.658 11.376 1.00 0.00 H new ATOM 83 N GLN A 9 4.550 0.728 11.708 1.00 0.00 N ATOM 84 CA GLN A 9 5.929 1.194 11.617 1.00 0.00 C ATOM 85 C GLN A 9 6.744 0.303 10.686 1.00 0.00 C ATOM 86 O GLN A 9 6.414 -0.866 10.484 1.00 0.00 O ATOM 87 CB GLN A 9 6.572 1.225 13.005 1.00 0.00 C ATOM 88 CG GLN A 9 6.512 -0.107 13.734 1.00 0.00 C ATOM 89 CD GLN A 9 5.118 -0.439 14.229 1.00 0.00 C ATOM 90 OE1 GLN A 9 4.343 -1.102 13.538 1.00 0.00 O ATOM 91 NE2 GLN A 9 4.792 0.020 15.431 1.00 0.00 N ATOM 0 H GLN A 9 4.377 -0.169 11.254 1.00 0.00 H new ATOM 0 HA GLN A 9 5.918 2.204 11.207 1.00 0.00 H new ATOM 0 HB2 GLN A 9 7.614 1.529 12.907 1.00 0.00 H new ATOM 0 HB3 GLN A 9 6.074 1.983 13.610 1.00 0.00 H new ATOM 0 HG2 GLN A 9 6.854 -0.898 13.067 1.00 0.00 H new ATOM 0 HG3 GLN A 9 7.198 -0.085 14.580 1.00 0.00 H new ATOM 0 HE21 GLN A 9 5.466 0.565 15.969 1.00 0.00 H new ATOM 0 HE22 GLN A 9 3.868 -0.173 15.817 1.00 0.00 H new ATOM 100 N GLU A 10 7.810 0.861 10.121 1.00 0.00 N ATOM 101 CA GLU A 10 8.671 0.116 9.210 1.00 0.00 C ATOM 102 C GLU A 10 10.092 0.025 9.758 1.00 0.00 C ATOM 103 O GLU A 10 10.642 1.010 10.252 1.00 0.00 O ATOM 104 CB GLU A 10 8.685 0.777 7.832 1.00 0.00 C ATOM 105 CG GLU A 10 7.530 0.352 6.940 1.00 0.00 C ATOM 106 CD GLU A 10 6.183 0.788 7.484 1.00 0.00 C ATOM 107 OE1 GLU A 10 6.095 1.913 8.019 1.00 0.00 O ATOM 108 OE2 GLU A 10 5.216 0.004 7.375 1.00 0.00 O ATOM 0 H GLU A 10 8.098 1.827 10.278 1.00 0.00 H new ATOM 0 HA GLU A 10 8.271 -0.894 9.116 1.00 0.00 H new ATOM 0 HB2 GLU A 10 8.657 1.859 7.957 1.00 0.00 H new ATOM 0 HB3 GLU A 10 9.625 0.538 7.334 1.00 0.00 H new ATOM 0 HG2 GLU A 10 7.670 0.774 5.945 1.00 0.00 H new ATOM 0 HG3 GLU A 10 7.540 -0.732 6.831 1.00 0.00 H new ATOM 115 N ILE A 11 10.681 -1.162 9.666 1.00 0.00 N ATOM 116 CA ILE A 11 12.037 -1.382 10.151 1.00 0.00 C ATOM 117 C ILE A 11 13.027 -1.468 8.995 1.00 0.00 C ATOM 118 O ILE A 11 14.221 -1.216 9.164 1.00 0.00 O ATOM 119 CB ILE A 11 12.133 -2.670 10.991 1.00 0.00 C ATOM 120 CG1 ILE A 11 13.534 -2.810 11.592 1.00 0.00 C ATOM 121 CG2 ILE A 11 11.793 -3.884 10.139 1.00 0.00 C ATOM 122 CD1 ILE A 11 13.638 -3.900 12.636 1.00 0.00 C ATOM 0 H ILE A 11 10.240 -1.987 9.260 1.00 0.00 H new ATOM 0 HA ILE A 11 12.289 -0.528 10.780 1.00 0.00 H new ATOM 0 HB ILE A 11 11.413 -2.609 11.807 1.00 0.00 H new ATOM 0 HG12 ILE A 11 14.245 -3.016 10.792 1.00 0.00 H new ATOM 0 HG13 ILE A 11 13.825 -1.860 12.040 1.00 0.00 H new ATOM 0 HG21 ILE A 11 11.865 -4.786 10.746 1.00 0.00 H new ATOM 0 HG22 ILE A 11 10.778 -3.786 9.754 1.00 0.00 H new ATOM 0 HG23 ILE A 11 12.492 -3.951 9.305 1.00 0.00 H new ATOM 0 HD11 ILE A 11 14.658 -3.942 13.018 1.00 0.00 H new ATOM 0 HD12 ILE A 11 12.952 -3.685 13.456 1.00 0.00 H new ATOM 0 HD13 ILE A 11 13.379 -4.859 12.188 1.00 0.00 H new ATOM 134 N LYS A 12 12.524 -1.823 7.817 1.00 0.00 N ATOM 135 CA LYS A 12 13.362 -1.938 6.629 1.00 0.00 C ATOM 136 C LYS A 12 12.511 -2.143 5.381 1.00 0.00 C ATOM 137 O LYS A 12 11.339 -2.507 5.470 1.00 0.00 O ATOM 138 CB LYS A 12 14.346 -3.100 6.786 1.00 0.00 C ATOM 139 CG LYS A 12 15.572 -2.982 5.898 1.00 0.00 C ATOM 140 CD LYS A 12 16.642 -3.989 6.288 1.00 0.00 C ATOM 141 CE LYS A 12 17.579 -3.425 7.346 1.00 0.00 C ATOM 142 NZ LYS A 12 18.870 -4.166 7.396 1.00 0.00 N ATOM 0 H LYS A 12 11.539 -2.036 7.660 1.00 0.00 H new ATOM 0 HA LYS A 12 13.921 -1.009 6.517 1.00 0.00 H new ATOM 0 HB2 LYS A 12 14.665 -3.157 7.827 1.00 0.00 H new ATOM 0 HB3 LYS A 12 13.832 -4.034 6.559 1.00 0.00 H new ATOM 0 HG2 LYS A 12 15.286 -3.138 4.858 1.00 0.00 H new ATOM 0 HG3 LYS A 12 15.978 -1.973 5.969 1.00 0.00 H new ATOM 0 HD2 LYS A 12 16.169 -4.896 6.665 1.00 0.00 H new ATOM 0 HD3 LYS A 12 17.216 -4.272 5.406 1.00 0.00 H new ATOM 0 HE2 LYS A 12 17.772 -2.373 7.136 1.00 0.00 H new ATOM 0 HE3 LYS A 12 17.095 -3.472 8.322 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 19.480 -3.751 8.129 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 18.688 -5.165 7.621 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 19.344 -4.100 6.473 1.00 0.00 H new ATOM 156 N GLY A 13 13.109 -1.908 4.217 1.00 0.00 N ATOM 157 CA GLY A 13 12.391 -2.074 2.967 1.00 0.00 C ATOM 158 C GLY A 13 12.800 -1.053 1.923 1.00 0.00 C ATOM 159 O GLY A 13 11.984 -0.239 1.490 1.00 0.00 O ATOM 0 H GLY A 13 14.078 -1.606 4.118 1.00 0.00 H new ATOM 0 HA2 GLY A 13 12.570 -3.077 2.579 1.00 0.00 H new ATOM 0 HA3 GLY A 13 11.320 -1.990 3.153 1.00 0.00 H new ATOM 163 N ARG A 14 14.065 -1.094 1.522 1.00 0.00 N ATOM 164 CA ARG A 14 14.581 -0.163 0.525 1.00 0.00 C ATOM 165 C ARG A 14 13.857 -0.336 -0.807 1.00 0.00 C ATOM 166 O ARG A 14 13.273 0.610 -1.336 1.00 0.00 O ATOM 167 CB ARG A 14 16.084 -0.371 0.331 1.00 0.00 C ATOM 168 CG ARG A 14 16.940 0.468 1.266 1.00 0.00 C ATOM 169 CD ARG A 14 16.881 -0.053 2.694 1.00 0.00 C ATOM 170 NE ARG A 14 17.656 -1.280 2.861 1.00 0.00 N ATOM 171 CZ ARG A 14 18.980 -1.303 2.973 1.00 0.00 C ATOM 172 NH1 ARG A 14 19.671 -0.173 2.938 1.00 0.00 N ATOM 173 NH2 ARG A 14 19.614 -2.459 3.124 1.00 0.00 N ATOM 0 H ARG A 14 14.752 -1.762 1.872 1.00 0.00 H new ATOM 0 HA ARG A 14 14.405 0.850 0.886 1.00 0.00 H new ATOM 0 HB2 ARG A 14 16.319 -1.424 0.484 1.00 0.00 H new ATOM 0 HB3 ARG A 14 16.345 -0.132 -0.700 1.00 0.00 H new ATOM 0 HG2 ARG A 14 17.973 0.463 0.918 1.00 0.00 H new ATOM 0 HG3 ARG A 14 16.600 1.503 1.241 1.00 0.00 H new ATOM 0 HD2 ARG A 14 17.259 0.710 3.374 1.00 0.00 H new ATOM 0 HD3 ARG A 14 15.843 -0.239 2.969 1.00 0.00 H new ATOM 0 HE ARG A 14 17.154 -2.167 2.893 1.00 0.00 H new ATOM 0 HH11 ARG A 14 19.187 0.718 2.825 1.00 0.00 H new ATOM 0 HH12 ARG A 14 20.687 -0.194 3.024 1.00 0.00 H new ATOM 0 HH21 ARG A 14 19.085 -3.331 3.154 1.00 0.00 H new ATOM 0 HH22 ARG A 14 20.630 -2.476 3.210 1.00 0.00 H new ATOM 187 N LYS A 15 13.899 -1.550 -1.344 1.00 0.00 N ATOM 188 CA LYS A 15 13.248 -1.849 -2.614 1.00 0.00 C ATOM 189 C LYS A 15 11.947 -2.613 -2.391 1.00 0.00 C ATOM 190 O LYS A 15 11.634 -3.013 -1.269 1.00 0.00 O ATOM 191 CB LYS A 15 14.183 -2.663 -3.511 1.00 0.00 C ATOM 192 CG LYS A 15 14.612 -3.987 -2.901 1.00 0.00 C ATOM 193 CD LYS A 15 15.996 -4.396 -3.376 1.00 0.00 C ATOM 194 CE LYS A 15 16.683 -5.309 -2.371 1.00 0.00 C ATOM 195 NZ LYS A 15 17.043 -4.585 -1.120 1.00 0.00 N ATOM 0 H LYS A 15 14.378 -2.344 -0.919 1.00 0.00 H new ATOM 0 HA LYS A 15 13.015 -0.905 -3.106 1.00 0.00 H new ATOM 0 HB2 LYS A 15 13.685 -2.855 -4.461 1.00 0.00 H new ATOM 0 HB3 LYS A 15 15.070 -2.069 -3.730 1.00 0.00 H new ATOM 0 HG2 LYS A 15 14.608 -3.906 -1.814 1.00 0.00 H new ATOM 0 HG3 LYS A 15 13.892 -4.761 -3.166 1.00 0.00 H new ATOM 0 HD2 LYS A 15 15.917 -4.905 -4.337 1.00 0.00 H new ATOM 0 HD3 LYS A 15 16.605 -3.506 -3.536 1.00 0.00 H new ATOM 0 HE2 LYS A 15 16.026 -6.145 -2.131 1.00 0.00 H new ATOM 0 HE3 LYS A 15 17.583 -5.730 -2.819 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 17.796 -5.103 -0.623 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 17.378 -3.629 -1.356 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 16.207 -4.516 -0.506 1.00 0.00 H new ATOM 209 N THR A 16 11.192 -2.814 -3.467 1.00 0.00 N ATOM 210 CA THR A 16 9.925 -3.530 -3.388 1.00 0.00 C ATOM 211 C THR A 16 9.993 -4.852 -4.145 1.00 0.00 C ATOM 212 O THR A 16 10.666 -4.957 -5.171 1.00 0.00 O ATOM 213 CB THR A 16 8.766 -2.687 -3.953 1.00 0.00 C ATOM 214 OG1 THR A 16 8.889 -1.330 -3.514 1.00 0.00 O ATOM 215 CG2 THR A 16 7.423 -3.249 -3.513 1.00 0.00 C ATOM 0 H THR A 16 11.436 -2.491 -4.403 1.00 0.00 H new ATOM 0 HA THR A 16 9.739 -3.727 -2.332 1.00 0.00 H new ATOM 0 HB THR A 16 8.817 -2.722 -5.041 1.00 0.00 H new ATOM 0 HG1 THR A 16 8.150 -0.800 -3.879 1.00 0.00 H new ATOM 0 HG21 THR A 16 6.620 -2.637 -3.924 1.00 0.00 H new ATOM 0 HG22 THR A 16 7.321 -4.272 -3.874 1.00 0.00 H new ATOM 0 HG23 THR A 16 7.364 -3.241 -2.425 1.00 0.00 H new ATOM 223 N LEU A 17 9.292 -5.858 -3.634 1.00 0.00 N ATOM 224 CA LEU A 17 9.271 -7.174 -4.264 1.00 0.00 C ATOM 225 C LEU A 17 7.883 -7.496 -4.808 1.00 0.00 C ATOM 226 O LEU A 17 6.968 -7.817 -4.051 1.00 0.00 O ATOM 227 CB LEU A 17 9.700 -8.247 -3.261 1.00 0.00 C ATOM 228 CG LEU A 17 9.642 -9.692 -3.758 1.00 0.00 C ATOM 229 CD1 LEU A 17 10.661 -9.917 -4.865 1.00 0.00 C ATOM 230 CD2 LEU A 17 9.878 -10.661 -2.608 1.00 0.00 C ATOM 0 H LEU A 17 8.731 -5.788 -2.785 1.00 0.00 H new ATOM 0 HA LEU A 17 9.973 -7.162 -5.098 1.00 0.00 H new ATOM 0 HB2 LEU A 17 10.721 -8.033 -2.945 1.00 0.00 H new ATOM 0 HB3 LEU A 17 9.069 -8.162 -2.377 1.00 0.00 H new ATOM 0 HG LEU A 17 8.648 -9.877 -4.165 1.00 0.00 H new ATOM 0 HD11 LEU A 17 10.605 -10.951 -5.206 1.00 0.00 H new ATOM 0 HD12 LEU A 17 10.447 -9.248 -5.698 1.00 0.00 H new ATOM 0 HD13 LEU A 17 11.662 -9.714 -4.485 1.00 0.00 H new ATOM 0 HD21 LEU A 17 9.833 -11.685 -2.980 1.00 0.00 H new ATOM 0 HD22 LEU A 17 10.860 -10.476 -2.172 1.00 0.00 H new ATOM 0 HD23 LEU A 17 9.110 -10.517 -1.848 1.00 0.00 H new ATOM 242 N ALA A 18 7.737 -7.411 -6.126 1.00 0.00 N ATOM 243 CA ALA A 18 6.462 -7.698 -6.772 1.00 0.00 C ATOM 244 C ALA A 18 6.593 -7.646 -8.291 1.00 0.00 C ATOM 245 O ALA A 18 7.526 -7.044 -8.825 1.00 0.00 O ATOM 246 CB ALA A 18 5.399 -6.719 -6.299 1.00 0.00 C ATOM 0 H ALA A 18 8.485 -7.146 -6.767 1.00 0.00 H new ATOM 0 HA ALA A 18 6.160 -8.708 -6.493 1.00 0.00 H new ATOM 0 HB1 ALA A 18 4.452 -6.945 -6.789 1.00 0.00 H new ATOM 0 HB2 ALA A 18 5.278 -6.807 -5.219 1.00 0.00 H new ATOM 0 HB3 ALA A 18 5.703 -5.703 -6.549 1.00 0.00 H new ATOM 252 N THR A 19 5.653 -8.282 -8.984 1.00 0.00 N ATOM 253 CA THR A 19 5.665 -8.310 -10.441 1.00 0.00 C ATOM 254 C THR A 19 5.550 -6.904 -11.019 1.00 0.00 C ATOM 255 O THR A 19 5.120 -5.965 -10.350 1.00 0.00 O ATOM 256 CB THR A 19 4.517 -9.175 -10.995 1.00 0.00 C ATOM 257 OG1 THR A 19 3.405 -9.150 -10.094 1.00 0.00 O ATOM 258 CG2 THR A 19 4.974 -10.611 -11.203 1.00 0.00 C ATOM 0 H THR A 19 4.874 -8.785 -8.559 1.00 0.00 H new ATOM 0 HA THR A 19 6.618 -8.747 -10.741 1.00 0.00 H new ATOM 0 HB THR A 19 4.214 -8.763 -11.957 1.00 0.00 H new ATOM 0 HG1 THR A 19 2.679 -9.701 -10.455 1.00 0.00 H new ATOM 0 HG21 THR A 19 4.147 -11.203 -11.595 1.00 0.00 H new ATOM 0 HG22 THR A 19 5.802 -10.630 -11.912 1.00 0.00 H new ATOM 0 HG23 THR A 19 5.301 -11.030 -10.252 1.00 0.00 H new ATOM 266 N PRO A 20 5.945 -6.754 -12.292 1.00 0.00 N ATOM 267 CA PRO A 20 5.894 -5.465 -12.989 1.00 0.00 C ATOM 268 C PRO A 20 4.465 -5.015 -13.274 1.00 0.00 C ATOM 269 O PRO A 20 4.146 -3.831 -13.175 1.00 0.00 O ATOM 270 CB PRO A 20 6.640 -5.739 -14.297 1.00 0.00 C ATOM 271 CG PRO A 20 6.490 -7.205 -14.518 1.00 0.00 C ATOM 272 CD PRO A 20 6.468 -7.829 -13.150 1.00 0.00 C ATOM 0 HA PRO A 20 6.330 -4.663 -12.394 1.00 0.00 H new ATOM 0 HB2 PRO A 20 6.214 -5.168 -15.123 1.00 0.00 H new ATOM 0 HB3 PRO A 20 7.690 -5.455 -14.221 1.00 0.00 H new ATOM 0 HG2 PRO A 20 5.572 -7.426 -15.063 1.00 0.00 H new ATOM 0 HG3 PRO A 20 7.315 -7.597 -15.113 1.00 0.00 H new ATOM 0 HD2 PRO A 20 5.830 -8.712 -13.122 1.00 0.00 H new ATOM 0 HD3 PRO A 20 7.463 -8.145 -12.837 1.00 0.00 H new ATOM 280 N ALA A 21 3.609 -5.968 -13.628 1.00 0.00 N ATOM 281 CA ALA A 21 2.213 -5.670 -13.925 1.00 0.00 C ATOM 282 C ALA A 21 1.481 -5.178 -12.682 1.00 0.00 C ATOM 283 O ALA A 21 0.568 -4.357 -12.770 1.00 0.00 O ATOM 284 CB ALA A 21 1.521 -6.899 -14.496 1.00 0.00 C ATOM 0 H ALA A 21 3.858 -6.953 -13.716 1.00 0.00 H new ATOM 0 HA ALA A 21 2.187 -4.874 -14.669 1.00 0.00 H new ATOM 0 HB1 ALA A 21 0.479 -6.662 -14.713 1.00 0.00 H new ATOM 0 HB2 ALA A 21 2.022 -7.205 -15.414 1.00 0.00 H new ATOM 0 HB3 ALA A 21 1.565 -7.711 -13.770 1.00 0.00 H new ATOM 290 N VAL A 22 1.886 -5.685 -11.521 1.00 0.00 N ATOM 291 CA VAL A 22 1.268 -5.297 -10.260 1.00 0.00 C ATOM 292 C VAL A 22 1.809 -3.958 -9.771 1.00 0.00 C ATOM 293 O VAL A 22 1.066 -3.132 -9.242 1.00 0.00 O ATOM 294 CB VAL A 22 1.500 -6.360 -9.170 1.00 0.00 C ATOM 295 CG1 VAL A 22 1.052 -5.841 -7.812 1.00 0.00 C ATOM 296 CG2 VAL A 22 0.775 -7.651 -9.522 1.00 0.00 C ATOM 0 H VAL A 22 2.640 -6.366 -11.429 1.00 0.00 H new ATOM 0 HA VAL A 22 0.198 -5.207 -10.448 1.00 0.00 H new ATOM 0 HB VAL A 22 2.568 -6.572 -9.116 1.00 0.00 H new ATOM 0 HG11 VAL A 22 1.224 -6.606 -7.055 1.00 0.00 H new ATOM 0 HG12 VAL A 22 1.621 -4.946 -7.559 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -0.010 -5.598 -7.848 1.00 0.00 H new ATOM 0 HG21 VAL A 22 0.950 -8.391 -8.741 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -0.294 -7.457 -9.605 1.00 0.00 H new ATOM 0 HG23 VAL A 22 1.150 -8.031 -10.472 1.00 0.00 H new ATOM 306 N ARG A 23 3.109 -3.750 -9.954 1.00 0.00 N ATOM 307 CA ARG A 23 3.752 -2.511 -9.531 1.00 0.00 C ATOM 308 C ARG A 23 3.027 -1.299 -10.110 1.00 0.00 C ATOM 309 O ARG A 23 3.076 -0.206 -9.544 1.00 0.00 O ATOM 310 CB ARG A 23 5.218 -2.498 -9.966 1.00 0.00 C ATOM 311 CG ARG A 23 6.121 -3.352 -9.089 1.00 0.00 C ATOM 312 CD ARG A 23 7.483 -3.563 -9.732 1.00 0.00 C ATOM 313 NE ARG A 23 8.368 -4.361 -8.888 1.00 0.00 N ATOM 314 CZ ARG A 23 9.593 -4.727 -9.248 1.00 0.00 C ATOM 315 NH1 ARG A 23 10.075 -4.370 -10.430 1.00 0.00 N ATOM 316 NH2 ARG A 23 10.338 -5.454 -8.424 1.00 0.00 N ATOM 0 H ARG A 23 3.738 -4.423 -10.392 1.00 0.00 H new ATOM 0 HA ARG A 23 3.703 -2.458 -8.443 1.00 0.00 H new ATOM 0 HB2 ARG A 23 5.286 -2.851 -10.995 1.00 0.00 H new ATOM 0 HB3 ARG A 23 5.582 -1.471 -9.956 1.00 0.00 H new ATOM 0 HG2 ARG A 23 6.246 -2.873 -8.118 1.00 0.00 H new ATOM 0 HG3 ARG A 23 5.648 -4.318 -8.910 1.00 0.00 H new ATOM 0 HD2 ARG A 23 7.357 -4.058 -10.695 1.00 0.00 H new ATOM 0 HD3 ARG A 23 7.945 -2.596 -9.929 1.00 0.00 H new ATOM 0 HE ARG A 23 8.027 -4.653 -7.972 1.00 0.00 H new ATOM 0 HH11 ARG A 23 9.505 -3.813 -11.066 1.00 0.00 H new ATOM 0 HH12 ARG A 23 11.016 -4.653 -10.703 1.00 0.00 H new ATOM 0 HH21 ARG A 23 9.970 -5.732 -7.514 1.00 0.00 H new ATOM 0 HH22 ARG A 23 11.279 -5.735 -8.701 1.00 0.00 H new ATOM 330 N ARG A 24 2.358 -1.499 -11.240 1.00 0.00 N ATOM 331 CA ARG A 24 1.626 -0.423 -11.896 1.00 0.00 C ATOM 332 C ARG A 24 0.272 -0.201 -11.228 1.00 0.00 C ATOM 333 O ARG A 24 -0.100 0.932 -10.917 1.00 0.00 O ATOM 334 CB ARG A 24 1.428 -0.742 -13.380 1.00 0.00 C ATOM 335 CG ARG A 24 0.213 -0.065 -13.992 1.00 0.00 C ATOM 336 CD ARG A 24 0.394 0.161 -15.484 1.00 0.00 C ATOM 337 NE ARG A 24 -0.881 0.156 -16.197 1.00 0.00 N ATOM 338 CZ ARG A 24 -0.998 -0.108 -17.494 1.00 0.00 C ATOM 339 NH1 ARG A 24 0.079 -0.389 -18.215 1.00 0.00 N ATOM 340 NH2 ARG A 24 -2.192 -0.093 -18.070 1.00 0.00 N ATOM 0 H ARG A 24 2.308 -2.397 -11.721 1.00 0.00 H new ATOM 0 HA ARG A 24 2.213 0.491 -11.803 1.00 0.00 H new ATOM 0 HB2 ARG A 24 2.318 -0.438 -13.930 1.00 0.00 H new ATOM 0 HB3 ARG A 24 1.332 -1.821 -13.501 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -0.672 -0.678 -13.821 1.00 0.00 H new ATOM 0 HG3 ARG A 24 0.039 0.890 -13.497 1.00 0.00 H new ATOM 0 HD2 ARG A 24 0.897 1.114 -15.648 1.00 0.00 H new ATOM 0 HD3 ARG A 24 1.041 -0.615 -15.892 1.00 0.00 H new ATOM 0 HE ARG A 24 -1.728 0.367 -15.670 1.00 0.00 H new ATOM 0 HH11 ARG A 24 0.999 -0.403 -17.774 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -0.012 -0.591 -19.211 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -3.022 0.121 -17.517 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -2.280 -0.296 -19.066 1.00 0.00 H new ATOM 354 N LEU A 25 -0.460 -1.287 -11.010 1.00 0.00 N ATOM 355 CA LEU A 25 -1.774 -1.211 -10.380 1.00 0.00 C ATOM 356 C LEU A 25 -1.758 -0.238 -9.205 1.00 0.00 C ATOM 357 O LEU A 25 -2.794 0.300 -8.818 1.00 0.00 O ATOM 358 CB LEU A 25 -2.214 -2.597 -9.904 1.00 0.00 C ATOM 359 CG LEU A 25 -3.721 -2.811 -9.763 1.00 0.00 C ATOM 360 CD1 LEU A 25 -4.410 -2.651 -11.110 1.00 0.00 C ATOM 361 CD2 LEU A 25 -4.012 -4.182 -9.172 1.00 0.00 C ATOM 0 H LEU A 25 -0.166 -2.231 -11.260 1.00 0.00 H new ATOM 0 HA LEU A 25 -2.485 -0.846 -11.121 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -1.826 -3.339 -10.602 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -1.748 -2.793 -8.938 1.00 0.00 H new ATOM 0 HG LEU A 25 -4.115 -2.055 -9.084 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -5.482 -2.807 -10.991 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -4.230 -1.647 -11.494 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -4.013 -3.385 -11.811 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -5.090 -4.317 -9.079 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -3.605 -4.954 -9.825 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -3.550 -4.259 -8.188 1.00 0.00 H new ATOM 373 N ALA A 26 -0.573 -0.016 -8.644 1.00 0.00 N ATOM 374 CA ALA A 26 -0.422 0.895 -7.515 1.00 0.00 C ATOM 375 C ALA A 26 -0.239 2.332 -7.992 1.00 0.00 C ATOM 376 O ALA A 26 -0.957 3.235 -7.562 1.00 0.00 O ATOM 377 CB ALA A 26 0.754 0.471 -6.649 1.00 0.00 C ATOM 0 H ALA A 26 0.295 -0.454 -8.952 1.00 0.00 H new ATOM 0 HA ALA A 26 -1.333 0.850 -6.918 1.00 0.00 H new ATOM 0 HB1 ALA A 26 0.855 1.160 -5.810 1.00 0.00 H new ATOM 0 HB2 ALA A 26 0.583 -0.537 -6.272 1.00 0.00 H new ATOM 0 HB3 ALA A 26 1.668 0.486 -7.243 1.00 0.00 H new ATOM 383 N MET A 27 0.727 2.537 -8.882 1.00 0.00 N ATOM 384 CA MET A 27 1.004 3.866 -9.417 1.00 0.00 C ATOM 385 C MET A 27 -0.256 4.483 -10.016 1.00 0.00 C ATOM 386 O MET A 27 -0.405 5.704 -10.044 1.00 0.00 O ATOM 387 CB MET A 27 2.105 3.793 -10.476 1.00 0.00 C ATOM 388 CG MET A 27 1.604 3.359 -11.844 1.00 0.00 C ATOM 389 SD MET A 27 2.817 3.638 -13.148 1.00 0.00 S ATOM 390 CE MET A 27 4.113 2.505 -12.653 1.00 0.00 C ATOM 0 H MET A 27 1.331 1.801 -9.248 1.00 0.00 H new ATOM 0 HA MET A 27 1.342 4.499 -8.596 1.00 0.00 H new ATOM 0 HB2 MET A 27 2.578 4.771 -10.565 1.00 0.00 H new ATOM 0 HB3 MET A 27 2.874 3.096 -10.142 1.00 0.00 H new ATOM 0 HG2 MET A 27 1.346 2.300 -11.813 1.00 0.00 H new ATOM 0 HG3 MET A 27 0.690 3.903 -12.081 1.00 0.00 H new ATOM 0 HE1 MET A 27 5.023 3.065 -12.437 1.00 0.00 H new ATOM 0 HE2 MET A 27 3.800 1.962 -11.761 1.00 0.00 H new ATOM 0 HE3 MET A 27 4.306 1.798 -13.460 1.00 0.00 H new ATOM 400 N GLU A 28 -1.157 3.631 -10.494 1.00 0.00 N ATOM 401 CA GLU A 28 -2.402 4.096 -11.095 1.00 0.00 C ATOM 402 C GLU A 28 -3.394 4.531 -10.021 1.00 0.00 C ATOM 403 O GLU A 28 -4.162 5.473 -10.215 1.00 0.00 O ATOM 404 CB GLU A 28 -3.020 2.993 -11.959 1.00 0.00 C ATOM 405 CG GLU A 28 -2.047 2.383 -12.954 1.00 0.00 C ATOM 406 CD GLU A 28 -2.733 1.888 -14.212 1.00 0.00 C ATOM 407 OE1 GLU A 28 -2.925 2.699 -15.142 1.00 0.00 O ATOM 408 OE2 GLU A 28 -3.079 0.689 -14.267 1.00 0.00 O ATOM 0 H GLU A 28 -1.049 2.617 -10.477 1.00 0.00 H new ATOM 0 HA GLU A 28 -2.173 4.956 -11.725 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -3.403 2.206 -11.309 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -3.872 3.402 -12.501 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -1.295 3.125 -13.223 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -1.522 1.554 -12.481 1.00 0.00 H new ATOM 415 N ASN A 29 -3.374 3.836 -8.888 1.00 0.00 N ATOM 416 CA ASN A 29 -4.272 4.150 -7.783 1.00 0.00 C ATOM 417 C ASN A 29 -3.549 4.953 -6.705 1.00 0.00 C ATOM 418 O ASN A 29 -4.048 5.105 -5.591 1.00 0.00 O ATOM 419 CB ASN A 29 -4.842 2.864 -7.180 1.00 0.00 C ATOM 420 CG ASN A 29 -5.894 2.227 -8.068 1.00 0.00 C ATOM 421 OD1 ASN A 29 -7.044 2.666 -8.099 1.00 0.00 O ATOM 422 ND2 ASN A 29 -5.504 1.186 -8.794 1.00 0.00 N ATOM 0 H ASN A 29 -2.746 3.052 -8.711 1.00 0.00 H new ATOM 0 HA ASN A 29 -5.091 4.754 -8.174 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -4.032 2.154 -7.014 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -5.278 3.085 -6.206 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -6.168 0.716 -9.409 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -4.540 0.856 -8.736 1.00 0.00 H new ATOM 429 N ASN A 30 -2.371 5.463 -7.046 1.00 0.00 N ATOM 430 CA ASN A 30 -1.579 6.251 -6.108 1.00 0.00 C ATOM 431 C ASN A 30 -1.428 5.521 -4.777 1.00 0.00 C ATOM 432 O ASN A 30 -1.532 6.126 -3.710 1.00 0.00 O ATOM 433 CB ASN A 30 -2.228 7.618 -5.881 1.00 0.00 C ATOM 434 CG ASN A 30 -1.989 8.570 -7.037 1.00 0.00 C ATOM 435 OD1 ASN A 30 -1.633 8.150 -8.139 1.00 0.00 O ATOM 436 ND2 ASN A 30 -2.182 9.860 -6.791 1.00 0.00 N ATOM 0 H ASN A 30 -1.943 5.345 -7.964 1.00 0.00 H new ATOM 0 HA ASN A 30 -0.588 6.394 -6.539 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -3.301 7.489 -5.736 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -1.833 8.057 -4.965 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -2.035 10.548 -7.530 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -2.477 10.164 -5.863 1.00 0.00 H new ATOM 443 N ILE A 31 -1.181 4.216 -4.849 1.00 0.00 N ATOM 444 CA ILE A 31 -1.014 3.404 -3.650 1.00 0.00 C ATOM 445 C ILE A 31 0.462 3.202 -3.324 1.00 0.00 C ATOM 446 O ILE A 31 1.269 2.909 -4.207 1.00 0.00 O ATOM 447 CB ILE A 31 -1.688 2.028 -3.803 1.00 0.00 C ATOM 448 CG1 ILE A 31 -3.200 2.193 -3.972 1.00 0.00 C ATOM 449 CG2 ILE A 31 -1.375 1.148 -2.603 1.00 0.00 C ATOM 450 CD1 ILE A 31 -3.908 0.911 -4.354 1.00 0.00 C ATOM 0 H ILE A 31 -1.092 3.700 -5.724 1.00 0.00 H new ATOM 0 HA ILE A 31 -1.493 3.945 -2.834 1.00 0.00 H new ATOM 0 HB ILE A 31 -1.293 1.543 -4.696 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -3.623 2.569 -3.040 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -3.392 2.946 -4.736 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -1.859 0.179 -2.726 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -0.297 1.008 -2.526 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -1.745 1.625 -1.696 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -4.976 1.102 -4.457 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -3.512 0.545 -5.301 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -3.746 0.161 -3.579 1.00 0.00 H new ATOM 462 N LYS A 32 0.808 3.359 -2.051 1.00 0.00 N ATOM 463 CA LYS A 32 2.186 3.190 -1.606 1.00 0.00 C ATOM 464 C LYS A 32 2.535 1.712 -1.463 1.00 0.00 C ATOM 465 O LYS A 32 2.314 1.111 -0.410 1.00 0.00 O ATOM 466 CB LYS A 32 2.405 3.908 -0.273 1.00 0.00 C ATOM 467 CG LYS A 32 2.315 5.421 -0.375 1.00 0.00 C ATOM 468 CD LYS A 32 0.877 5.901 -0.284 1.00 0.00 C ATOM 469 CE LYS A 32 0.803 7.409 -0.094 1.00 0.00 C ATOM 470 NZ LYS A 32 -0.501 7.962 -0.551 1.00 0.00 N ATOM 0 H LYS A 32 0.152 3.603 -1.309 1.00 0.00 H new ATOM 0 HA LYS A 32 2.841 3.628 -2.359 1.00 0.00 H new ATOM 0 HB2 LYS A 32 1.665 3.556 0.446 1.00 0.00 H new ATOM 0 HB3 LYS A 32 3.385 3.636 0.120 1.00 0.00 H new ATOM 0 HG2 LYS A 32 2.903 5.876 0.422 1.00 0.00 H new ATOM 0 HG3 LYS A 32 2.750 5.750 -1.319 1.00 0.00 H new ATOM 0 HD2 LYS A 32 0.341 5.621 -1.191 1.00 0.00 H new ATOM 0 HD3 LYS A 32 0.378 5.404 0.548 1.00 0.00 H new ATOM 0 HE2 LYS A 32 0.951 7.650 0.959 1.00 0.00 H new ATOM 0 HE3 LYS A 32 1.613 7.885 -0.647 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -0.512 8.992 -0.405 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -0.631 7.754 -1.562 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -1.273 7.527 -0.006 1.00 0.00 H new ATOM 484 N LEU A 33 3.081 1.131 -2.525 1.00 0.00 N ATOM 485 CA LEU A 33 3.463 -0.276 -2.517 1.00 0.00 C ATOM 486 C LEU A 33 3.961 -0.698 -1.139 1.00 0.00 C ATOM 487 O LEU A 33 3.420 -1.618 -0.526 1.00 0.00 O ATOM 488 CB LEU A 33 4.544 -0.539 -3.566 1.00 0.00 C ATOM 489 CG LEU A 33 4.050 -0.951 -4.953 1.00 0.00 C ATOM 490 CD1 LEU A 33 5.224 -1.183 -5.891 1.00 0.00 C ATOM 491 CD2 LEU A 33 3.182 -2.198 -4.860 1.00 0.00 C ATOM 0 H LEU A 33 3.269 1.613 -3.404 1.00 0.00 H new ATOM 0 HA LEU A 33 2.580 -0.867 -2.760 1.00 0.00 H new ATOM 0 HB2 LEU A 33 5.147 0.363 -3.671 1.00 0.00 H new ATOM 0 HB3 LEU A 33 5.203 -1.321 -3.190 1.00 0.00 H new ATOM 0 HG LEU A 33 3.444 -0.141 -5.358 1.00 0.00 H new ATOM 0 HD11 LEU A 33 4.853 -1.475 -6.873 1.00 0.00 H new ATOM 0 HD12 LEU A 33 5.805 -0.265 -5.981 1.00 0.00 H new ATOM 0 HD13 LEU A 33 5.857 -1.975 -5.492 1.00 0.00 H new ATOM 0 HD21 LEU A 33 2.839 -2.478 -5.856 1.00 0.00 H new ATOM 0 HD22 LEU A 33 3.764 -3.015 -4.434 1.00 0.00 H new ATOM 0 HD23 LEU A 33 2.321 -1.995 -4.223 1.00 0.00 H new ATOM 503 N SER A 34 4.995 -0.016 -0.655 1.00 0.00 N ATOM 504 CA SER A 34 5.569 -0.320 0.650 1.00 0.00 C ATOM 505 C SER A 34 4.473 -0.485 1.699 1.00 0.00 C ATOM 506 O SER A 34 4.532 -1.386 2.536 1.00 0.00 O ATOM 507 CB SER A 34 6.536 0.785 1.077 1.00 0.00 C ATOM 508 OG SER A 34 7.223 0.432 2.264 1.00 0.00 O ATOM 0 H SER A 34 5.452 0.751 -1.148 1.00 0.00 H new ATOM 0 HA SER A 34 6.116 -1.259 0.569 1.00 0.00 H new ATOM 0 HB2 SER A 34 7.255 0.972 0.279 1.00 0.00 H new ATOM 0 HB3 SER A 34 5.986 1.713 1.234 1.00 0.00 H new ATOM 0 HG SER A 34 7.836 1.155 2.514 1.00 0.00 H new ATOM 514 N GLU A 35 3.475 0.391 1.647 1.00 0.00 N ATOM 515 CA GLU A 35 2.367 0.343 2.593 1.00 0.00 C ATOM 516 C GLU A 35 1.507 -0.896 2.361 1.00 0.00 C ATOM 517 O GLU A 35 0.865 -1.402 3.282 1.00 0.00 O ATOM 518 CB GLU A 35 1.508 1.603 2.471 1.00 0.00 C ATOM 519 CG GLU A 35 2.282 2.891 2.693 1.00 0.00 C ATOM 520 CD GLU A 35 2.829 3.007 4.103 1.00 0.00 C ATOM 521 OE1 GLU A 35 2.182 2.487 5.036 1.00 0.00 O ATOM 522 OE2 GLU A 35 3.905 3.619 4.273 1.00 0.00 O ATOM 0 H GLU A 35 3.411 1.142 0.960 1.00 0.00 H new ATOM 0 HA GLU A 35 2.784 0.292 3.599 1.00 0.00 H new ATOM 0 HB2 GLU A 35 1.054 1.628 1.481 1.00 0.00 H new ATOM 0 HB3 GLU A 35 0.694 1.549 3.194 1.00 0.00 H new ATOM 0 HG2 GLU A 35 3.107 2.942 1.982 1.00 0.00 H new ATOM 0 HG3 GLU A 35 1.631 3.741 2.488 1.00 0.00 H new ATOM 529 N VAL A 36 1.500 -1.381 1.123 1.00 0.00 N ATOM 530 CA VAL A 36 0.719 -2.560 0.769 1.00 0.00 C ATOM 531 C VAL A 36 1.384 -3.833 1.281 1.00 0.00 C ATOM 532 O VAL A 36 2.363 -4.310 0.708 1.00 0.00 O ATOM 533 CB VAL A 36 0.531 -2.671 -0.756 1.00 0.00 C ATOM 534 CG1 VAL A 36 -0.450 -3.784 -1.093 1.00 0.00 C ATOM 535 CG2 VAL A 36 0.063 -1.344 -1.333 1.00 0.00 C ATOM 0 H VAL A 36 2.026 -0.976 0.349 1.00 0.00 H new ATOM 0 HA VAL A 36 -0.257 -2.447 1.241 1.00 0.00 H new ATOM 0 HB VAL A 36 1.492 -2.918 -1.206 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -0.570 -3.848 -2.174 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -0.069 -4.732 -0.714 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -1.415 -3.571 -0.632 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -0.065 -1.441 -2.411 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -0.888 -1.065 -0.879 1.00 0.00 H new ATOM 0 HG23 VAL A 36 0.805 -0.574 -1.123 1.00 0.00 H new ATOM 545 N VAL A 37 0.845 -4.380 2.367 1.00 0.00 N ATOM 546 CA VAL A 37 1.384 -5.599 2.957 1.00 0.00 C ATOM 547 C VAL A 37 1.294 -6.767 1.983 1.00 0.00 C ATOM 548 O VAL A 37 0.233 -7.366 1.810 1.00 0.00 O ATOM 549 CB VAL A 37 0.642 -5.969 4.256 1.00 0.00 C ATOM 550 CG1 VAL A 37 -0.851 -6.099 3.999 1.00 0.00 C ATOM 551 CG2 VAL A 37 1.205 -7.255 4.842 1.00 0.00 C ATOM 0 H VAL A 37 0.035 -3.998 2.855 1.00 0.00 H new ATOM 0 HA VAL A 37 2.431 -5.403 3.188 1.00 0.00 H new ATOM 0 HB VAL A 37 0.793 -5.170 4.981 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -1.359 -6.361 4.927 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -1.240 -5.151 3.627 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -1.026 -6.879 3.258 1.00 0.00 H new ATOM 0 HG21 VAL A 37 0.670 -7.502 5.759 1.00 0.00 H new ATOM 0 HG22 VAL A 37 1.086 -8.065 4.123 1.00 0.00 H new ATOM 0 HG23 VAL A 37 2.263 -7.121 5.065 1.00 0.00 H new ATOM 561 N GLY A 38 2.418 -7.088 1.348 1.00 0.00 N ATOM 562 CA GLY A 38 2.445 -8.186 0.398 1.00 0.00 C ATOM 563 C GLY A 38 1.856 -9.461 0.968 1.00 0.00 C ATOM 564 O GLY A 38 1.437 -9.496 2.125 1.00 0.00 O ATOM 0 H GLY A 38 3.309 -6.608 1.474 1.00 0.00 H new ATOM 0 HA2 GLY A 38 1.891 -7.902 -0.497 1.00 0.00 H new ATOM 0 HA3 GLY A 38 3.474 -8.371 0.090 1.00 0.00 H new ATOM 568 N SER A 39 1.821 -10.511 0.153 1.00 0.00 N ATOM 569 CA SER A 39 1.273 -11.792 0.581 1.00 0.00 C ATOM 570 C SER A 39 2.208 -12.936 0.202 1.00 0.00 C ATOM 571 O SER A 39 2.385 -13.887 0.962 1.00 0.00 O ATOM 572 CB SER A 39 -0.105 -12.016 -0.044 1.00 0.00 C ATOM 573 OG SER A 39 -1.025 -11.027 0.383 1.00 0.00 O ATOM 0 H SER A 39 2.166 -10.499 -0.807 1.00 0.00 H new ATOM 0 HA SER A 39 1.172 -11.772 1.666 1.00 0.00 H new ATOM 0 HB2 SER A 39 -0.023 -11.996 -1.131 1.00 0.00 H new ATOM 0 HB3 SER A 39 -0.475 -13.004 0.229 1.00 0.00 H new ATOM 0 HG SER A 39 -1.898 -11.191 -0.032 1.00 0.00 H new ATOM 579 N GLY A 40 2.807 -12.837 -0.982 1.00 0.00 N ATOM 580 CA GLY A 40 3.716 -13.869 -1.443 1.00 0.00 C ATOM 581 C GLY A 40 4.627 -14.373 -0.342 1.00 0.00 C ATOM 582 O GLY A 40 4.867 -13.675 0.644 1.00 0.00 O ATOM 0 H GLY A 40 2.678 -12.060 -1.630 1.00 0.00 H new ATOM 0 HA2 GLY A 40 3.140 -14.703 -1.844 1.00 0.00 H new ATOM 0 HA3 GLY A 40 4.321 -13.477 -2.260 1.00 0.00 H new ATOM 586 N LYS A 41 5.136 -15.590 -0.508 1.00 0.00 N ATOM 587 CA LYS A 41 6.026 -16.188 0.480 1.00 0.00 C ATOM 588 C LYS A 41 7.086 -15.190 0.934 1.00 0.00 C ATOM 589 O LYS A 41 7.219 -14.910 2.125 1.00 0.00 O ATOM 590 CB LYS A 41 6.699 -17.435 -0.098 1.00 0.00 C ATOM 591 CG LYS A 41 7.215 -18.394 0.960 1.00 0.00 C ATOM 592 CD LYS A 41 8.633 -18.047 1.382 1.00 0.00 C ATOM 593 CE LYS A 41 9.112 -18.940 2.516 1.00 0.00 C ATOM 594 NZ LYS A 41 10.533 -18.672 2.871 1.00 0.00 N ATOM 0 H LYS A 41 4.947 -16.181 -1.318 1.00 0.00 H new ATOM 0 HA LYS A 41 5.427 -16.473 1.345 1.00 0.00 H new ATOM 0 HB2 LYS A 41 5.987 -17.959 -0.735 1.00 0.00 H new ATOM 0 HB3 LYS A 41 7.529 -17.128 -0.734 1.00 0.00 H new ATOM 0 HG2 LYS A 41 6.558 -18.366 1.830 1.00 0.00 H new ATOM 0 HG3 LYS A 41 7.188 -19.413 0.573 1.00 0.00 H new ATOM 0 HD2 LYS A 41 9.303 -18.150 0.529 1.00 0.00 H new ATOM 0 HD3 LYS A 41 8.675 -17.004 1.696 1.00 0.00 H new ATOM 0 HE2 LYS A 41 8.483 -18.783 3.392 1.00 0.00 H new ATOM 0 HE3 LYS A 41 9.001 -19.985 2.227 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 10.821 -19.301 3.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 11.137 -18.846 2.042 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 10.635 -17.682 3.171 1.00 0.00 H new ATOM 608 N ASP A 42 7.836 -14.655 -0.023 1.00 0.00 N ATOM 609 CA ASP A 42 8.882 -13.685 0.278 1.00 0.00 C ATOM 610 C ASP A 42 8.306 -12.276 0.376 1.00 0.00 C ATOM 611 O ASP A 42 8.970 -11.298 0.035 1.00 0.00 O ATOM 612 CB ASP A 42 9.973 -13.730 -0.795 1.00 0.00 C ATOM 613 CG ASP A 42 10.654 -15.082 -0.870 1.00 0.00 C ATOM 614 OD1 ASP A 42 9.979 -16.068 -1.234 1.00 0.00 O ATOM 615 OD2 ASP A 42 11.864 -15.154 -0.568 1.00 0.00 O ATOM 0 H ASP A 42 7.739 -14.877 -1.014 1.00 0.00 H new ATOM 0 HA ASP A 42 9.319 -13.947 1.242 1.00 0.00 H new ATOM 0 HB2 ASP A 42 9.535 -13.492 -1.765 1.00 0.00 H new ATOM 0 HB3 ASP A 42 10.718 -12.962 -0.585 1.00 0.00 H new ATOM 620 N GLY A 43 7.065 -12.181 0.843 1.00 0.00 N ATOM 621 CA GLY A 43 6.420 -10.888 0.977 1.00 0.00 C ATOM 622 C GLY A 43 6.077 -10.269 -0.364 1.00 0.00 C ATOM 623 O GLY A 43 5.625 -9.127 -0.431 1.00 0.00 O ATOM 0 H GLY A 43 6.495 -12.976 1.131 1.00 0.00 H new ATOM 0 HA2 GLY A 43 5.510 -10.999 1.566 1.00 0.00 H new ATOM 0 HA3 GLY A 43 7.076 -10.214 1.528 1.00 0.00 H new ATOM 627 N ARG A 44 6.296 -11.026 -1.436 1.00 0.00 N ATOM 628 CA ARG A 44 6.010 -10.543 -2.782 1.00 0.00 C ATOM 629 C ARG A 44 4.577 -10.033 -2.884 1.00 0.00 C ATOM 630 O ARG A 44 3.623 -10.802 -2.749 1.00 0.00 O ATOM 631 CB ARG A 44 6.241 -11.657 -3.805 1.00 0.00 C ATOM 632 CG ARG A 44 5.641 -11.364 -5.169 1.00 0.00 C ATOM 633 CD ARG A 44 5.824 -12.536 -6.122 1.00 0.00 C ATOM 634 NE ARG A 44 4.869 -13.609 -5.859 1.00 0.00 N ATOM 635 CZ ARG A 44 4.848 -14.754 -6.532 1.00 0.00 C ATOM 636 NH1 ARG A 44 5.724 -14.973 -7.503 1.00 0.00 N ATOM 637 NH2 ARG A 44 3.948 -15.683 -6.235 1.00 0.00 N ATOM 0 H ARG A 44 6.670 -11.974 -1.398 1.00 0.00 H new ATOM 0 HA ARG A 44 6.687 -9.716 -2.996 1.00 0.00 H new ATOM 0 HB2 ARG A 44 7.313 -11.820 -3.916 1.00 0.00 H new ATOM 0 HB3 ARG A 44 5.816 -12.585 -3.422 1.00 0.00 H new ATOM 0 HG2 ARG A 44 4.579 -11.144 -5.061 1.00 0.00 H new ATOM 0 HG3 ARG A 44 6.109 -10.475 -5.590 1.00 0.00 H new ATOM 0 HD2 ARG A 44 5.707 -12.190 -7.149 1.00 0.00 H new ATOM 0 HD3 ARG A 44 6.839 -12.923 -6.030 1.00 0.00 H new ATOM 0 HE ARG A 44 4.181 -13.472 -5.119 1.00 0.00 H new ATOM 0 HH11 ARG A 44 6.417 -14.261 -7.735 1.00 0.00 H new ATOM 0 HH12 ARG A 44 5.705 -15.853 -8.018 1.00 0.00 H new ATOM 0 HH21 ARG A 44 3.272 -15.518 -5.489 1.00 0.00 H new ATOM 0 HH22 ARG A 44 3.933 -16.562 -6.752 1.00 0.00 H new ATOM 651 N ILE A 45 4.432 -8.734 -3.121 1.00 0.00 N ATOM 652 CA ILE A 45 3.114 -8.123 -3.241 1.00 0.00 C ATOM 653 C ILE A 45 2.399 -8.600 -4.500 1.00 0.00 C ATOM 654 O ILE A 45 2.839 -8.328 -5.618 1.00 0.00 O ATOM 655 CB ILE A 45 3.208 -6.585 -3.269 1.00 0.00 C ATOM 656 CG1 ILE A 45 4.088 -6.085 -2.122 1.00 0.00 C ATOM 657 CG2 ILE A 45 1.820 -5.968 -3.186 1.00 0.00 C ATOM 658 CD1 ILE A 45 4.781 -4.773 -2.420 1.00 0.00 C ATOM 0 H ILE A 45 5.210 -8.084 -3.234 1.00 0.00 H new ATOM 0 HA ILE A 45 2.543 -8.429 -2.364 1.00 0.00 H new ATOM 0 HB ILE A 45 3.664 -6.281 -4.211 1.00 0.00 H new ATOM 0 HG12 ILE A 45 3.475 -5.968 -1.229 1.00 0.00 H new ATOM 0 HG13 ILE A 45 4.840 -6.841 -1.896 1.00 0.00 H new ATOM 0 HG21 ILE A 45 1.903 -4.881 -3.207 1.00 0.00 H new ATOM 0 HG22 ILE A 45 1.222 -6.303 -4.034 1.00 0.00 H new ATOM 0 HG23 ILE A 45 1.339 -6.277 -2.258 1.00 0.00 H new ATOM 0 HD11 ILE A 45 5.387 -4.479 -1.563 1.00 0.00 H new ATOM 0 HD12 ILE A 45 5.421 -4.890 -3.295 1.00 0.00 H new ATOM 0 HD13 ILE A 45 4.034 -4.004 -2.617 1.00 0.00 H new ATOM 670 N LEU A 46 1.292 -9.311 -4.312 1.00 0.00 N ATOM 671 CA LEU A 46 0.514 -9.825 -5.432 1.00 0.00 C ATOM 672 C LEU A 46 -0.509 -8.797 -5.903 1.00 0.00 C ATOM 673 O LEU A 46 -0.730 -7.779 -5.246 1.00 0.00 O ATOM 674 CB LEU A 46 -0.194 -11.122 -5.034 1.00 0.00 C ATOM 675 CG LEU A 46 0.683 -12.195 -4.389 1.00 0.00 C ATOM 676 CD1 LEU A 46 -0.169 -13.351 -3.887 1.00 0.00 C ATOM 677 CD2 LEU A 46 1.732 -12.692 -5.375 1.00 0.00 C ATOM 0 H LEU A 46 0.914 -9.544 -3.394 1.00 0.00 H new ATOM 0 HA LEU A 46 1.199 -10.030 -6.254 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -0.999 -10.875 -4.342 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -0.658 -11.547 -5.924 1.00 0.00 H new ATOM 0 HG LEU A 46 1.197 -11.752 -3.536 1.00 0.00 H new ATOM 0 HD11 LEU A 46 0.473 -14.105 -3.431 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -0.880 -12.984 -3.147 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -0.711 -13.793 -4.723 1.00 0.00 H new ATOM 0 HD21 LEU A 46 2.347 -13.455 -4.898 1.00 0.00 H new ATOM 0 HD22 LEU A 46 1.238 -13.118 -6.248 1.00 0.00 H new ATOM 0 HD23 LEU A 46 2.363 -11.859 -5.685 1.00 0.00 H new ATOM 689 N LYS A 47 -1.135 -9.071 -7.043 1.00 0.00 N ATOM 690 CA LYS A 47 -2.139 -8.171 -7.600 1.00 0.00 C ATOM 691 C LYS A 47 -3.336 -8.045 -6.663 1.00 0.00 C ATOM 692 O LYS A 47 -3.909 -6.965 -6.516 1.00 0.00 O ATOM 693 CB LYS A 47 -2.601 -8.675 -8.968 1.00 0.00 C ATOM 694 CG LYS A 47 -3.530 -7.714 -9.689 1.00 0.00 C ATOM 695 CD LYS A 47 -3.761 -8.136 -11.130 1.00 0.00 C ATOM 696 CE LYS A 47 -5.097 -7.627 -11.653 1.00 0.00 C ATOM 697 NZ LYS A 47 -6.197 -8.600 -11.402 1.00 0.00 N ATOM 0 H LYS A 47 -0.965 -9.909 -7.599 1.00 0.00 H new ATOM 0 HA LYS A 47 -1.685 -7.187 -7.716 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -1.727 -8.859 -9.592 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -3.109 -9.631 -8.841 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -4.485 -7.668 -9.165 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -3.105 -6.710 -9.667 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -2.955 -7.754 -11.756 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -3.732 -9.223 -11.201 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -5.336 -6.677 -11.175 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -5.019 -7.435 -12.723 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -7.090 -8.217 -11.772 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -5.981 -9.499 -11.879 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -6.289 -8.764 -10.379 1.00 0.00 H new ATOM 711 N GLU A 48 -3.706 -9.153 -6.029 1.00 0.00 N ATOM 712 CA GLU A 48 -4.835 -9.164 -5.105 1.00 0.00 C ATOM 713 C GLU A 48 -4.602 -8.193 -3.951 1.00 0.00 C ATOM 714 O GLU A 48 -5.542 -7.584 -3.440 1.00 0.00 O ATOM 715 CB GLU A 48 -5.063 -10.575 -4.561 1.00 0.00 C ATOM 716 CG GLU A 48 -3.792 -11.258 -4.086 1.00 0.00 C ATOM 717 CD GLU A 48 -4.068 -12.466 -3.214 1.00 0.00 C ATOM 718 OE1 GLU A 48 -5.041 -12.423 -2.430 1.00 0.00 O ATOM 719 OE2 GLU A 48 -3.313 -13.456 -3.314 1.00 0.00 O ATOM 0 H GLU A 48 -3.241 -10.054 -6.138 1.00 0.00 H new ATOM 0 HA GLU A 48 -5.723 -8.846 -5.651 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -5.770 -10.526 -3.733 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -5.524 -11.185 -5.338 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -3.205 -11.566 -4.951 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -3.187 -10.543 -3.528 1.00 0.00 H new ATOM 726 N ASP A 49 -3.345 -8.055 -3.547 1.00 0.00 N ATOM 727 CA ASP A 49 -2.987 -7.158 -2.454 1.00 0.00 C ATOM 728 C ASP A 49 -3.408 -5.725 -2.767 1.00 0.00 C ATOM 729 O ASP A 49 -3.890 -5.005 -1.893 1.00 0.00 O ATOM 730 CB ASP A 49 -1.482 -7.215 -2.191 1.00 0.00 C ATOM 731 CG ASP A 49 -1.131 -6.867 -0.757 1.00 0.00 C ATOM 732 OD1 ASP A 49 -2.048 -6.858 0.092 1.00 0.00 O ATOM 733 OD2 ASP A 49 0.058 -6.607 -0.483 1.00 0.00 O ATOM 0 H ASP A 49 -2.556 -8.553 -3.960 1.00 0.00 H new ATOM 0 HA ASP A 49 -3.516 -7.486 -1.559 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -1.114 -8.215 -2.420 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -0.972 -6.526 -2.864 1.00 0.00 H new ATOM 738 N ILE A 50 -3.221 -5.319 -4.018 1.00 0.00 N ATOM 739 CA ILE A 50 -3.581 -3.973 -4.446 1.00 0.00 C ATOM 740 C ILE A 50 -5.077 -3.726 -4.281 1.00 0.00 C ATOM 741 O ILE A 50 -5.490 -2.704 -3.728 1.00 0.00 O ATOM 742 CB ILE A 50 -3.190 -3.726 -5.914 1.00 0.00 C ATOM 743 CG1 ILE A 50 -1.697 -3.989 -6.119 1.00 0.00 C ATOM 744 CG2 ILE A 50 -3.542 -2.303 -6.324 1.00 0.00 C ATOM 745 CD1 ILE A 50 -0.825 -2.791 -5.817 1.00 0.00 C ATOM 0 H ILE A 50 -2.822 -5.903 -4.753 1.00 0.00 H new ATOM 0 HA ILE A 50 -3.029 -3.281 -3.810 1.00 0.00 H new ATOM 0 HB ILE A 50 -3.752 -4.416 -6.544 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -1.392 -4.820 -5.483 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -1.529 -4.299 -7.150 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -3.259 -2.144 -7.365 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -4.615 -2.147 -6.211 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -3.004 -1.598 -5.690 1.00 0.00 H new ATOM 0 HD11 ILE A 50 0.220 -3.051 -5.984 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -1.103 -1.965 -6.471 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -0.963 -2.493 -4.778 1.00 0.00 H new ATOM 757 N LEU A 51 -5.883 -4.665 -4.762 1.00 0.00 N ATOM 758 CA LEU A 51 -7.333 -4.550 -4.666 1.00 0.00 C ATOM 759 C LEU A 51 -7.792 -4.626 -3.213 1.00 0.00 C ATOM 760 O LEU A 51 -8.910 -4.236 -2.884 1.00 0.00 O ATOM 761 CB LEU A 51 -8.007 -5.655 -5.482 1.00 0.00 C ATOM 762 CG LEU A 51 -7.909 -5.520 -7.003 1.00 0.00 C ATOM 763 CD1 LEU A 51 -8.203 -6.851 -7.676 1.00 0.00 C ATOM 764 CD2 LEU A 51 -8.860 -4.444 -7.505 1.00 0.00 C ATOM 0 H LEU A 51 -5.557 -5.515 -5.223 1.00 0.00 H new ATOM 0 HA LEU A 51 -7.622 -3.579 -5.069 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -7.570 -6.611 -5.193 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -9.061 -5.691 -5.207 1.00 0.00 H new ATOM 0 HG LEU A 51 -6.891 -5.224 -7.258 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -8.129 -6.736 -8.757 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -7.482 -7.596 -7.340 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -9.210 -7.177 -7.414 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -8.777 -4.362 -8.589 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -9.883 -4.710 -7.239 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -8.602 -3.489 -7.048 1.00 0.00 H new ATOM 776 N ASN A 52 -6.917 -5.127 -2.348 1.00 0.00 N ATOM 777 CA ASN A 52 -7.230 -5.252 -0.929 1.00 0.00 C ATOM 778 C ASN A 52 -6.800 -4.004 -0.165 1.00 0.00 C ATOM 779 O ASN A 52 -7.263 -3.754 0.949 1.00 0.00 O ATOM 780 CB ASN A 52 -6.543 -6.485 -0.339 1.00 0.00 C ATOM 781 CG ASN A 52 -7.120 -7.781 -0.878 1.00 0.00 C ATOM 782 OD1 ASN A 52 -8.239 -7.810 -1.390 1.00 0.00 O ATOM 783 ND2 ASN A 52 -6.356 -8.861 -0.763 1.00 0.00 N ATOM 0 H ASN A 52 -5.985 -5.453 -2.605 1.00 0.00 H new ATOM 0 HA ASN A 52 -8.310 -5.364 -0.830 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -5.477 -6.445 -0.561 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -6.643 -6.469 0.746 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -6.691 -9.761 -1.106 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -5.435 -8.790 -0.331 1.00 0.00 H new ATOM 790 N TYR A 53 -5.913 -3.222 -0.771 1.00 0.00 N ATOM 791 CA TYR A 53 -5.419 -2.000 -0.148 1.00 0.00 C ATOM 792 C TYR A 53 -6.372 -0.836 -0.401 1.00 0.00 C ATOM 793 O TYR A 53 -6.430 0.116 0.381 1.00 0.00 O ATOM 794 CB TYR A 53 -4.026 -1.658 -0.680 1.00 0.00 C ATOM 795 CG TYR A 53 -3.515 -0.312 -0.219 1.00 0.00 C ATOM 796 CD1 TYR A 53 -4.088 0.866 -0.683 1.00 0.00 C ATOM 797 CD2 TYR A 53 -2.459 -0.217 0.679 1.00 0.00 C ATOM 798 CE1 TYR A 53 -3.625 2.099 -0.266 1.00 0.00 C ATOM 799 CE2 TYR A 53 -1.990 1.012 1.102 1.00 0.00 C ATOM 800 CZ TYR A 53 -2.577 2.166 0.628 1.00 0.00 C ATOM 801 OH TYR A 53 -2.111 3.392 1.046 1.00 0.00 O ATOM 0 H TYR A 53 -5.521 -3.413 -1.693 1.00 0.00 H new ATOM 0 HA TYR A 53 -5.358 -2.170 0.927 1.00 0.00 H new ATOM 0 HB2 TYR A 53 -3.326 -2.431 -0.363 1.00 0.00 H new ATOM 0 HB3 TYR A 53 -4.048 -1.675 -1.770 1.00 0.00 H new ATOM 0 HD1 TYR A 53 -4.910 0.817 -1.382 1.00 0.00 H new ATOM 0 HD2 TYR A 53 -1.997 -1.119 1.053 1.00 0.00 H new ATOM 0 HE1 TYR A 53 -4.081 3.005 -0.638 1.00 0.00 H new ATOM 0 HE2 TYR A 53 -1.168 1.068 1.800 1.00 0.00 H new ATOM 0 HH TYR A 53 -1.371 3.263 1.676 1.00 0.00 H new ATOM 811 N LEU A 54 -7.117 -0.918 -1.496 1.00 0.00 N ATOM 812 CA LEU A 54 -8.070 0.128 -1.853 1.00 0.00 C ATOM 813 C LEU A 54 -9.384 -0.051 -1.100 1.00 0.00 C ATOM 814 O LEU A 54 -9.997 0.922 -0.661 1.00 0.00 O ATOM 815 CB LEU A 54 -8.328 0.117 -3.361 1.00 0.00 C ATOM 816 CG LEU A 54 -7.176 0.601 -4.243 1.00 0.00 C ATOM 817 CD1 LEU A 54 -7.352 0.104 -5.670 1.00 0.00 C ATOM 818 CD2 LEU A 54 -7.082 2.118 -4.212 1.00 0.00 C ATOM 0 H LEU A 54 -7.081 -1.697 -2.153 1.00 0.00 H new ATOM 0 HA LEU A 54 -7.639 1.089 -1.571 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -8.584 -0.900 -3.658 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -9.201 0.738 -3.565 1.00 0.00 H new ATOM 0 HG LEU A 54 -6.245 0.192 -3.850 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -6.523 0.458 -6.283 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -7.369 -0.986 -5.676 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -8.290 0.483 -6.074 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -6.257 2.444 -4.845 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -8.014 2.548 -4.580 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -6.908 2.451 -3.189 1.00 0.00 H new ATOM 830 N GLU A 55 -9.810 -1.302 -0.952 1.00 0.00 N ATOM 831 CA GLU A 55 -11.051 -1.608 -0.250 1.00 0.00 C ATOM 832 C GLU A 55 -11.044 -1.007 1.152 1.00 0.00 C ATOM 833 O GLU A 55 -12.097 -0.726 1.725 1.00 0.00 O ATOM 834 CB GLU A 55 -11.255 -3.123 -0.167 1.00 0.00 C ATOM 835 CG GLU A 55 -10.344 -3.806 0.839 1.00 0.00 C ATOM 836 CD GLU A 55 -10.949 -5.076 1.404 1.00 0.00 C ATOM 837 OE1 GLU A 55 -11.895 -4.975 2.213 1.00 0.00 O ATOM 838 OE2 GLU A 55 -10.475 -6.172 1.037 1.00 0.00 O ATOM 0 H GLU A 55 -9.314 -2.119 -1.309 1.00 0.00 H new ATOM 0 HA GLU A 55 -11.875 -1.168 -0.811 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -12.292 -3.327 0.098 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -11.086 -3.558 -1.152 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -9.393 -4.042 0.361 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -10.128 -3.116 1.655 1.00 0.00 H new ATOM 845 N LYS A 56 -9.850 -0.814 1.701 1.00 0.00 N ATOM 846 CA LYS A 56 -9.703 -0.246 3.036 1.00 0.00 C ATOM 847 C LYS A 56 -9.896 1.267 3.009 1.00 0.00 C ATOM 848 O LYS A 56 -10.200 1.881 4.031 1.00 0.00 O ATOM 849 CB LYS A 56 -8.326 -0.585 3.609 1.00 0.00 C ATOM 850 CG LYS A 56 -8.006 -2.070 3.587 1.00 0.00 C ATOM 851 CD LYS A 56 -6.728 -2.376 4.350 1.00 0.00 C ATOM 852 CE LYS A 56 -6.321 -3.834 4.193 1.00 0.00 C ATOM 853 NZ LYS A 56 -5.067 -4.143 4.935 1.00 0.00 N ATOM 0 H LYS A 56 -8.969 -1.043 1.241 1.00 0.00 H new ATOM 0 HA LYS A 56 -10.472 -0.681 3.674 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -7.564 -0.049 3.042 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -8.271 -0.225 4.636 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -8.834 -2.628 4.024 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -7.904 -2.406 2.555 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -5.925 -1.732 3.991 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -6.870 -2.148 5.406 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -7.124 -4.476 4.554 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -6.183 -4.061 3.136 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -4.824 -5.145 4.803 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -4.294 -3.548 4.573 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -5.207 -3.951 5.948 1.00 0.00 H new ATOM 867 N GLN A 57 -9.719 1.860 1.832 1.00 0.00 N ATOM 868 CA GLN A 57 -9.874 3.300 1.672 1.00 0.00 C ATOM 869 C GLN A 57 -11.345 3.701 1.740 1.00 0.00 C ATOM 870 O GLN A 57 -11.764 4.413 2.654 1.00 0.00 O ATOM 871 CB GLN A 57 -9.271 3.755 0.342 1.00 0.00 C ATOM 872 CG GLN A 57 -7.904 3.156 0.058 1.00 0.00 C ATOM 873 CD GLN A 57 -6.825 3.703 0.971 1.00 0.00 C ATOM 874 OE1 GLN A 57 -6.563 4.906 0.991 1.00 0.00 O ATOM 875 NE2 GLN A 57 -6.192 2.820 1.735 1.00 0.00 N ATOM 0 H GLN A 57 -9.468 1.365 0.976 1.00 0.00 H new ATOM 0 HA GLN A 57 -9.344 3.789 2.490 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -9.951 3.487 -0.466 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -9.189 4.842 0.342 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -7.956 2.073 0.171 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -7.633 3.355 -0.979 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -6.441 1.832 1.686 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -5.457 3.130 2.370 1.00 0.00 H new ATOM 884 N THR A 58 -12.125 3.238 0.768 1.00 0.00 N ATOM 885 CA THR A 58 -13.547 3.549 0.717 1.00 0.00 C ATOM 886 C THR A 58 -13.824 4.950 1.250 1.00 0.00 C ATOM 887 O THR A 58 -14.861 5.198 1.864 1.00 0.00 O ATOM 888 CB THR A 58 -14.374 2.532 1.526 1.00 0.00 C ATOM 889 OG1 THR A 58 -14.247 2.800 2.927 1.00 0.00 O ATOM 890 CG2 THR A 58 -13.919 1.110 1.234 1.00 0.00 C ATOM 0 H THR A 58 -11.795 2.646 0.006 1.00 0.00 H new ATOM 0 HA THR A 58 -13.844 3.497 -0.331 1.00 0.00 H new ATOM 0 HB THR A 58 -15.419 2.631 1.231 1.00 0.00 H new ATOM 0 HG1 THR A 58 -14.749 3.611 3.152 1.00 0.00 H new ATOM 0 HG21 THR A 58 -14.517 0.410 1.817 1.00 0.00 H new ATOM 0 HG22 THR A 58 -14.045 0.899 0.172 1.00 0.00 H new ATOM 0 HG23 THR A 58 -12.868 1.001 1.504 1.00 0.00 H new ATOM 898 N GLY A 59 -12.889 5.865 1.011 1.00 0.00 N ATOM 899 CA GLY A 59 -13.052 7.231 1.473 1.00 0.00 C ATOM 900 C GLY A 59 -12.409 8.239 0.541 1.00 0.00 C ATOM 901 O GLY A 59 -12.999 9.273 0.233 1.00 0.00 O ATOM 0 H GLY A 59 -12.022 5.684 0.506 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -14.115 7.455 1.568 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -12.615 7.330 2.467 1.00 0.00 H new ATOM 905 N ALA A 60 -11.195 7.937 0.092 1.00 0.00 N ATOM 906 CA ALA A 60 -10.472 8.825 -0.810 1.00 0.00 C ATOM 907 C ALA A 60 -11.362 9.282 -1.960 1.00 0.00 C ATOM 908 O ALA A 60 -12.431 8.718 -2.192 1.00 0.00 O ATOM 909 CB ALA A 60 -9.227 8.133 -1.345 1.00 0.00 C ATOM 0 H ALA A 60 -10.692 7.085 0.338 1.00 0.00 H new ATOM 0 HA ALA A 60 -10.170 9.708 -0.247 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -8.696 8.807 -2.017 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -8.576 7.862 -0.514 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -9.516 7.233 -1.888 1.00 0.00 H new ATOM 915 N ILE A 61 -10.915 10.308 -2.676 1.00 0.00 N ATOM 916 CA ILE A 61 -11.671 10.840 -3.803 1.00 0.00 C ATOM 917 C ILE A 61 -11.844 9.790 -4.895 1.00 0.00 C ATOM 918 O ILE A 61 -11.187 9.847 -5.935 1.00 0.00 O ATOM 919 CB ILE A 61 -10.987 12.082 -4.404 1.00 0.00 C ATOM 920 CG1 ILE A 61 -9.469 11.895 -4.425 1.00 0.00 C ATOM 921 CG2 ILE A 61 -11.361 13.328 -3.615 1.00 0.00 C ATOM 922 CD1 ILE A 61 -8.777 12.686 -5.514 1.00 0.00 C ATOM 0 H ILE A 61 -10.033 10.788 -2.496 1.00 0.00 H new ATOM 0 HA ILE A 61 -12.650 11.125 -3.419 1.00 0.00 H new ATOM 0 HB ILE A 61 -11.334 12.208 -5.430 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -9.061 12.190 -3.458 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -9.243 10.837 -4.557 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -10.869 14.197 -4.053 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -12.441 13.468 -3.647 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -11.040 13.213 -2.580 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -7.703 12.505 -5.469 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -9.157 12.375 -6.487 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -8.972 13.749 -5.372 1.00 0.00 H new ATOM 934 N LEU A 62 -12.731 8.832 -4.652 1.00 0.00 N ATOM 935 CA LEU A 62 -12.992 7.768 -5.615 1.00 0.00 C ATOM 936 C LEU A 62 -14.372 7.159 -5.392 1.00 0.00 C ATOM 937 O LEU A 62 -14.889 7.124 -4.276 1.00 0.00 O ATOM 938 CB LEU A 62 -11.919 6.683 -5.510 1.00 0.00 C ATOM 939 CG LEU A 62 -12.176 5.583 -4.480 1.00 0.00 C ATOM 940 CD1 LEU A 62 -11.345 4.349 -4.799 1.00 0.00 C ATOM 941 CD2 LEU A 62 -11.872 6.084 -3.076 1.00 0.00 C ATOM 0 H LEU A 62 -13.282 8.770 -3.796 1.00 0.00 H new ATOM 0 HA LEU A 62 -12.964 8.201 -6.615 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -11.805 6.217 -6.489 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -10.969 7.161 -5.272 1.00 0.00 H new ATOM 0 HG LEU A 62 -13.230 5.309 -4.525 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -11.541 3.576 -4.055 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -11.612 3.977 -5.788 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -10.287 4.609 -4.782 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -12.061 5.287 -2.357 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -10.827 6.387 -3.016 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -12.511 6.937 -2.848 1.00 0.00 H new ATOM 953 N PRO A 63 -14.983 6.663 -6.478 1.00 0.00 N ATOM 954 CA PRO A 63 -16.309 6.042 -6.427 1.00 0.00 C ATOM 955 C PRO A 63 -16.293 4.700 -5.703 1.00 0.00 C ATOM 956 O PRO A 63 -15.342 3.925 -5.802 1.00 0.00 O ATOM 957 CB PRO A 63 -16.670 5.850 -7.903 1.00 0.00 C ATOM 958 CG PRO A 63 -15.358 5.771 -8.605 1.00 0.00 C ATOM 959 CD PRO A 63 -14.424 6.670 -7.841 1.00 0.00 C ATOM 0 HA PRO A 63 -17.024 6.653 -5.876 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -17.255 4.943 -8.053 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -17.269 6.681 -8.276 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -14.986 4.747 -8.623 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -15.450 6.095 -9.642 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -13.401 6.294 -7.858 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -14.401 7.676 -8.261 1.00 0.00 H new ATOM 967 N PRO A 64 -17.372 4.415 -4.958 1.00 0.00 N ATOM 968 CA PRO A 64 -17.506 3.165 -4.204 1.00 0.00 C ATOM 969 C PRO A 64 -17.695 1.956 -5.115 1.00 0.00 C ATOM 970 O PRO A 64 -16.994 0.953 -4.985 1.00 0.00 O ATOM 971 CB PRO A 64 -18.758 3.396 -3.354 1.00 0.00 C ATOM 972 CG PRO A 64 -19.549 4.406 -4.112 1.00 0.00 C ATOM 973 CD PRO A 64 -18.544 5.292 -4.795 1.00 0.00 C ATOM 0 HA PRO A 64 -16.613 2.943 -3.620 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -19.321 2.472 -3.219 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -18.500 3.760 -2.360 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -20.202 3.924 -4.839 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -20.187 4.983 -3.443 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -18.913 5.652 -5.755 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -18.308 6.170 -4.194 1.00 0.00 H new ATOM 981 N SER A 65 -18.648 2.059 -6.037 1.00 0.00 N ATOM 982 CA SER A 65 -18.931 0.973 -6.967 1.00 0.00 C ATOM 983 C SER A 65 -19.713 1.481 -8.174 1.00 0.00 C ATOM 984 O SER A 65 -20.150 2.631 -8.205 1.00 0.00 O ATOM 985 CB SER A 65 -19.717 -0.136 -6.265 1.00 0.00 C ATOM 986 OG SER A 65 -18.857 -0.973 -5.513 1.00 0.00 O ATOM 0 H SER A 65 -19.236 2.883 -6.159 1.00 0.00 H new ATOM 0 HA SER A 65 -17.980 0.570 -7.316 1.00 0.00 H new ATOM 0 HB2 SER A 65 -20.466 0.305 -5.608 1.00 0.00 H new ATOM 0 HB3 SER A 65 -20.253 -0.731 -7.005 1.00 0.00 H new ATOM 0 HG SER A 65 -18.030 -0.490 -5.306 1.00 0.00 H new ATOM 992 N GLY A 66 -19.887 0.614 -9.167 1.00 0.00 N ATOM 993 CA GLY A 66 -20.617 0.992 -10.363 1.00 0.00 C ATOM 994 C GLY A 66 -20.553 -0.070 -11.442 1.00 0.00 C ATOM 995 O GLY A 66 -20.005 0.146 -12.523 1.00 0.00 O ATOM 0 H GLY A 66 -19.535 -0.343 -9.164 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -21.659 1.180 -10.104 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -20.211 1.926 -10.752 1.00 0.00 H new ATOM 999 N PRO A 67 -21.121 -1.250 -11.151 1.00 0.00 N ATOM 1000 CA PRO A 67 -21.137 -2.374 -12.091 1.00 0.00 C ATOM 1001 C PRO A 67 -22.051 -2.118 -13.284 1.00 0.00 C ATOM 1002 O PRO A 67 -23.212 -1.744 -13.120 1.00 0.00 O ATOM 1003 CB PRO A 67 -21.673 -3.534 -11.247 1.00 0.00 C ATOM 1004 CG PRO A 67 -22.475 -2.883 -10.174 1.00 0.00 C ATOM 1005 CD PRO A 67 -21.791 -1.576 -9.880 1.00 0.00 C ATOM 0 HA PRO A 67 -20.153 -2.560 -12.521 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -22.286 -4.209 -11.845 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -20.860 -4.128 -10.829 1.00 0.00 H new ATOM 0 HG2 PRO A 67 -23.503 -2.721 -10.499 1.00 0.00 H new ATOM 0 HG3 PRO A 67 -22.517 -3.510 -9.284 1.00 0.00 H new ATOM 0 HD2 PRO A 67 -22.505 -0.804 -9.592 1.00 0.00 H new ATOM 0 HD3 PRO A 67 -21.077 -1.671 -9.062 1.00 0.00 H new ATOM 1013 N SER A 68 -21.520 -2.321 -14.485 1.00 0.00 N ATOM 1014 CA SER A 68 -22.287 -2.109 -15.708 1.00 0.00 C ATOM 1015 C SER A 68 -23.437 -3.107 -15.807 1.00 0.00 C ATOM 1016 O SER A 68 -23.312 -4.259 -15.390 1.00 0.00 O ATOM 1017 CB SER A 68 -21.381 -2.235 -16.933 1.00 0.00 C ATOM 1018 OG SER A 68 -20.466 -1.155 -17.003 1.00 0.00 O ATOM 0 H SER A 68 -20.561 -2.632 -14.638 1.00 0.00 H new ATOM 0 HA SER A 68 -22.703 -1.102 -15.676 1.00 0.00 H new ATOM 0 HB2 SER A 68 -20.834 -3.177 -16.890 1.00 0.00 H new ATOM 0 HB3 SER A 68 -21.989 -2.260 -17.838 1.00 0.00 H new ATOM 0 HG SER A 68 -19.897 -1.259 -17.794 1.00 0.00 H new ATOM 1024 N SER A 69 -24.558 -2.656 -16.361 1.00 0.00 N ATOM 1025 CA SER A 69 -25.731 -3.507 -16.513 1.00 0.00 C ATOM 1026 C SER A 69 -25.570 -4.450 -17.702 1.00 0.00 C ATOM 1027 O SER A 69 -25.588 -5.670 -17.548 1.00 0.00 O ATOM 1028 CB SER A 69 -26.987 -2.652 -16.694 1.00 0.00 C ATOM 1029 OG SER A 69 -27.162 -1.766 -15.602 1.00 0.00 O ATOM 0 H SER A 69 -24.678 -1.706 -16.712 1.00 0.00 H new ATOM 0 HA SER A 69 -25.833 -4.106 -15.608 1.00 0.00 H new ATOM 0 HB2 SER A 69 -26.913 -2.082 -17.620 1.00 0.00 H new ATOM 0 HB3 SER A 69 -27.860 -3.298 -16.786 1.00 0.00 H new ATOM 0 HG SER A 69 -27.970 -1.230 -15.742 1.00 0.00 H new ATOM 1035 N GLY A 70 -25.411 -3.873 -18.890 1.00 0.00 N ATOM 1036 CA GLY A 70 -25.249 -4.675 -20.088 1.00 0.00 C ATOM 1037 C GLY A 70 -26.571 -4.991 -20.759 1.00 0.00 C ATOM 1038 O GLY A 70 -26.703 -6.006 -21.440 1.00 0.00 O ATOM 0 H GLY A 70 -25.392 -2.865 -19.043 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -24.606 -4.146 -20.791 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -24.743 -5.606 -19.832 1.00 0.00 H new TER 1042 GLY A 70