USER MOD reduce.3.24.130724 H: found=0, std=0, add=664, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 653 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 21 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 70 THR OG1 : rot 110:sc= -2.23! USER MOD Set 2.1: A 6 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 13 HIS : no HD1:sc= 0 X(o=0,f=-0.0058) USER MOD Single : A 18 THR OG1 : rot -35:sc= 1.19 USER MOD Single : A 19 SER OG : rot 79:sc= 1.12 USER MOD Single : A 20 MET CE :methyl 164:sc= -0.0651 (180deg=-0.44) USER MOD Single : A 24 TYR OH : rot 165:sc= -1.34 USER MOD Single : A 30 MET CE :methyl -149:sc= -2.2 (180deg=-4.7!) USER MOD Single : A 41 GLN : amide:sc= 0.00535 X(o=0.0053,f=0) USER MOD Single : A 43 ASN : amide:sc= 0 K(o=0,f=-0.72) USER MOD Single : A 44 LYS NZ :NH3+ -117:sc= 0.0598 (180deg=-0.158) USER MOD Single : A 46 GLN : amide:sc= 0.646 K(o=0.65,f=-2.8!) USER MOD Single : A 47 GLN : amide:sc= -1.8! C(o=-1.8!,f=-6.9!) USER MOD Single : A 49 SER OG : rot -83:sc= 1.19 USER MOD Single : A 51 CYS SG : rot -60:sc= -1.02 USER MOD Single : A 52 LYS NZ :NH3+ -168:sc= 1.29 (180deg=1.2) USER MOD Single : A 54 GLN : amide:sc= -0.584 X(o=-0.58,f=-0.13) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 146:sc= 1.21 USER MOD Single : A 66 SER OG : rot 140:sc= -3.07! USER MOD Single : A 68 SER OG : rot 10:sc= 1.09 USER MOD Single : A 75 SER OG : rot -113:sc= 0.104 USER MOD Single : A 77 GLN : amide:sc= 0 X(o=0,f=-0.2) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ -144:sc= 1.26 (180deg=1.03) USER MOD Single : A 81 MET CE :methyl -157:sc= -0.268 (180deg=-0.982) USER MOD Single : A 82 MET CE :methyl -170:sc= -0.0175 (180deg=-0.203) USER MOD Single : A 88 SER OG : rot 90:sc= 1.08 USER MOD ----------------------------------------------------------------- ATOM 1 N ILE A 5 15.774 4.199 7.509 1.00 0.00 N ATOM 2 CA ILE A 5 16.128 3.819 6.153 1.00 0.00 C ATOM 3 C ILE A 5 15.391 4.701 5.156 1.00 0.00 C ATOM 4 O ILE A 5 14.635 5.595 5.551 1.00 0.00 O ATOM 5 CB ILE A 5 15.797 2.337 5.873 1.00 0.00 C ATOM 6 CG1 ILE A 5 14.310 2.058 6.130 1.00 0.00 C ATOM 7 CG2 ILE A 5 16.672 1.432 6.728 1.00 0.00 C ATOM 8 CD1 ILE A 5 13.880 0.652 5.767 1.00 0.00 C ATOM 0 HA ILE A 5 17.204 3.954 6.042 1.00 0.00 H new ATOM 0 HB ILE A 5 16.004 2.126 4.824 1.00 0.00 H new ATOM 0 HG12 ILE A 5 14.094 2.233 7.184 1.00 0.00 H new ATOM 0 HG13 ILE A 5 13.713 2.769 5.560 1.00 0.00 H new ATOM 0 HG21 ILE A 5 16.429 0.390 6.521 1.00 0.00 H new ATOM 0 HG22 ILE A 5 17.721 1.613 6.494 1.00 0.00 H new ATOM 0 HG23 ILE A 5 16.494 1.644 7.782 1.00 0.00 H new ATOM 0 HD11 ILE A 5 12.817 0.531 5.977 1.00 0.00 H new ATOM 0 HD12 ILE A 5 14.063 0.478 4.707 1.00 0.00 H new ATOM 0 HD13 ILE A 5 14.450 -0.066 6.356 1.00 0.00 H new ATOM 19 N SER A 6 15.612 4.462 3.874 1.00 0.00 N ATOM 20 CA SER A 6 14.939 5.224 2.843 1.00 0.00 C ATOM 21 C SER A 6 14.865 4.431 1.544 1.00 0.00 C ATOM 22 O SER A 6 15.773 3.661 1.221 1.00 0.00 O ATOM 23 CB SER A 6 15.661 6.556 2.609 1.00 0.00 C ATOM 24 OG SER A 6 14.988 7.340 1.638 1.00 0.00 O ATOM 0 H SER A 6 16.251 3.747 3.526 1.00 0.00 H new ATOM 0 HA SER A 6 13.922 5.428 3.179 1.00 0.00 H new ATOM 0 HB2 SER A 6 15.724 7.108 3.547 1.00 0.00 H new ATOM 0 HB3 SER A 6 16.683 6.366 2.282 1.00 0.00 H new ATOM 0 HG SER A 6 15.468 8.184 1.509 1.00 0.00 H new ATOM 30 N SER A 7 13.759 4.613 0.831 1.00 0.00 N ATOM 31 CA SER A 7 13.570 4.079 -0.514 1.00 0.00 C ATOM 32 C SER A 7 13.332 2.564 -0.525 1.00 0.00 C ATOM 33 O SER A 7 12.211 2.116 -0.744 1.00 0.00 O ATOM 34 CB SER A 7 14.755 4.442 -1.413 1.00 0.00 C ATOM 35 OG SER A 7 15.012 5.838 -1.376 1.00 0.00 O ATOM 0 H SER A 7 12.958 5.142 1.175 1.00 0.00 H new ATOM 0 HA SER A 7 12.667 4.544 -0.909 1.00 0.00 H new ATOM 0 HB2 SER A 7 15.642 3.897 -1.090 1.00 0.00 H new ATOM 0 HB3 SER A 7 14.547 4.134 -2.438 1.00 0.00 H new ATOM 0 HG SER A 7 15.774 6.046 -1.956 1.00 0.00 H new ATOM 41 N GLN A 8 14.374 1.778 -0.276 1.00 0.00 N ATOM 42 CA GLN A 8 14.299 0.327 -0.448 1.00 0.00 C ATOM 43 C GLN A 8 15.143 -0.400 0.591 1.00 0.00 C ATOM 44 O GLN A 8 15.957 0.212 1.284 1.00 0.00 O ATOM 45 CB GLN A 8 14.769 -0.075 -1.853 1.00 0.00 C ATOM 46 CG GLN A 8 13.848 0.383 -2.973 1.00 0.00 C ATOM 47 CD GLN A 8 14.382 0.029 -4.348 1.00 0.00 C ATOM 48 OE1 GLN A 8 14.109 -1.049 -4.878 1.00 0.00 O ATOM 49 NE2 GLN A 8 15.131 0.945 -4.942 1.00 0.00 N ATOM 0 H GLN A 8 15.280 2.118 0.045 1.00 0.00 H new ATOM 0 HA GLN A 8 13.256 0.038 -0.316 1.00 0.00 H new ATOM 0 HB2 GLN A 8 15.763 0.338 -2.023 1.00 0.00 H new ATOM 0 HB3 GLN A 8 14.863 -1.160 -1.896 1.00 0.00 H new ATOM 0 HG2 GLN A 8 12.866 -0.072 -2.840 1.00 0.00 H new ATOM 0 HG3 GLN A 8 13.711 1.462 -2.907 1.00 0.00 H new ATOM 0 HE21 GLN A 8 15.333 1.825 -4.467 1.00 0.00 H new ATOM 0 HE22 GLN A 8 15.506 0.771 -5.874 1.00 0.00 H new ATOM 58 N LEU A 9 14.935 -1.709 0.683 1.00 0.00 N ATOM 59 CA LEU A 9 15.678 -2.563 1.597 1.00 0.00 C ATOM 60 C LEU A 9 15.663 -3.995 1.063 1.00 0.00 C ATOM 61 O LEU A 9 14.625 -4.472 0.614 1.00 0.00 O ATOM 62 CB LEU A 9 15.040 -2.524 2.998 1.00 0.00 C ATOM 63 CG LEU A 9 16.009 -2.538 4.191 1.00 0.00 C ATOM 64 CD1 LEU A 9 16.763 -3.854 4.272 1.00 0.00 C ATOM 65 CD2 LEU A 9 16.982 -1.373 4.107 1.00 0.00 C ATOM 0 H LEU A 9 14.243 -2.207 0.123 1.00 0.00 H new ATOM 0 HA LEU A 9 16.705 -2.206 1.672 1.00 0.00 H new ATOM 0 HB2 LEU A 9 14.425 -1.627 3.068 1.00 0.00 H new ATOM 0 HB3 LEU A 9 14.370 -3.379 3.092 1.00 0.00 H new ATOM 0 HG LEU A 9 15.418 -2.432 5.100 1.00 0.00 H new ATOM 0 HD11 LEU A 9 17.440 -3.833 5.126 1.00 0.00 H new ATOM 0 HD12 LEU A 9 16.054 -4.673 4.391 1.00 0.00 H new ATOM 0 HD13 LEU A 9 17.337 -4.001 3.357 1.00 0.00 H new ATOM 0 HD21 LEU A 9 17.659 -1.402 4.961 1.00 0.00 H new ATOM 0 HD22 LEU A 9 17.558 -1.446 3.185 1.00 0.00 H new ATOM 0 HD23 LEU A 9 16.428 -0.435 4.115 1.00 0.00 H new ATOM 77 N GLY A 10 16.806 -4.667 1.090 1.00 0.00 N ATOM 78 CA GLY A 10 16.858 -6.050 0.646 1.00 0.00 C ATOM 79 C GLY A 10 17.853 -6.880 1.438 1.00 0.00 C ATOM 80 O GLY A 10 18.977 -7.102 0.982 1.00 0.00 O ATOM 0 H GLY A 10 17.695 -4.283 1.409 1.00 0.00 H new ATOM 0 HA2 GLY A 10 15.867 -6.494 0.736 1.00 0.00 H new ATOM 0 HA3 GLY A 10 17.126 -6.079 -0.410 1.00 0.00 H new ATOM 84 N PRO A 11 17.464 -7.361 2.631 1.00 0.00 N ATOM 85 CA PRO A 11 18.351 -8.156 3.486 1.00 0.00 C ATOM 86 C PRO A 11 18.512 -9.589 2.983 1.00 0.00 C ATOM 87 O PRO A 11 19.599 -10.165 3.047 1.00 0.00 O ATOM 88 CB PRO A 11 17.638 -8.139 4.839 1.00 0.00 C ATOM 89 CG PRO A 11 16.192 -7.982 4.508 1.00 0.00 C ATOM 90 CD PRO A 11 16.132 -7.165 3.243 1.00 0.00 C ATOM 0 HA PRO A 11 19.363 -7.753 3.515 1.00 0.00 H new ATOM 0 HB2 PRO A 11 17.819 -9.060 5.393 1.00 0.00 H new ATOM 0 HB3 PRO A 11 17.992 -7.318 5.462 1.00 0.00 H new ATOM 0 HG2 PRO A 11 15.718 -8.953 4.366 1.00 0.00 H new ATOM 0 HG3 PRO A 11 15.660 -7.483 5.318 1.00 0.00 H new ATOM 0 HD2 PRO A 11 15.335 -7.508 2.583 1.00 0.00 H new ATOM 0 HD3 PRO A 11 15.940 -6.113 3.455 1.00 0.00 H new ATOM 98 N ILE A 12 17.426 -10.150 2.470 1.00 0.00 N ATOM 99 CA ILE A 12 17.422 -11.522 1.992 1.00 0.00 C ATOM 100 C ILE A 12 16.803 -11.602 0.604 1.00 0.00 C ATOM 101 O ILE A 12 16.104 -10.688 0.172 1.00 0.00 O ATOM 102 CB ILE A 12 16.651 -12.460 2.945 1.00 0.00 C ATOM 103 CG1 ILE A 12 15.236 -11.928 3.201 1.00 0.00 C ATOM 104 CG2 ILE A 12 17.412 -12.631 4.252 1.00 0.00 C ATOM 105 CD1 ILE A 12 14.388 -12.840 4.060 1.00 0.00 C ATOM 0 H ILE A 12 16.531 -9.670 2.375 1.00 0.00 H new ATOM 0 HA ILE A 12 18.461 -11.849 1.952 1.00 0.00 H new ATOM 0 HB ILE A 12 16.562 -13.438 2.471 1.00 0.00 H new ATOM 0 HG12 ILE A 12 15.306 -10.952 3.682 1.00 0.00 H new ATOM 0 HG13 ILE A 12 14.736 -11.777 2.244 1.00 0.00 H new ATOM 0 HG21 ILE A 12 16.855 -13.295 4.913 1.00 0.00 H new ATOM 0 HG22 ILE A 12 18.393 -13.061 4.048 1.00 0.00 H new ATOM 0 HG23 ILE A 12 17.534 -11.660 4.732 1.00 0.00 H new ATOM 0 HD11 ILE A 12 13.402 -12.397 4.197 1.00 0.00 H new ATOM 0 HD12 ILE A 12 14.286 -13.809 3.571 1.00 0.00 H new ATOM 0 HD13 ILE A 12 14.865 -12.972 5.031 1.00 0.00 H new ATOM 116 N HIS A 13 17.078 -12.699 -0.080 1.00 0.00 N ATOM 117 CA HIS A 13 16.628 -12.899 -1.457 1.00 0.00 C ATOM 118 C HIS A 13 15.252 -13.590 -1.579 1.00 0.00 C ATOM 119 O HIS A 13 14.611 -13.433 -2.618 1.00 0.00 O ATOM 120 CB HIS A 13 17.669 -13.698 -2.241 1.00 0.00 C ATOM 121 CG HIS A 13 18.972 -12.980 -2.408 1.00 0.00 C ATOM 122 ND1 HIS A 13 20.157 -13.438 -1.879 1.00 0.00 N ATOM 123 CD2 HIS A 13 19.270 -11.830 -3.053 1.00 0.00 C ATOM 124 CE1 HIS A 13 21.127 -12.598 -2.190 1.00 0.00 C ATOM 125 NE2 HIS A 13 20.617 -11.611 -2.901 1.00 0.00 N ATOM 0 H HIS A 13 17.618 -13.478 0.298 1.00 0.00 H new ATOM 0 HA HIS A 13 16.511 -11.900 -1.876 1.00 0.00 H new ATOM 0 HB2 HIS A 13 17.848 -14.645 -1.731 1.00 0.00 H new ATOM 0 HB3 HIS A 13 17.266 -13.937 -3.225 1.00 0.00 H new ATOM 0 HD2 HIS A 13 18.576 -11.199 -3.589 1.00 0.00 H new ATOM 0 HE1 HIS A 13 22.165 -12.702 -1.909 1.00 0.00 H new ATOM 0 HE2 HIS A 13 21.137 -10.817 -3.276 1.00 0.00 H new ATOM 134 N PRO A 14 14.812 -14.428 -0.591 1.00 0.00 N ATOM 135 CA PRO A 14 13.445 -14.977 -0.547 1.00 0.00 C ATOM 136 C PRO A 14 12.336 -13.992 -0.964 1.00 0.00 C ATOM 137 O PRO A 14 12.571 -12.792 -1.084 1.00 0.00 O ATOM 138 CB PRO A 14 13.282 -15.336 0.927 1.00 0.00 C ATOM 139 CG PRO A 14 14.640 -15.731 1.379 1.00 0.00 C ATOM 140 CD PRO A 14 15.630 -15.018 0.489 1.00 0.00 C ATOM 0 HA PRO A 14 13.338 -15.801 -1.253 1.00 0.00 H new ATOM 0 HB2 PRO A 14 12.906 -14.489 1.500 1.00 0.00 H new ATOM 0 HB3 PRO A 14 12.570 -16.151 1.058 1.00 0.00 H new ATOM 0 HG2 PRO A 14 14.793 -15.457 2.423 1.00 0.00 H new ATOM 0 HG3 PRO A 14 14.769 -16.811 1.311 1.00 0.00 H new ATOM 0 HD2 PRO A 14 16.173 -14.249 1.038 1.00 0.00 H new ATOM 0 HD3 PRO A 14 16.372 -15.709 0.090 1.00 0.00 H new ATOM 148 N PRO A 15 11.102 -14.505 -1.171 1.00 0.00 N ATOM 149 CA PRO A 15 9.934 -13.708 -1.579 1.00 0.00 C ATOM 150 C PRO A 15 9.807 -12.365 -0.842 1.00 0.00 C ATOM 151 O PRO A 15 10.257 -12.210 0.299 1.00 0.00 O ATOM 152 CB PRO A 15 8.736 -14.616 -1.235 1.00 0.00 C ATOM 153 CG PRO A 15 9.310 -15.836 -0.588 1.00 0.00 C ATOM 154 CD PRO A 15 10.738 -15.916 -1.034 1.00 0.00 C ATOM 0 HA PRO A 15 10.005 -13.432 -2.631 1.00 0.00 H new ATOM 0 HB2 PRO A 15 8.043 -14.109 -0.564 1.00 0.00 H new ATOM 0 HB3 PRO A 15 8.176 -14.878 -2.133 1.00 0.00 H new ATOM 0 HG2 PRO A 15 9.245 -15.767 0.498 1.00 0.00 H new ATOM 0 HG3 PRO A 15 8.759 -16.729 -0.884 1.00 0.00 H new ATOM 0 HD2 PRO A 15 11.364 -16.428 -0.303 1.00 0.00 H new ATOM 0 HD3 PRO A 15 10.840 -16.456 -1.976 1.00 0.00 H new ATOM 162 N PRO A 16 9.153 -11.382 -1.490 1.00 0.00 N ATOM 163 CA PRO A 16 9.018 -10.005 -0.982 1.00 0.00 C ATOM 164 C PRO A 16 8.109 -9.886 0.241 1.00 0.00 C ATOM 165 O PRO A 16 7.499 -8.843 0.464 1.00 0.00 O ATOM 166 CB PRO A 16 8.399 -9.258 -2.163 1.00 0.00 C ATOM 167 CG PRO A 16 7.653 -10.301 -2.901 1.00 0.00 C ATOM 168 CD PRO A 16 8.497 -11.536 -2.800 1.00 0.00 C ATOM 0 HA PRO A 16 9.979 -9.616 -0.646 1.00 0.00 H new ATOM 0 HB2 PRO A 16 7.739 -8.459 -1.827 1.00 0.00 H new ATOM 0 HB3 PRO A 16 9.164 -8.798 -2.788 1.00 0.00 H new ATOM 0 HG2 PRO A 16 6.667 -10.462 -2.466 1.00 0.00 H new ATOM 0 HG3 PRO A 16 7.499 -10.013 -3.941 1.00 0.00 H new ATOM 0 HD2 PRO A 16 7.893 -12.442 -2.845 1.00 0.00 H new ATOM 0 HD3 PRO A 16 9.223 -11.596 -3.611 1.00 0.00 H new ATOM 176 N ARG A 17 8.024 -10.950 1.022 1.00 0.00 N ATOM 177 CA ARG A 17 7.275 -10.937 2.269 1.00 0.00 C ATOM 178 C ARG A 17 8.117 -10.305 3.364 1.00 0.00 C ATOM 179 O ARG A 17 7.602 -9.829 4.374 1.00 0.00 O ATOM 180 CB ARG A 17 6.873 -12.362 2.666 1.00 0.00 C ATOM 181 CG ARG A 17 8.010 -13.364 2.558 1.00 0.00 C ATOM 182 CD ARG A 17 7.617 -14.725 3.109 1.00 0.00 C ATOM 183 NE ARG A 17 6.401 -15.255 2.487 1.00 0.00 N ATOM 184 CZ ARG A 17 5.734 -16.313 2.951 1.00 0.00 C ATOM 185 NH1 ARG A 17 6.187 -16.970 4.011 1.00 0.00 N ATOM 186 NH2 ARG A 17 4.620 -16.718 2.354 1.00 0.00 N ATOM 0 H ARG A 17 8.469 -11.843 0.812 1.00 0.00 H new ATOM 0 HA ARG A 17 6.367 -10.349 2.131 1.00 0.00 H new ATOM 0 HB2 ARG A 17 6.502 -12.354 3.691 1.00 0.00 H new ATOM 0 HB3 ARG A 17 6.049 -12.689 2.031 1.00 0.00 H new ATOM 0 HG2 ARG A 17 8.306 -13.466 1.514 1.00 0.00 H new ATOM 0 HG3 ARG A 17 8.878 -12.989 3.101 1.00 0.00 H new ATOM 0 HD2 ARG A 17 8.436 -15.427 2.952 1.00 0.00 H new ATOM 0 HD3 ARG A 17 7.466 -14.647 4.186 1.00 0.00 H new ATOM 0 HE ARG A 17 6.045 -14.789 1.653 1.00 0.00 H new ATOM 0 HH11 ARG A 17 7.045 -16.666 4.471 1.00 0.00 H new ATOM 0 HH12 ARG A 17 5.677 -17.779 4.366 1.00 0.00 H new ATOM 0 HH21 ARG A 17 4.270 -16.220 1.536 1.00 0.00 H new ATOM 0 HH22 ARG A 17 4.114 -17.528 2.713 1.00 0.00 H new ATOM 200 N THR A 18 9.423 -10.297 3.139 1.00 0.00 N ATOM 201 CA THR A 18 10.364 -9.710 4.074 1.00 0.00 C ATOM 202 C THR A 18 11.692 -9.420 3.369 1.00 0.00 C ATOM 203 O THR A 18 12.728 -9.229 4.004 1.00 0.00 O ATOM 204 CB THR A 18 10.575 -10.646 5.286 1.00 0.00 C ATOM 205 OG1 THR A 18 11.566 -10.122 6.183 1.00 0.00 O ATOM 206 CG2 THR A 18 10.981 -12.039 4.829 1.00 0.00 C ATOM 0 H THR A 18 9.856 -10.696 2.306 1.00 0.00 H new ATOM 0 HA THR A 18 9.957 -8.768 4.442 1.00 0.00 H new ATOM 0 HB THR A 18 9.626 -10.709 5.818 1.00 0.00 H new ATOM 0 HG1 THR A 18 12.260 -9.658 5.669 1.00 0.00 H new ATOM 0 HG21 THR A 18 11.124 -12.680 5.699 1.00 0.00 H new ATOM 0 HG22 THR A 18 10.199 -12.456 4.195 1.00 0.00 H new ATOM 0 HG23 THR A 18 11.912 -11.980 4.265 1.00 0.00 H new ATOM 214 N SER A 19 11.640 -9.375 2.045 1.00 0.00 N ATOM 215 CA SER A 19 12.822 -9.110 1.242 1.00 0.00 C ATOM 216 C SER A 19 12.859 -7.653 0.808 1.00 0.00 C ATOM 217 O SER A 19 13.255 -6.781 1.585 1.00 0.00 O ATOM 218 CB SER A 19 12.853 -10.048 0.026 1.00 0.00 C ATOM 219 OG SER A 19 13.900 -9.717 -0.868 1.00 0.00 O ATOM 0 H SER A 19 10.787 -9.519 1.504 1.00 0.00 H new ATOM 0 HA SER A 19 13.709 -9.300 1.847 1.00 0.00 H new ATOM 0 HB2 SER A 19 12.976 -11.077 0.364 1.00 0.00 H new ATOM 0 HB3 SER A 19 11.898 -9.996 -0.497 1.00 0.00 H new ATOM 0 HG SER A 19 14.749 -10.060 -0.519 1.00 0.00 H new ATOM 225 N MET A 20 12.431 -7.396 -0.421 1.00 0.00 N ATOM 226 CA MET A 20 12.374 -6.045 -0.953 1.00 0.00 C ATOM 227 C MET A 20 11.364 -5.205 -0.180 1.00 0.00 C ATOM 228 O MET A 20 10.181 -5.145 -0.517 1.00 0.00 O ATOM 229 CB MET A 20 12.037 -6.061 -2.451 1.00 0.00 C ATOM 230 CG MET A 20 10.845 -6.934 -2.807 1.00 0.00 C ATOM 231 SD MET A 20 10.353 -6.782 -4.534 1.00 0.00 S ATOM 232 CE MET A 20 11.845 -7.329 -5.359 1.00 0.00 C ATOM 0 H MET A 20 12.116 -8.115 -1.072 1.00 0.00 H new ATOM 0 HA MET A 20 13.358 -5.591 -0.834 1.00 0.00 H new ATOM 0 HB2 MET A 20 11.838 -5.041 -2.779 1.00 0.00 H new ATOM 0 HB3 MET A 20 12.908 -6.410 -3.005 1.00 0.00 H new ATOM 0 HG2 MET A 20 11.088 -7.975 -2.594 1.00 0.00 H new ATOM 0 HG3 MET A 20 10.002 -6.666 -2.170 1.00 0.00 H new ATOM 0 HE1 MET A 20 11.620 -7.564 -6.399 1.00 0.00 H new ATOM 0 HE2 MET A 20 12.594 -6.538 -5.319 1.00 0.00 H new ATOM 0 HE3 MET A 20 12.231 -8.219 -4.861 1.00 0.00 H new ATOM 242 N THR A 21 11.842 -4.582 0.875 1.00 0.00 N ATOM 243 CA THR A 21 11.026 -3.705 1.676 1.00 0.00 C ATOM 244 C THR A 21 11.181 -2.287 1.161 1.00 0.00 C ATOM 245 O THR A 21 12.256 -1.705 1.251 1.00 0.00 O ATOM 246 CB THR A 21 11.459 -3.776 3.152 1.00 0.00 C ATOM 247 OG1 THR A 21 11.477 -5.146 3.578 1.00 0.00 O ATOM 248 CG2 THR A 21 10.523 -2.966 4.040 1.00 0.00 C ATOM 0 H THR A 21 12.805 -4.671 1.199 1.00 0.00 H new ATOM 0 HA THR A 21 9.983 -4.013 1.607 1.00 0.00 H new ATOM 0 HB THR A 21 12.458 -3.349 3.241 1.00 0.00 H new ATOM 0 HG1 THR A 21 11.754 -5.193 4.517 1.00 0.00 H new ATOM 0 HG21 THR A 21 10.854 -3.035 5.076 1.00 0.00 H new ATOM 0 HG22 THR A 21 10.534 -1.923 3.724 1.00 0.00 H new ATOM 0 HG23 THR A 21 9.510 -3.360 3.956 1.00 0.00 H new ATOM 256 N GLU A 22 10.121 -1.731 0.614 1.00 0.00 N ATOM 257 CA GLU A 22 10.198 -0.398 0.058 1.00 0.00 C ATOM 258 C GLU A 22 9.714 0.605 1.090 1.00 0.00 C ATOM 259 O GLU A 22 8.571 0.539 1.536 1.00 0.00 O ATOM 260 CB GLU A 22 9.366 -0.323 -1.233 1.00 0.00 C ATOM 261 CG GLU A 22 9.540 0.964 -2.033 1.00 0.00 C ATOM 262 CD GLU A 22 9.122 0.797 -3.485 1.00 0.00 C ATOM 263 OE1 GLU A 22 9.732 -0.038 -4.190 1.00 0.00 O ATOM 264 OE2 GLU A 22 8.170 1.474 -3.923 1.00 0.00 O ATOM 0 H GLU A 22 9.206 -2.176 0.543 1.00 0.00 H new ATOM 0 HA GLU A 22 11.230 -0.158 -0.196 1.00 0.00 H new ATOM 0 HB2 GLU A 22 9.631 -1.168 -1.869 1.00 0.00 H new ATOM 0 HB3 GLU A 22 8.313 -0.435 -0.977 1.00 0.00 H new ATOM 0 HG2 GLU A 22 8.949 1.757 -1.575 1.00 0.00 H new ATOM 0 HG3 GLU A 22 10.583 1.278 -1.990 1.00 0.00 H new ATOM 271 N GLU A 23 10.600 1.503 1.491 1.00 0.00 N ATOM 272 CA GLU A 23 10.235 2.558 2.416 1.00 0.00 C ATOM 273 C GLU A 23 9.913 3.792 1.601 1.00 0.00 C ATOM 274 O GLU A 23 10.814 4.478 1.108 1.00 0.00 O ATOM 275 CB GLU A 23 11.377 2.847 3.395 1.00 0.00 C ATOM 276 CG GLU A 23 10.950 3.652 4.615 1.00 0.00 C ATOM 277 CD GLU A 23 10.030 2.872 5.535 1.00 0.00 C ATOM 278 OE1 GLU A 23 8.810 2.840 5.277 1.00 0.00 O ATOM 279 OE2 GLU A 23 10.526 2.289 6.520 1.00 0.00 O ATOM 0 H GLU A 23 11.574 1.520 1.190 1.00 0.00 H new ATOM 0 HA GLU A 23 9.371 2.254 3.007 1.00 0.00 H new ATOM 0 HB2 GLU A 23 11.807 1.902 3.727 1.00 0.00 H new ATOM 0 HB3 GLU A 23 12.164 3.389 2.871 1.00 0.00 H new ATOM 0 HG2 GLU A 23 11.836 3.961 5.170 1.00 0.00 H new ATOM 0 HG3 GLU A 23 10.445 4.561 4.288 1.00 0.00 H new ATOM 286 N TYR A 24 8.638 4.070 1.449 1.00 0.00 N ATOM 287 CA TYR A 24 8.209 5.087 0.518 1.00 0.00 C ATOM 288 C TYR A 24 8.087 6.442 1.192 1.00 0.00 C ATOM 289 O TYR A 24 7.387 6.591 2.193 1.00 0.00 O ATOM 290 CB TYR A 24 6.878 4.692 -0.119 1.00 0.00 C ATOM 291 CG TYR A 24 6.837 4.943 -1.607 1.00 0.00 C ATOM 292 CD1 TYR A 24 7.341 6.117 -2.145 1.00 0.00 C ATOM 293 CD2 TYR A 24 6.310 3.997 -2.475 1.00 0.00 C ATOM 294 CE1 TYR A 24 7.315 6.346 -3.502 1.00 0.00 C ATOM 295 CE2 TYR A 24 6.280 4.219 -3.838 1.00 0.00 C ATOM 296 CZ TYR A 24 6.785 5.395 -4.345 1.00 0.00 C ATOM 297 OH TYR A 24 6.755 5.624 -5.699 1.00 0.00 O ATOM 0 H TYR A 24 7.883 3.608 1.956 1.00 0.00 H new ATOM 0 HA TYR A 24 8.968 5.169 -0.260 1.00 0.00 H new ATOM 0 HB2 TYR A 24 6.691 3.635 0.071 1.00 0.00 H new ATOM 0 HB3 TYR A 24 6.073 5.249 0.360 1.00 0.00 H new ATOM 0 HD1 TYR A 24 7.761 6.864 -1.488 1.00 0.00 H new ATOM 0 HD2 TYR A 24 5.917 3.072 -2.078 1.00 0.00 H new ATOM 0 HE1 TYR A 24 7.709 7.268 -3.904 1.00 0.00 H new ATOM 0 HE2 TYR A 24 5.863 3.475 -4.501 1.00 0.00 H new ATOM 0 HH TYR A 24 6.575 4.783 -6.169 1.00 0.00 H new ATOM 307 N ARG A 25 8.789 7.417 0.634 1.00 0.00 N ATOM 308 CA ARG A 25 8.689 8.788 1.093 1.00 0.00 C ATOM 309 C ARG A 25 7.459 9.438 0.494 1.00 0.00 C ATOM 310 O ARG A 25 7.329 9.542 -0.726 1.00 0.00 O ATOM 311 CB ARG A 25 9.926 9.590 0.699 1.00 0.00 C ATOM 312 CG ARG A 25 11.180 9.203 1.454 1.00 0.00 C ATOM 313 CD ARG A 25 12.298 10.193 1.181 1.00 0.00 C ATOM 314 NE ARG A 25 11.896 11.567 1.501 1.00 0.00 N ATOM 315 CZ ARG A 25 12.740 12.593 1.593 1.00 0.00 C ATOM 316 NH1 ARG A 25 14.044 12.405 1.399 1.00 0.00 N ATOM 317 NH2 ARG A 25 12.281 13.804 1.902 1.00 0.00 N ATOM 0 H ARG A 25 9.437 7.279 -0.142 1.00 0.00 H new ATOM 0 HA ARG A 25 8.613 8.778 2.180 1.00 0.00 H new ATOM 0 HB2 ARG A 25 10.104 9.462 -0.369 1.00 0.00 H new ATOM 0 HB3 ARG A 25 9.727 10.649 0.865 1.00 0.00 H new ATOM 0 HG2 ARG A 25 10.971 9.169 2.523 1.00 0.00 H new ATOM 0 HG3 ARG A 25 11.494 8.202 1.159 1.00 0.00 H new ATOM 0 HD2 ARG A 25 13.175 9.924 1.770 1.00 0.00 H new ATOM 0 HD3 ARG A 25 12.589 10.134 0.132 1.00 0.00 H new ATOM 0 HE ARG A 25 10.906 11.748 1.664 1.00 0.00 H new ATOM 0 HH11 ARG A 25 14.398 11.474 1.179 1.00 0.00 H new ATOM 0 HH12 ARG A 25 14.689 13.192 1.470 1.00 0.00 H new ATOM 0 HH21 ARG A 25 11.284 13.945 2.068 1.00 0.00 H new ATOM 0 HH22 ARG A 25 12.926 14.591 1.973 1.00 0.00 H new ATOM 331 N VAL A 26 6.554 9.860 1.348 1.00 0.00 N ATOM 332 CA VAL A 26 5.309 10.443 0.900 1.00 0.00 C ATOM 333 C VAL A 26 4.962 11.672 1.732 1.00 0.00 C ATOM 334 O VAL A 26 4.882 11.603 2.957 1.00 0.00 O ATOM 335 CB VAL A 26 4.164 9.401 0.946 1.00 0.00 C ATOM 336 CG1 VAL A 26 4.251 8.553 2.199 1.00 0.00 C ATOM 337 CG2 VAL A 26 2.806 10.076 0.861 1.00 0.00 C ATOM 0 H VAL A 26 6.658 9.810 2.362 1.00 0.00 H new ATOM 0 HA VAL A 26 5.433 10.758 -0.136 1.00 0.00 H new ATOM 0 HB VAL A 26 4.278 8.749 0.080 1.00 0.00 H new ATOM 0 HG11 VAL A 26 3.436 7.830 2.206 1.00 0.00 H new ATOM 0 HG12 VAL A 26 5.204 8.025 2.216 1.00 0.00 H new ATOM 0 HG13 VAL A 26 4.176 9.193 3.078 1.00 0.00 H new ATOM 0 HG21 VAL A 26 2.021 9.320 0.896 1.00 0.00 H new ATOM 0 HG22 VAL A 26 2.687 10.761 1.700 1.00 0.00 H new ATOM 0 HG23 VAL A 26 2.734 10.632 -0.074 1.00 0.00 H new ATOM 347 N PRO A 27 4.768 12.821 1.068 1.00 0.00 N ATOM 348 CA PRO A 27 4.389 14.062 1.738 1.00 0.00 C ATOM 349 C PRO A 27 3.040 13.910 2.425 1.00 0.00 C ATOM 350 O PRO A 27 2.132 13.260 1.903 1.00 0.00 O ATOM 351 CB PRO A 27 4.329 15.094 0.605 1.00 0.00 C ATOM 352 CG PRO A 27 4.205 14.299 -0.645 1.00 0.00 C ATOM 353 CD PRO A 27 4.890 12.988 -0.385 1.00 0.00 C ATOM 0 HA PRO A 27 5.089 14.353 2.522 1.00 0.00 H new ATOM 0 HB2 PRO A 27 3.480 15.766 0.730 1.00 0.00 H new ATOM 0 HB3 PRO A 27 5.226 15.714 0.590 1.00 0.00 H new ATOM 0 HG2 PRO A 27 3.158 14.145 -0.905 1.00 0.00 H new ATOM 0 HG3 PRO A 27 4.668 14.819 -1.483 1.00 0.00 H new ATOM 0 HD2 PRO A 27 4.411 12.171 -0.925 1.00 0.00 H new ATOM 0 HD3 PRO A 27 5.933 13.010 -0.700 1.00 0.00 H new ATOM 361 N ASP A 28 2.929 14.512 3.602 1.00 0.00 N ATOM 362 CA ASP A 28 1.820 14.249 4.517 1.00 0.00 C ATOM 363 C ASP A 28 0.453 14.558 3.903 1.00 0.00 C ATOM 364 O ASP A 28 -0.545 13.915 4.235 1.00 0.00 O ATOM 365 CB ASP A 28 2.017 15.028 5.821 1.00 0.00 C ATOM 366 CG ASP A 28 0.869 14.836 6.797 1.00 0.00 C ATOM 367 OD1 ASP A 28 0.598 13.682 7.199 1.00 0.00 O ATOM 368 OD2 ASP A 28 0.228 15.838 7.167 1.00 0.00 O ATOM 0 H ASP A 28 3.602 15.195 3.951 1.00 0.00 H new ATOM 0 HA ASP A 28 1.827 13.180 4.728 1.00 0.00 H new ATOM 0 HB2 ASP A 28 2.947 14.710 6.293 1.00 0.00 H new ATOM 0 HB3 ASP A 28 2.122 16.089 5.594 1.00 0.00 H new ATOM 373 N GLY A 29 0.395 15.524 3.004 1.00 0.00 N ATOM 374 CA GLY A 29 -0.854 15.805 2.324 1.00 0.00 C ATOM 375 C GLY A 29 -1.246 14.667 1.399 1.00 0.00 C ATOM 376 O GLY A 29 -2.418 14.286 1.305 1.00 0.00 O ATOM 0 H GLY A 29 1.181 16.115 2.733 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -1.642 15.967 3.059 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -0.759 16.727 1.750 1.00 0.00 H new ATOM 380 N MET A 30 -0.249 14.071 0.767 1.00 0.00 N ATOM 381 CA MET A 30 -0.490 13.046 -0.232 1.00 0.00 C ATOM 382 C MET A 30 -0.814 11.716 0.421 1.00 0.00 C ATOM 383 O MET A 30 -1.526 10.902 -0.155 1.00 0.00 O ATOM 384 CB MET A 30 0.713 12.897 -1.158 1.00 0.00 C ATOM 385 CG MET A 30 1.064 14.177 -1.903 1.00 0.00 C ATOM 386 SD MET A 30 -0.354 14.934 -2.725 1.00 0.00 S ATOM 387 CE MET A 30 -0.812 13.649 -3.887 1.00 0.00 C ATOM 0 H MET A 30 0.736 14.280 0.929 1.00 0.00 H new ATOM 0 HA MET A 30 -1.350 13.357 -0.826 1.00 0.00 H new ATOM 0 HB2 MET A 30 1.575 12.578 -0.573 1.00 0.00 H new ATOM 0 HB3 MET A 30 0.509 12.108 -1.882 1.00 0.00 H new ATOM 0 HG2 MET A 30 1.493 14.892 -1.201 1.00 0.00 H new ATOM 0 HG3 MET A 30 1.832 13.959 -2.645 1.00 0.00 H new ATOM 0 HE1 MET A 30 -1.243 14.102 -4.780 1.00 0.00 H new ATOM 0 HE2 MET A 30 0.073 13.075 -4.162 1.00 0.00 H new ATOM 0 HE3 MET A 30 -1.545 12.987 -3.427 1.00 0.00 H new ATOM 397 N VAL A 31 -0.309 11.487 1.627 1.00 0.00 N ATOM 398 CA VAL A 31 -0.686 10.287 2.360 1.00 0.00 C ATOM 399 C VAL A 31 -2.138 10.410 2.824 1.00 0.00 C ATOM 400 O VAL A 31 -2.858 9.418 2.937 1.00 0.00 O ATOM 401 CB VAL A 31 0.255 9.986 3.553 1.00 0.00 C ATOM 402 CG1 VAL A 31 0.231 11.102 4.577 1.00 0.00 C ATOM 403 CG2 VAL A 31 -0.106 8.657 4.197 1.00 0.00 C ATOM 0 H VAL A 31 0.348 12.101 2.109 1.00 0.00 H new ATOM 0 HA VAL A 31 -0.587 9.440 1.681 1.00 0.00 H new ATOM 0 HB VAL A 31 1.271 9.919 3.164 1.00 0.00 H new ATOM 0 HG11 VAL A 31 0.903 10.856 5.399 1.00 0.00 H new ATOM 0 HG12 VAL A 31 0.555 12.032 4.109 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -0.782 11.222 4.960 1.00 0.00 H new ATOM 0 HG21 VAL A 31 0.566 8.463 5.033 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -1.133 8.695 4.559 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -0.010 7.858 3.462 1.00 0.00 H new ATOM 413 N GLY A 32 -2.583 11.641 3.042 1.00 0.00 N ATOM 414 CA GLY A 32 -3.994 11.870 3.286 1.00 0.00 C ATOM 415 C GLY A 32 -4.821 11.534 2.058 1.00 0.00 C ATOM 416 O GLY A 32 -6.006 11.211 2.160 1.00 0.00 O ATOM 0 H GLY A 32 -1.999 12.477 3.054 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -4.324 11.262 4.128 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -4.154 12.912 3.563 1.00 0.00 H new ATOM 420 N LEU A 33 -4.196 11.620 0.889 1.00 0.00 N ATOM 421 CA LEU A 33 -4.847 11.226 -0.359 1.00 0.00 C ATOM 422 C LEU A 33 -4.703 9.726 -0.653 1.00 0.00 C ATOM 423 O LEU A 33 -5.573 9.146 -1.302 1.00 0.00 O ATOM 424 CB LEU A 33 -4.306 12.037 -1.544 1.00 0.00 C ATOM 425 CG LEU A 33 -5.008 13.363 -1.819 1.00 0.00 C ATOM 426 CD1 LEU A 33 -4.780 14.355 -0.689 1.00 0.00 C ATOM 427 CD2 LEU A 33 -4.543 13.946 -3.144 1.00 0.00 C ATOM 0 H LEU A 33 -3.240 11.958 0.777 1.00 0.00 H new ATOM 0 HA LEU A 33 -5.908 11.439 -0.228 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -3.249 12.237 -1.370 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -4.371 11.421 -2.441 1.00 0.00 H new ATOM 0 HG LEU A 33 -6.079 13.168 -1.880 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -5.293 15.289 -0.916 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -5.171 13.943 0.241 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -3.712 14.545 -0.581 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -5.054 14.892 -3.325 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -3.467 14.116 -3.109 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -4.775 13.249 -3.949 1.00 0.00 H new ATOM 439 N ILE A 34 -3.627 9.092 -0.182 1.00 0.00 N ATOM 440 CA ILE A 34 -3.407 7.666 -0.458 1.00 0.00 C ATOM 441 C ILE A 34 -4.450 6.830 0.274 1.00 0.00 C ATOM 442 O ILE A 34 -4.850 5.754 -0.178 1.00 0.00 O ATOM 443 CB ILE A 34 -1.979 7.183 -0.062 1.00 0.00 C ATOM 444 CG1 ILE A 34 -1.706 5.791 -0.630 1.00 0.00 C ATOM 445 CG2 ILE A 34 -1.792 7.153 1.443 1.00 0.00 C ATOM 446 CD1 ILE A 34 -1.610 5.764 -2.134 1.00 0.00 C ATOM 0 H ILE A 34 -2.903 9.533 0.384 1.00 0.00 H new ATOM 0 HA ILE A 34 -3.503 7.535 -1.536 1.00 0.00 H new ATOM 0 HB ILE A 34 -1.272 7.898 -0.484 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -0.776 5.411 -0.208 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -2.500 5.115 -0.312 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -0.784 6.811 1.678 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -1.939 8.154 1.848 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -2.519 6.472 1.886 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -1.415 4.745 -2.468 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -2.548 6.114 -2.565 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -0.797 6.414 -2.458 1.00 0.00 H new ATOM 457 N ILE A 35 -4.896 7.349 1.406 1.00 0.00 N ATOM 458 CA ILE A 35 -5.948 6.714 2.176 1.00 0.00 C ATOM 459 C ILE A 35 -7.324 7.091 1.644 1.00 0.00 C ATOM 460 O ILE A 35 -8.321 6.471 2.014 1.00 0.00 O ATOM 461 CB ILE A 35 -5.851 7.062 3.669 1.00 0.00 C ATOM 462 CG1 ILE A 35 -5.683 8.571 3.872 1.00 0.00 C ATOM 463 CG2 ILE A 35 -4.712 6.287 4.310 1.00 0.00 C ATOM 464 CD1 ILE A 35 -5.483 8.974 5.318 1.00 0.00 C ATOM 0 H ILE A 35 -4.542 8.215 1.813 1.00 0.00 H new ATOM 0 HA ILE A 35 -5.812 5.638 2.068 1.00 0.00 H new ATOM 0 HB ILE A 35 -6.781 6.772 4.157 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -4.829 8.914 3.287 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -6.563 9.081 3.481 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -4.650 6.540 5.368 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -4.894 5.218 4.202 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -3.774 6.547 3.820 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -5.372 10.056 5.382 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -6.347 8.663 5.905 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -4.586 8.493 5.709 1.00 0.00 H new ATOM 475 N GLY A 36 -7.360 8.123 0.799 1.00 0.00 N ATOM 476 CA GLY A 36 -8.589 8.547 0.141 1.00 0.00 C ATOM 477 C GLY A 36 -9.707 8.881 1.107 1.00 0.00 C ATOM 478 O GLY A 36 -9.808 10.008 1.592 1.00 0.00 O ATOM 0 H GLY A 36 -6.543 8.682 0.555 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -8.379 9.421 -0.475 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -8.924 7.756 -0.531 1.00 0.00 H new ATOM 482 N ARG A 37 -10.534 7.883 1.380 1.00 0.00 N ATOM 483 CA ARG A 37 -11.662 7.998 2.302 1.00 0.00 C ATOM 484 C ARG A 37 -11.217 8.275 3.740 1.00 0.00 C ATOM 485 O ARG A 37 -12.047 8.413 4.639 1.00 0.00 O ATOM 486 CB ARG A 37 -12.484 6.715 2.240 1.00 0.00 C ATOM 487 CG ARG A 37 -11.632 5.453 2.247 1.00 0.00 C ATOM 488 CD ARG A 37 -12.455 4.241 1.839 1.00 0.00 C ATOM 489 NE ARG A 37 -12.928 4.355 0.460 1.00 0.00 N ATOM 490 CZ ARG A 37 -13.814 3.533 -0.105 1.00 0.00 C ATOM 491 NH1 ARG A 37 -14.306 2.500 0.570 1.00 0.00 N ATOM 492 NH2 ARG A 37 -14.194 3.744 -1.359 1.00 0.00 N ATOM 0 H ARG A 37 -10.442 6.956 0.963 1.00 0.00 H new ATOM 0 HA ARG A 37 -12.266 8.851 1.993 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -13.168 6.688 3.089 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -13.096 6.727 1.338 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -10.791 5.573 1.564 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -11.215 5.296 3.242 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -11.853 3.339 1.945 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -13.308 4.136 2.510 1.00 0.00 H new ATOM 0 HE ARG A 37 -12.555 5.115 -0.109 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -14.007 2.329 1.530 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -14.983 1.878 0.128 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -13.809 4.530 -1.883 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -14.871 3.120 -1.799 1.00 0.00 H new ATOM 506 N GLY A 38 -9.913 8.347 3.958 1.00 0.00 N ATOM 507 CA GLY A 38 -9.403 8.742 5.254 1.00 0.00 C ATOM 508 C GLY A 38 -8.708 7.618 5.991 1.00 0.00 C ATOM 509 O GLY A 38 -8.408 7.742 7.178 1.00 0.00 O ATOM 0 H GLY A 38 -9.198 8.139 3.260 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -8.705 9.569 5.125 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -10.227 9.112 5.864 1.00 0.00 H new ATOM 513 N GLY A 39 -8.453 6.521 5.298 1.00 0.00 N ATOM 514 CA GLY A 39 -7.693 5.444 5.896 1.00 0.00 C ATOM 515 C GLY A 39 -8.075 4.083 5.355 1.00 0.00 C ATOM 516 O GLY A 39 -7.210 3.271 5.038 1.00 0.00 O ATOM 0 H GLY A 39 -8.756 6.356 4.338 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -6.631 5.614 5.720 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -7.843 5.456 6.976 1.00 0.00 H new ATOM 520 N GLU A 40 -9.374 3.847 5.237 1.00 0.00 N ATOM 521 CA GLU A 40 -9.899 2.548 4.821 1.00 0.00 C ATOM 522 C GLU A 40 -9.328 2.083 3.474 1.00 0.00 C ATOM 523 O GLU A 40 -9.151 0.883 3.258 1.00 0.00 O ATOM 524 CB GLU A 40 -11.420 2.621 4.730 1.00 0.00 C ATOM 525 CG GLU A 40 -12.090 1.288 4.456 1.00 0.00 C ATOM 526 CD GLU A 40 -13.497 1.457 3.931 1.00 0.00 C ATOM 527 OE1 GLU A 40 -14.344 2.023 4.648 1.00 0.00 O ATOM 528 OE2 GLU A 40 -13.754 1.053 2.779 1.00 0.00 O ATOM 0 H GLU A 40 -10.093 4.545 5.425 1.00 0.00 H new ATOM 0 HA GLU A 40 -9.593 1.819 5.571 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -11.810 3.026 5.664 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -11.693 3.321 3.940 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -11.498 0.727 3.732 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -12.114 0.699 5.373 1.00 0.00 H new ATOM 535 N GLN A 41 -9.031 3.026 2.577 1.00 0.00 N ATOM 536 CA GLN A 41 -8.630 2.668 1.216 1.00 0.00 C ATOM 537 C GLN A 41 -7.355 1.842 1.212 1.00 0.00 C ATOM 538 O GLN A 41 -7.288 0.806 0.554 1.00 0.00 O ATOM 539 CB GLN A 41 -8.430 3.902 0.340 1.00 0.00 C ATOM 540 CG GLN A 41 -8.328 3.571 -1.141 1.00 0.00 C ATOM 541 CD GLN A 41 -8.221 4.804 -2.012 1.00 0.00 C ATOM 542 OE1 GLN A 41 -9.228 5.347 -2.462 1.00 0.00 O ATOM 543 NE2 GLN A 41 -7.002 5.259 -2.245 1.00 0.00 N ATOM 0 H GLN A 41 -9.060 4.028 2.765 1.00 0.00 H new ATOM 0 HA GLN A 41 -9.444 2.073 0.803 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -9.261 4.590 0.496 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -7.524 4.420 0.654 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -7.457 2.937 -1.308 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -9.203 2.995 -1.441 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -6.194 4.777 -1.851 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -6.870 6.092 -2.818 1.00 0.00 H new ATOM 552 N ILE A 42 -6.344 2.290 1.952 1.00 0.00 N ATOM 553 CA ILE A 42 -5.080 1.574 1.973 1.00 0.00 C ATOM 554 C ILE A 42 -5.283 0.169 2.519 1.00 0.00 C ATOM 555 O ILE A 42 -4.770 -0.786 1.955 1.00 0.00 O ATOM 556 CB ILE A 42 -3.971 2.305 2.771 1.00 0.00 C ATOM 557 CG1 ILE A 42 -2.656 1.531 2.682 1.00 0.00 C ATOM 558 CG2 ILE A 42 -4.367 2.514 4.222 1.00 0.00 C ATOM 559 CD1 ILE A 42 -2.082 1.481 1.281 1.00 0.00 C ATOM 0 H ILE A 42 -6.376 3.128 2.532 1.00 0.00 H new ATOM 0 HA ILE A 42 -4.734 1.525 0.940 1.00 0.00 H new ATOM 0 HB ILE A 42 -3.835 3.289 2.323 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -1.927 1.990 3.349 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -2.817 0.513 3.037 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -3.563 3.029 4.748 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -5.275 3.115 4.268 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -4.547 1.548 4.693 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -1.149 0.917 1.290 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -2.794 0.995 0.613 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -1.889 2.495 0.930 1.00 0.00 H new ATOM 570 N ASN A 43 -6.078 0.046 3.583 1.00 0.00 N ATOM 571 CA ASN A 43 -6.360 -1.260 4.175 1.00 0.00 C ATOM 572 C ASN A 43 -7.021 -2.166 3.151 1.00 0.00 C ATOM 573 O ASN A 43 -6.733 -3.358 3.089 1.00 0.00 O ATOM 574 CB ASN A 43 -7.261 -1.138 5.409 1.00 0.00 C ATOM 575 CG ASN A 43 -6.619 -0.351 6.536 1.00 0.00 C ATOM 576 OD1 ASN A 43 -5.396 -0.340 6.685 1.00 0.00 O ATOM 577 ND2 ASN A 43 -7.439 0.304 7.346 1.00 0.00 N ATOM 0 H ASN A 43 -6.535 0.830 4.049 1.00 0.00 H new ATOM 0 HA ASN A 43 -5.410 -1.691 4.489 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -8.196 -0.656 5.123 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -7.513 -2.136 5.768 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -7.063 0.842 8.126 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -8.446 0.270 7.189 1.00 0.00 H new ATOM 584 N LYS A 44 -7.906 -1.593 2.345 1.00 0.00 N ATOM 585 CA LYS A 44 -8.545 -2.332 1.268 1.00 0.00 C ATOM 586 C LYS A 44 -7.496 -2.838 0.285 1.00 0.00 C ATOM 587 O LYS A 44 -7.478 -4.012 -0.060 1.00 0.00 O ATOM 588 CB LYS A 44 -9.567 -1.449 0.539 1.00 0.00 C ATOM 589 CG LYS A 44 -10.242 -2.133 -0.643 1.00 0.00 C ATOM 590 CD LYS A 44 -11.043 -3.352 -0.209 1.00 0.00 C ATOM 591 CE LYS A 44 -11.656 -4.071 -1.400 1.00 0.00 C ATOM 592 NZ LYS A 44 -10.622 -4.657 -2.295 1.00 0.00 N ATOM 0 H LYS A 44 -8.197 -0.618 2.418 1.00 0.00 H new ATOM 0 HA LYS A 44 -9.069 -3.185 1.699 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -10.332 -1.134 1.249 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -9.067 -0.547 0.187 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -10.901 -1.425 -1.145 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -9.486 -2.434 -1.369 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -10.396 -4.038 0.337 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -11.832 -3.044 0.477 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -12.317 -4.862 -1.044 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -12.271 -3.372 -1.967 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -10.678 -4.207 -3.231 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -9.679 -4.495 -1.889 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -10.786 -5.679 -2.392 1.00 0.00 H new ATOM 605 N ILE A 45 -6.613 -1.945 -0.134 1.00 0.00 N ATOM 606 CA ILE A 45 -5.584 -2.266 -1.116 1.00 0.00 C ATOM 607 C ILE A 45 -4.611 -3.323 -0.591 1.00 0.00 C ATOM 608 O ILE A 45 -4.385 -4.350 -1.233 1.00 0.00 O ATOM 609 CB ILE A 45 -4.794 -0.998 -1.506 1.00 0.00 C ATOM 610 CG1 ILE A 45 -5.747 0.063 -2.063 1.00 0.00 C ATOM 611 CG2 ILE A 45 -3.705 -1.331 -2.523 1.00 0.00 C ATOM 612 CD1 ILE A 45 -5.123 1.437 -2.187 1.00 0.00 C ATOM 0 H ILE A 45 -6.588 -0.980 0.195 1.00 0.00 H new ATOM 0 HA ILE A 45 -6.091 -2.668 -1.993 1.00 0.00 H new ATOM 0 HB ILE A 45 -4.311 -0.600 -0.614 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -6.099 -0.256 -3.044 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -6.622 0.128 -1.416 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -3.161 -0.423 -2.784 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -3.015 -2.057 -2.093 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -4.161 -1.751 -3.420 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -5.858 2.135 -2.588 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -4.796 1.778 -1.205 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -4.265 1.388 -2.858 1.00 0.00 H new ATOM 623 N GLN A 46 -4.056 -3.074 0.587 1.00 0.00 N ATOM 624 CA GLN A 46 -3.000 -3.920 1.130 1.00 0.00 C ATOM 625 C GLN A 46 -3.530 -5.275 1.602 1.00 0.00 C ATOM 626 O GLN A 46 -2.934 -6.311 1.310 1.00 0.00 O ATOM 627 CB GLN A 46 -2.254 -3.194 2.261 1.00 0.00 C ATOM 628 CG GLN A 46 -3.145 -2.636 3.356 1.00 0.00 C ATOM 629 CD GLN A 46 -2.948 -3.312 4.700 1.00 0.00 C ATOM 630 OE1 GLN A 46 -3.623 -4.284 5.029 1.00 0.00 O ATOM 631 NE2 GLN A 46 -2.021 -2.792 5.491 1.00 0.00 N ATOM 0 H GLN A 46 -4.319 -2.292 1.187 1.00 0.00 H new ATOM 0 HA GLN A 46 -2.296 -4.120 0.322 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -1.541 -3.886 2.710 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -1.677 -2.376 1.830 1.00 0.00 H new ATOM 0 HG2 GLN A 46 -2.951 -1.569 3.463 1.00 0.00 H new ATOM 0 HG3 GLN A 46 -4.187 -2.741 3.054 1.00 0.00 H new ATOM 0 HE21 GLN A 46 -1.481 -1.984 5.181 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -1.847 -3.200 6.410 1.00 0.00 H new ATOM 640 N GLN A 47 -4.659 -5.275 2.299 1.00 0.00 N ATOM 641 CA GLN A 47 -5.203 -6.505 2.868 1.00 0.00 C ATOM 642 C GLN A 47 -5.810 -7.386 1.777 1.00 0.00 C ATOM 643 O GLN A 47 -5.881 -8.609 1.913 1.00 0.00 O ATOM 644 CB GLN A 47 -6.244 -6.171 3.942 1.00 0.00 C ATOM 645 CG GLN A 47 -6.772 -7.371 4.718 1.00 0.00 C ATOM 646 CD GLN A 47 -5.700 -8.092 5.523 1.00 0.00 C ATOM 647 OE1 GLN A 47 -4.526 -8.118 5.149 1.00 0.00 O ATOM 648 NE2 GLN A 47 -6.093 -8.686 6.636 1.00 0.00 N ATOM 0 H GLN A 47 -5.216 -4.441 2.485 1.00 0.00 H new ATOM 0 HA GLN A 47 -4.390 -7.063 3.333 1.00 0.00 H new ATOM 0 HB2 GLN A 47 -5.804 -5.466 4.647 1.00 0.00 H new ATOM 0 HB3 GLN A 47 -7.085 -5.665 3.468 1.00 0.00 H new ATOM 0 HG2 GLN A 47 -7.561 -7.039 5.393 1.00 0.00 H new ATOM 0 HG3 GLN A 47 -7.226 -8.074 4.020 1.00 0.00 H new ATOM 0 HE21 GLN A 47 -7.073 -8.645 6.917 1.00 0.00 H new ATOM 0 HE22 GLN A 47 -5.417 -9.185 7.214 1.00 0.00 H new ATOM 657 N ASP A 48 -6.239 -6.763 0.691 1.00 0.00 N ATOM 658 CA ASP A 48 -6.805 -7.496 -0.433 1.00 0.00 C ATOM 659 C ASP A 48 -5.702 -8.187 -1.223 1.00 0.00 C ATOM 660 O ASP A 48 -5.741 -9.401 -1.435 1.00 0.00 O ATOM 661 CB ASP A 48 -7.582 -6.550 -1.344 1.00 0.00 C ATOM 662 CG ASP A 48 -8.307 -7.268 -2.464 1.00 0.00 C ATOM 663 OD1 ASP A 48 -7.678 -7.562 -3.498 1.00 0.00 O ATOM 664 OD2 ASP A 48 -9.520 -7.531 -2.310 1.00 0.00 O ATOM 0 H ASP A 48 -6.207 -5.752 0.563 1.00 0.00 H new ATOM 0 HA ASP A 48 -7.487 -8.252 -0.044 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -8.306 -5.994 -0.748 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -6.894 -5.821 -1.773 1.00 0.00 H new ATOM 669 N SER A 49 -4.709 -7.410 -1.638 1.00 0.00 N ATOM 670 CA SER A 49 -3.590 -7.939 -2.402 1.00 0.00 C ATOM 671 C SER A 49 -2.779 -8.930 -1.569 1.00 0.00 C ATOM 672 O SER A 49 -2.353 -9.973 -2.064 1.00 0.00 O ATOM 673 CB SER A 49 -2.699 -6.794 -2.886 1.00 0.00 C ATOM 674 OG SER A 49 -2.297 -5.967 -1.805 1.00 0.00 O ATOM 0 H SER A 49 -4.658 -6.408 -1.456 1.00 0.00 H new ATOM 0 HA SER A 49 -3.985 -8.471 -3.267 1.00 0.00 H new ATOM 0 HB2 SER A 49 -1.819 -7.200 -3.384 1.00 0.00 H new ATOM 0 HB3 SER A 49 -3.236 -6.198 -3.624 1.00 0.00 H new ATOM 0 HG SER A 49 -3.005 -5.319 -1.608 1.00 0.00 H new ATOM 680 N GLY A 50 -2.577 -8.602 -0.300 1.00 0.00 N ATOM 681 CA GLY A 50 -1.833 -9.474 0.585 1.00 0.00 C ATOM 682 C GLY A 50 -0.518 -8.863 1.019 1.00 0.00 C ATOM 683 O GLY A 50 0.306 -9.524 1.652 1.00 0.00 O ATOM 0 H GLY A 50 -2.917 -7.743 0.133 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -2.436 -9.696 1.465 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -1.642 -10.422 0.082 1.00 0.00 H new ATOM 687 N CYS A 51 -0.316 -7.600 0.674 1.00 0.00 N ATOM 688 CA CYS A 51 0.904 -6.897 1.034 1.00 0.00 C ATOM 689 C CYS A 51 0.729 -6.151 2.348 1.00 0.00 C ATOM 690 O CYS A 51 -0.277 -5.485 2.571 1.00 0.00 O ATOM 691 CB CYS A 51 1.307 -5.929 -0.075 1.00 0.00 C ATOM 692 SG CYS A 51 2.735 -4.888 0.314 1.00 0.00 S ATOM 0 H CYS A 51 -0.984 -7.041 0.144 1.00 0.00 H new ATOM 0 HA CYS A 51 1.697 -7.634 1.161 1.00 0.00 H new ATOM 0 HB2 CYS A 51 1.526 -6.501 -0.976 1.00 0.00 H new ATOM 0 HB3 CYS A 51 0.457 -5.286 -0.304 1.00 0.00 H new ATOM 0 HG CYS A 51 2.473 -4.167 1.363 1.00 0.00 H new ATOM 698 N LYS A 52 1.722 -6.267 3.206 1.00 0.00 N ATOM 699 CA LYS A 52 1.704 -5.617 4.498 1.00 0.00 C ATOM 700 C LYS A 52 2.169 -4.174 4.362 1.00 0.00 C ATOM 701 O LYS A 52 3.357 -3.874 4.471 1.00 0.00 O ATOM 702 CB LYS A 52 2.599 -6.388 5.464 1.00 0.00 C ATOM 703 CG LYS A 52 2.143 -7.821 5.678 1.00 0.00 C ATOM 704 CD LYS A 52 3.221 -8.655 6.343 1.00 0.00 C ATOM 705 CE LYS A 52 4.448 -8.779 5.456 1.00 0.00 C ATOM 706 NZ LYS A 52 5.541 -9.527 6.131 1.00 0.00 N ATOM 0 H LYS A 52 2.563 -6.815 3.026 1.00 0.00 H new ATOM 0 HA LYS A 52 0.687 -5.610 4.891 1.00 0.00 H new ATOM 0 HB2 LYS A 52 3.620 -6.390 5.082 1.00 0.00 H new ATOM 0 HB3 LYS A 52 2.619 -5.871 6.424 1.00 0.00 H new ATOM 0 HG2 LYS A 52 1.244 -7.829 6.294 1.00 0.00 H new ATOM 0 HG3 LYS A 52 1.877 -8.266 4.719 1.00 0.00 H new ATOM 0 HD2 LYS A 52 3.501 -8.201 7.293 1.00 0.00 H new ATOM 0 HD3 LYS A 52 2.830 -9.647 6.567 1.00 0.00 H new ATOM 0 HE2 LYS A 52 4.178 -9.286 4.530 1.00 0.00 H new ATOM 0 HE3 LYS A 52 4.802 -7.785 5.183 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 6.422 -9.419 5.589 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 5.677 -9.151 7.091 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 5.290 -10.535 6.186 1.00 0.00 H new ATOM 719 N VAL A 53 1.223 -3.293 4.083 1.00 0.00 N ATOM 720 CA VAL A 53 1.516 -1.878 3.931 1.00 0.00 C ATOM 721 C VAL A 53 1.267 -1.147 5.239 1.00 0.00 C ATOM 722 O VAL A 53 0.123 -1.011 5.678 1.00 0.00 O ATOM 723 CB VAL A 53 0.656 -1.247 2.822 1.00 0.00 C ATOM 724 CG1 VAL A 53 0.996 0.222 2.636 1.00 0.00 C ATOM 725 CG2 VAL A 53 0.831 -2.008 1.521 1.00 0.00 C ATOM 0 H VAL A 53 0.240 -3.535 3.957 1.00 0.00 H new ATOM 0 HA VAL A 53 2.566 -1.784 3.653 1.00 0.00 H new ATOM 0 HB VAL A 53 -0.389 -1.311 3.124 1.00 0.00 H new ATOM 0 HG11 VAL A 53 0.373 0.642 1.846 1.00 0.00 H new ATOM 0 HG12 VAL A 53 0.813 0.759 3.567 1.00 0.00 H new ATOM 0 HG13 VAL A 53 2.046 0.320 2.361 1.00 0.00 H new ATOM 0 HG21 VAL A 53 0.216 -1.550 0.746 1.00 0.00 H new ATOM 0 HG22 VAL A 53 1.878 -1.977 1.219 1.00 0.00 H new ATOM 0 HG23 VAL A 53 0.524 -3.044 1.662 1.00 0.00 H new ATOM 735 N GLN A 54 2.337 -0.683 5.860 1.00 0.00 N ATOM 736 CA GLN A 54 2.231 -0.009 7.140 1.00 0.00 C ATOM 737 C GLN A 54 2.560 1.472 6.987 1.00 0.00 C ATOM 738 O GLN A 54 3.683 1.834 6.632 1.00 0.00 O ATOM 739 CB GLN A 54 3.173 -0.653 8.159 1.00 0.00 C ATOM 740 CG GLN A 54 2.770 -0.395 9.602 1.00 0.00 C ATOM 741 CD GLN A 54 1.547 -1.196 10.012 1.00 0.00 C ATOM 742 OE1 GLN A 54 1.665 -2.307 10.528 1.00 0.00 O ATOM 743 NE2 GLN A 54 0.367 -0.656 9.764 1.00 0.00 N ATOM 0 H GLN A 54 3.288 -0.761 5.499 1.00 0.00 H new ATOM 0 HA GLN A 54 1.206 -0.106 7.499 1.00 0.00 H new ATOM 0 HB2 GLN A 54 3.204 -1.729 7.985 1.00 0.00 H new ATOM 0 HB3 GLN A 54 4.183 -0.275 7.999 1.00 0.00 H new ATOM 0 HG2 GLN A 54 3.603 -0.645 10.259 1.00 0.00 H new ATOM 0 HG3 GLN A 54 2.567 0.668 9.736 1.00 0.00 H new ATOM 0 HE21 GLN A 54 0.309 0.268 9.335 1.00 0.00 H new ATOM 0 HE22 GLN A 54 -0.486 -1.163 10.002 1.00 0.00 H new ATOM 752 N ILE A 55 1.574 2.318 7.244 1.00 0.00 N ATOM 753 CA ILE A 55 1.766 3.759 7.177 1.00 0.00 C ATOM 754 C ILE A 55 2.426 4.251 8.464 1.00 0.00 C ATOM 755 O ILE A 55 1.768 4.390 9.494 1.00 0.00 O ATOM 756 CB ILE A 55 0.426 4.506 6.975 1.00 0.00 C ATOM 757 CG1 ILE A 55 -0.374 3.906 5.812 1.00 0.00 C ATOM 758 CG2 ILE A 55 0.676 5.984 6.727 1.00 0.00 C ATOM 759 CD1 ILE A 55 0.334 3.965 4.475 1.00 0.00 C ATOM 0 H ILE A 55 0.630 2.030 7.502 1.00 0.00 H new ATOM 0 HA ILE A 55 2.406 3.969 6.320 1.00 0.00 H new ATOM 0 HB ILE A 55 -0.161 4.392 7.887 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -0.604 2.866 6.043 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -1.325 4.432 5.730 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -0.276 6.496 6.587 1.00 0.00 H new ATOM 0 HG22 ILE A 55 1.196 6.414 7.583 1.00 0.00 H new ATOM 0 HG23 ILE A 55 1.288 6.105 5.833 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -0.300 3.520 3.708 1.00 0.00 H new ATOM 0 HD12 ILE A 55 0.540 5.004 4.218 1.00 0.00 H new ATOM 0 HD13 ILE A 55 1.272 3.413 4.535 1.00 0.00 H new ATOM 770 N SER A 56 3.728 4.487 8.405 1.00 0.00 N ATOM 771 CA SER A 56 4.485 4.899 9.577 1.00 0.00 C ATOM 772 C SER A 56 4.419 6.413 9.773 1.00 0.00 C ATOM 773 O SER A 56 4.922 7.186 8.950 1.00 0.00 O ATOM 774 CB SER A 56 5.936 4.442 9.439 1.00 0.00 C ATOM 775 OG SER A 56 6.003 3.053 9.161 1.00 0.00 O ATOM 0 H SER A 56 4.284 4.400 7.554 1.00 0.00 H new ATOM 0 HA SER A 56 4.042 4.431 10.456 1.00 0.00 H new ATOM 0 HB2 SER A 56 6.424 5.001 8.640 1.00 0.00 H new ATOM 0 HB3 SER A 56 6.479 4.660 10.358 1.00 0.00 H new ATOM 0 HG SER A 56 6.941 2.782 9.075 1.00 0.00 H new ATOM 781 N PRO A 57 3.786 6.851 10.873 1.00 0.00 N ATOM 782 CA PRO A 57 3.608 8.266 11.188 1.00 0.00 C ATOM 783 C PRO A 57 4.860 8.897 11.793 1.00 0.00 C ATOM 784 O PRO A 57 5.089 10.096 11.656 1.00 0.00 O ATOM 785 CB PRO A 57 2.463 8.270 12.215 1.00 0.00 C ATOM 786 CG PRO A 57 2.019 6.847 12.353 1.00 0.00 C ATOM 787 CD PRO A 57 3.170 6.005 11.898 1.00 0.00 C ATOM 0 HA PRO A 57 3.399 8.850 10.292 1.00 0.00 H new ATOM 0 HB2 PRO A 57 2.801 8.667 13.172 1.00 0.00 H new ATOM 0 HB3 PRO A 57 1.642 8.903 11.879 1.00 0.00 H new ATOM 0 HG2 PRO A 57 1.755 6.620 13.386 1.00 0.00 H new ATOM 0 HG3 PRO A 57 1.133 6.655 11.748 1.00 0.00 H new ATOM 0 HD2 PRO A 57 3.860 5.784 12.712 1.00 0.00 H new ATOM 0 HD3 PRO A 57 2.840 5.049 11.492 1.00 0.00 H new ATOM 795 N ASP A 58 5.675 8.083 12.449 1.00 0.00 N ATOM 796 CA ASP A 58 6.864 8.586 13.129 1.00 0.00 C ATOM 797 C ASP A 58 8.029 8.709 12.153 1.00 0.00 C ATOM 798 O ASP A 58 8.951 9.490 12.376 1.00 0.00 O ATOM 799 CB ASP A 58 7.253 7.670 14.295 1.00 0.00 C ATOM 800 CG ASP A 58 6.098 7.391 15.238 1.00 0.00 C ATOM 801 OD1 ASP A 58 5.719 8.296 16.013 1.00 0.00 O ATOM 802 OD2 ASP A 58 5.562 6.260 15.209 1.00 0.00 O ATOM 0 H ASP A 58 5.537 7.075 12.526 1.00 0.00 H new ATOM 0 HA ASP A 58 6.631 9.574 13.525 1.00 0.00 H new ATOM 0 HB2 ASP A 58 7.628 6.726 13.899 1.00 0.00 H new ATOM 0 HB3 ASP A 58 8.069 8.128 14.854 1.00 0.00 H new ATOM 807 N SER A 59 7.949 7.919 11.075 1.00 0.00 N ATOM 808 CA SER A 59 8.931 7.890 9.979 1.00 0.00 C ATOM 809 C SER A 59 10.368 7.663 10.462 1.00 0.00 C ATOM 810 O SER A 59 10.864 6.532 10.454 1.00 0.00 O ATOM 811 CB SER A 59 8.835 9.148 9.094 1.00 0.00 C ATOM 812 OG SER A 59 9.031 10.341 9.836 1.00 0.00 O ATOM 0 H SER A 59 7.180 7.264 10.935 1.00 0.00 H new ATOM 0 HA SER A 59 8.670 7.025 9.369 1.00 0.00 H new ATOM 0 HB2 SER A 59 9.580 9.089 8.300 1.00 0.00 H new ATOM 0 HB3 SER A 59 7.857 9.178 8.613 1.00 0.00 H new ATOM 0 HG SER A 59 9.496 11.000 9.279 1.00 0.00 H new ATOM 818 N GLY A 60 11.027 8.728 10.886 1.00 0.00 N ATOM 819 CA GLY A 60 12.407 8.641 11.303 1.00 0.00 C ATOM 820 C GLY A 60 13.201 9.836 10.828 1.00 0.00 C ATOM 821 O GLY A 60 13.115 10.916 11.409 1.00 0.00 O ATOM 0 H GLY A 60 10.623 9.663 10.949 1.00 0.00 H new ATOM 0 HA2 GLY A 60 12.457 8.577 12.390 1.00 0.00 H new ATOM 0 HA3 GLY A 60 12.851 7.727 10.909 1.00 0.00 H new ATOM 825 N GLY A 61 13.949 9.659 9.748 1.00 0.00 N ATOM 826 CA GLY A 61 14.727 10.751 9.200 1.00 0.00 C ATOM 827 C GLY A 61 13.950 11.540 8.162 1.00 0.00 C ATOM 828 O GLY A 61 14.533 12.269 7.362 1.00 0.00 O ATOM 0 H GLY A 61 14.031 8.778 9.241 1.00 0.00 H new ATOM 0 HA2 GLY A 61 15.034 11.417 10.006 1.00 0.00 H new ATOM 0 HA3 GLY A 61 15.637 10.356 8.748 1.00 0.00 H new ATOM 832 N LEU A 62 12.629 11.388 8.179 1.00 0.00 N ATOM 833 CA LEU A 62 11.759 12.055 7.217 1.00 0.00 C ATOM 834 C LEU A 62 10.780 12.971 7.951 1.00 0.00 C ATOM 835 O LEU A 62 10.226 12.587 8.981 1.00 0.00 O ATOM 836 CB LEU A 62 10.961 11.029 6.383 1.00 0.00 C ATOM 837 CG LEU A 62 11.771 10.083 5.476 1.00 0.00 C ATOM 838 CD1 LEU A 62 12.847 10.840 4.716 1.00 0.00 C ATOM 839 CD2 LEU A 62 12.383 8.941 6.270 1.00 0.00 C ATOM 0 H LEU A 62 12.135 10.804 8.854 1.00 0.00 H new ATOM 0 HA LEU A 62 12.387 12.640 6.545 1.00 0.00 H new ATOM 0 HB2 LEU A 62 10.373 10.419 7.069 1.00 0.00 H new ATOM 0 HB3 LEU A 62 10.256 11.576 5.758 1.00 0.00 H new ATOM 0 HG LEU A 62 11.077 9.655 4.752 1.00 0.00 H new ATOM 0 HD11 LEU A 62 13.402 10.147 4.084 1.00 0.00 H new ATOM 0 HD12 LEU A 62 12.383 11.605 4.094 1.00 0.00 H new ATOM 0 HD13 LEU A 62 13.529 11.312 5.424 1.00 0.00 H new ATOM 0 HD21 LEU A 62 12.947 8.293 5.599 1.00 0.00 H new ATOM 0 HD22 LEU A 62 13.050 9.344 7.032 1.00 0.00 H new ATOM 0 HD23 LEU A 62 11.591 8.366 6.749 1.00 0.00 H new ATOM 851 N PRO A 63 10.555 14.194 7.440 1.00 0.00 N ATOM 852 CA PRO A 63 9.571 15.129 8.008 1.00 0.00 C ATOM 853 C PRO A 63 8.174 14.804 7.505 1.00 0.00 C ATOM 854 O PRO A 63 7.168 15.362 7.952 1.00 0.00 O ATOM 855 CB PRO A 63 10.030 16.462 7.433 1.00 0.00 C ATOM 856 CG PRO A 63 10.511 16.094 6.076 1.00 0.00 C ATOM 857 CD PRO A 63 11.232 14.779 6.260 1.00 0.00 C ATOM 0 HA PRO A 63 9.520 15.103 9.097 1.00 0.00 H new ATOM 0 HB2 PRO A 63 9.215 17.185 7.390 1.00 0.00 H new ATOM 0 HB3 PRO A 63 10.822 16.909 8.034 1.00 0.00 H new ATOM 0 HG2 PRO A 63 9.681 15.994 5.377 1.00 0.00 H new ATOM 0 HG3 PRO A 63 11.178 16.857 5.673 1.00 0.00 H new ATOM 0 HD2 PRO A 63 11.138 14.140 5.382 1.00 0.00 H new ATOM 0 HD3 PRO A 63 12.298 14.924 6.436 1.00 0.00 H new ATOM 865 N GLU A 64 8.155 13.898 6.549 1.00 0.00 N ATOM 866 CA GLU A 64 6.958 13.483 5.858 1.00 0.00 C ATOM 867 C GLU A 64 6.517 12.118 6.366 1.00 0.00 C ATOM 868 O GLU A 64 6.948 11.674 7.433 1.00 0.00 O ATOM 869 CB GLU A 64 7.263 13.441 4.359 1.00 0.00 C ATOM 870 CG GLU A 64 8.569 12.720 4.043 1.00 0.00 C ATOM 871 CD GLU A 64 9.167 13.123 2.712 1.00 0.00 C ATOM 872 OE1 GLU A 64 9.727 14.237 2.618 1.00 0.00 O ATOM 873 OE2 GLU A 64 9.113 12.325 1.764 1.00 0.00 O ATOM 0 H GLU A 64 8.995 13.419 6.225 1.00 0.00 H new ATOM 0 HA GLU A 64 6.144 14.184 6.042 1.00 0.00 H new ATOM 0 HB2 GLU A 64 6.444 12.944 3.840 1.00 0.00 H new ATOM 0 HB3 GLU A 64 7.313 14.460 3.974 1.00 0.00 H new ATOM 0 HG2 GLU A 64 9.290 12.925 4.835 1.00 0.00 H new ATOM 0 HG3 GLU A 64 8.392 11.644 4.043 1.00 0.00 H new ATOM 880 N ARG A 65 5.680 11.450 5.603 1.00 0.00 N ATOM 881 CA ARG A 65 5.187 10.146 5.988 1.00 0.00 C ATOM 882 C ARG A 65 6.039 9.073 5.329 1.00 0.00 C ATOM 883 O ARG A 65 6.569 9.283 4.238 1.00 0.00 O ATOM 884 CB ARG A 65 3.722 9.997 5.570 1.00 0.00 C ATOM 885 CG ARG A 65 2.933 9.047 6.450 1.00 0.00 C ATOM 886 CD ARG A 65 2.978 9.490 7.897 1.00 0.00 C ATOM 887 NE ARG A 65 2.460 10.848 8.082 1.00 0.00 N ATOM 888 CZ ARG A 65 3.100 11.806 8.758 1.00 0.00 C ATOM 889 NH1 ARG A 65 4.271 11.555 9.332 1.00 0.00 N ATOM 890 NH2 ARG A 65 2.572 13.016 8.853 1.00 0.00 N ATOM 0 H ARG A 65 5.325 11.790 4.709 1.00 0.00 H new ATOM 0 HA ARG A 65 5.249 10.036 7.071 1.00 0.00 H new ATOM 0 HB2 ARG A 65 3.246 10.977 5.590 1.00 0.00 H new ATOM 0 HB3 ARG A 65 3.681 9.643 4.540 1.00 0.00 H new ATOM 0 HG2 ARG A 65 1.898 9.004 6.110 1.00 0.00 H new ATOM 0 HG3 ARG A 65 3.339 8.040 6.361 1.00 0.00 H new ATOM 0 HD2 ARG A 65 2.397 8.796 8.505 1.00 0.00 H new ATOM 0 HD3 ARG A 65 4.006 9.444 8.256 1.00 0.00 H new ATOM 0 HE ARG A 65 1.555 11.076 7.669 1.00 0.00 H new ATOM 0 HH11 ARG A 65 4.687 10.626 9.258 1.00 0.00 H new ATOM 0 HH12 ARG A 65 4.755 12.291 9.847 1.00 0.00 H new ATOM 0 HH21 ARG A 65 1.676 13.218 8.410 1.00 0.00 H new ATOM 0 HH22 ARG A 65 3.061 13.747 9.369 1.00 0.00 H new ATOM 904 N SER A 66 6.197 7.942 5.992 1.00 0.00 N ATOM 905 CA SER A 66 6.945 6.842 5.417 1.00 0.00 C ATOM 906 C SER A 66 6.067 5.603 5.348 1.00 0.00 C ATOM 907 O SER A 66 5.478 5.191 6.349 1.00 0.00 O ATOM 908 CB SER A 66 8.213 6.578 6.233 1.00 0.00 C ATOM 909 OG SER A 66 7.901 6.314 7.590 1.00 0.00 O ATOM 0 H SER A 66 5.820 7.763 6.923 1.00 0.00 H new ATOM 0 HA SER A 66 7.249 7.104 4.404 1.00 0.00 H new ATOM 0 HB2 SER A 66 8.752 5.731 5.809 1.00 0.00 H new ATOM 0 HB3 SER A 66 8.876 7.441 6.170 1.00 0.00 H new ATOM 0 HG SER A 66 8.475 5.593 7.923 1.00 0.00 H new ATOM 915 N VAL A 67 5.948 5.036 4.164 1.00 0.00 N ATOM 916 CA VAL A 67 5.100 3.876 3.964 1.00 0.00 C ATOM 917 C VAL A 67 5.937 2.642 3.669 1.00 0.00 C ATOM 918 O VAL A 67 6.577 2.556 2.621 1.00 0.00 O ATOM 919 CB VAL A 67 4.107 4.097 2.804 1.00 0.00 C ATOM 920 CG1 VAL A 67 3.230 2.873 2.605 1.00 0.00 C ATOM 921 CG2 VAL A 67 3.257 5.333 3.054 1.00 0.00 C ATOM 0 H VAL A 67 6.428 5.360 3.324 1.00 0.00 H new ATOM 0 HA VAL A 67 4.539 3.726 4.886 1.00 0.00 H new ATOM 0 HB VAL A 67 4.680 4.256 1.891 1.00 0.00 H new ATOM 0 HG11 VAL A 67 2.538 3.051 1.782 1.00 0.00 H new ATOM 0 HG12 VAL A 67 3.856 2.011 2.373 1.00 0.00 H new ATOM 0 HG13 VAL A 67 2.667 2.677 3.517 1.00 0.00 H new ATOM 0 HG21 VAL A 67 2.563 5.471 2.225 1.00 0.00 H new ATOM 0 HG22 VAL A 67 2.695 5.207 3.980 1.00 0.00 H new ATOM 0 HG23 VAL A 67 3.902 6.208 3.137 1.00 0.00 H new ATOM 931 N SER A 68 5.940 1.698 4.594 1.00 0.00 N ATOM 932 CA SER A 68 6.623 0.442 4.367 1.00 0.00 C ATOM 933 C SER A 68 5.777 -0.485 3.523 1.00 0.00 C ATOM 934 O SER A 68 4.616 -0.761 3.841 1.00 0.00 O ATOM 935 CB SER A 68 6.965 -0.259 5.664 1.00 0.00 C ATOM 936 OG SER A 68 7.936 0.461 6.409 1.00 0.00 O ATOM 0 H SER A 68 5.481 1.778 5.501 1.00 0.00 H new ATOM 0 HA SER A 68 7.548 0.682 3.843 1.00 0.00 H new ATOM 0 HB2 SER A 68 6.062 -0.378 6.263 1.00 0.00 H new ATOM 0 HB3 SER A 68 7.340 -1.260 5.449 1.00 0.00 H new ATOM 0 HG SER A 68 8.072 1.342 6.003 1.00 0.00 H new ATOM 942 N LEU A 69 6.366 -0.958 2.452 1.00 0.00 N ATOM 943 CA LEU A 69 5.696 -1.853 1.543 1.00 0.00 C ATOM 944 C LEU A 69 6.401 -3.202 1.472 1.00 0.00 C ATOM 945 O LEU A 69 7.526 -3.297 0.979 1.00 0.00 O ATOM 946 CB LEU A 69 5.667 -1.200 0.179 1.00 0.00 C ATOM 947 CG LEU A 69 4.905 0.124 0.133 1.00 0.00 C ATOM 948 CD1 LEU A 69 5.372 0.981 -1.029 1.00 0.00 C ATOM 949 CD2 LEU A 69 3.413 -0.140 0.039 1.00 0.00 C ATOM 0 H LEU A 69 7.325 -0.732 2.186 1.00 0.00 H new ATOM 0 HA LEU A 69 4.682 -2.040 1.897 1.00 0.00 H new ATOM 0 HB2 LEU A 69 6.692 -1.028 -0.151 1.00 0.00 H new ATOM 0 HB3 LEU A 69 5.215 -1.891 -0.532 1.00 0.00 H new ATOM 0 HG LEU A 69 5.109 0.672 1.053 1.00 0.00 H new ATOM 0 HD11 LEU A 69 4.814 1.917 -1.038 1.00 0.00 H new ATOM 0 HD12 LEU A 69 6.435 1.194 -0.920 1.00 0.00 H new ATOM 0 HD13 LEU A 69 5.203 0.448 -1.965 1.00 0.00 H new ATOM 0 HD21 LEU A 69 2.877 0.809 0.007 1.00 0.00 H new ATOM 0 HD22 LEU A 69 3.200 -0.708 -0.867 1.00 0.00 H new ATOM 0 HD23 LEU A 69 3.089 -0.710 0.909 1.00 0.00 H new ATOM 961 N THR A 70 5.753 -4.235 1.999 1.00 0.00 N ATOM 962 CA THR A 70 6.295 -5.588 1.951 1.00 0.00 C ATOM 963 C THR A 70 5.166 -6.627 1.943 1.00 0.00 C ATOM 964 O THR A 70 4.358 -6.665 2.865 1.00 0.00 O ATOM 965 CB THR A 70 7.207 -5.848 3.162 1.00 0.00 C ATOM 966 OG1 THR A 70 7.981 -4.679 3.454 1.00 0.00 O ATOM 967 CG2 THR A 70 8.139 -7.002 2.878 1.00 0.00 C ATOM 0 H THR A 70 4.849 -4.161 2.466 1.00 0.00 H new ATOM 0 HA THR A 70 6.875 -5.680 1.033 1.00 0.00 H new ATOM 0 HB THR A 70 6.580 -6.094 4.019 1.00 0.00 H new ATOM 0 HG1 THR A 70 7.668 -4.281 4.293 1.00 0.00 H new ATOM 0 HG21 THR A 70 8.779 -7.175 3.744 1.00 0.00 H new ATOM 0 HG22 THR A 70 7.555 -7.899 2.673 1.00 0.00 H new ATOM 0 HG23 THR A 70 8.757 -6.766 2.012 1.00 0.00 H new ATOM 975 N GLY A 71 5.111 -7.475 0.919 1.00 0.00 N ATOM 976 CA GLY A 71 4.019 -8.432 0.825 1.00 0.00 C ATOM 977 C GLY A 71 4.352 -9.669 0.008 1.00 0.00 C ATOM 978 O GLY A 71 4.837 -10.664 0.541 1.00 0.00 O ATOM 0 H GLY A 71 5.793 -7.518 0.161 1.00 0.00 H new ATOM 0 HA2 GLY A 71 3.731 -8.739 1.830 1.00 0.00 H new ATOM 0 HA3 GLY A 71 3.154 -7.939 0.382 1.00 0.00 H new ATOM 982 N ALA A 72 4.081 -9.609 -1.287 1.00 0.00 N ATOM 983 CA ALA A 72 4.249 -10.760 -2.167 1.00 0.00 C ATOM 984 C ALA A 72 4.354 -10.290 -3.619 1.00 0.00 C ATOM 985 O ALA A 72 4.065 -9.131 -3.891 1.00 0.00 O ATOM 986 CB ALA A 72 3.084 -11.725 -1.978 1.00 0.00 C ATOM 0 H ALA A 72 3.741 -8.770 -1.756 1.00 0.00 H new ATOM 0 HA ALA A 72 5.170 -11.286 -1.915 1.00 0.00 H new ATOM 0 HB1 ALA A 72 3.212 -12.584 -2.637 1.00 0.00 H new ATOM 0 HB2 ALA A 72 3.056 -12.063 -0.942 1.00 0.00 H new ATOM 0 HB3 ALA A 72 2.149 -11.219 -2.220 1.00 0.00 H new ATOM 992 N PRO A 73 4.775 -11.168 -4.560 1.00 0.00 N ATOM 993 CA PRO A 73 4.989 -10.802 -5.973 1.00 0.00 C ATOM 994 C PRO A 73 3.933 -9.850 -6.544 1.00 0.00 C ATOM 995 O PRO A 73 4.257 -8.746 -6.990 1.00 0.00 O ATOM 996 CB PRO A 73 4.920 -12.151 -6.680 1.00 0.00 C ATOM 997 CG PRO A 73 5.461 -13.122 -5.687 1.00 0.00 C ATOM 998 CD PRO A 73 5.091 -12.594 -4.323 1.00 0.00 C ATOM 0 HA PRO A 73 5.925 -10.258 -6.102 1.00 0.00 H new ATOM 0 HB2 PRO A 73 3.897 -12.400 -6.961 1.00 0.00 H new ATOM 0 HB3 PRO A 73 5.511 -12.150 -7.596 1.00 0.00 H new ATOM 0 HG2 PRO A 73 5.039 -14.114 -5.846 1.00 0.00 H new ATOM 0 HG3 PRO A 73 6.542 -13.216 -5.786 1.00 0.00 H new ATOM 0 HD2 PRO A 73 4.236 -13.128 -3.908 1.00 0.00 H new ATOM 0 HD3 PRO A 73 5.912 -12.708 -3.615 1.00 0.00 H new ATOM 1006 N GLU A 74 2.678 -10.273 -6.528 1.00 0.00 N ATOM 1007 CA GLU A 74 1.591 -9.453 -7.055 1.00 0.00 C ATOM 1008 C GLU A 74 1.141 -8.446 -6.010 1.00 0.00 C ATOM 1009 O GLU A 74 0.830 -7.292 -6.320 1.00 0.00 O ATOM 1010 CB GLU A 74 0.405 -10.332 -7.463 1.00 0.00 C ATOM 1011 CG GLU A 74 -0.787 -9.542 -7.979 1.00 0.00 C ATOM 1012 CD GLU A 74 -1.977 -10.418 -8.303 1.00 0.00 C ATOM 1013 OE1 GLU A 74 -1.921 -11.159 -9.303 1.00 0.00 O ATOM 1014 OE2 GLU A 74 -2.984 -10.355 -7.567 1.00 0.00 O ATOM 0 H GLU A 74 2.385 -11.177 -6.157 1.00 0.00 H new ATOM 0 HA GLU A 74 1.957 -8.922 -7.934 1.00 0.00 H new ATOM 0 HB2 GLU A 74 0.729 -11.030 -8.234 1.00 0.00 H new ATOM 0 HB3 GLU A 74 0.092 -10.927 -6.605 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -1.078 -8.804 -7.232 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -0.493 -8.992 -8.873 1.00 0.00 H new ATOM 1021 N SER A 75 1.140 -8.898 -4.769 1.00 0.00 N ATOM 1022 CA SER A 75 0.618 -8.125 -3.658 1.00 0.00 C ATOM 1023 C SER A 75 1.392 -6.824 -3.473 1.00 0.00 C ATOM 1024 O SER A 75 0.805 -5.751 -3.332 1.00 0.00 O ATOM 1025 CB SER A 75 0.699 -8.967 -2.390 1.00 0.00 C ATOM 1026 OG SER A 75 0.205 -10.276 -2.631 1.00 0.00 O ATOM 0 H SER A 75 1.502 -9.814 -4.503 1.00 0.00 H new ATOM 0 HA SER A 75 -0.419 -7.863 -3.869 1.00 0.00 H new ATOM 0 HB2 SER A 75 1.732 -9.019 -2.046 1.00 0.00 H new ATOM 0 HB3 SER A 75 0.122 -8.495 -1.595 1.00 0.00 H new ATOM 0 HG SER A 75 -0.624 -10.411 -2.127 1.00 0.00 H new ATOM 1032 N VAL A 76 2.712 -6.925 -3.506 1.00 0.00 N ATOM 1033 CA VAL A 76 3.564 -5.786 -3.230 1.00 0.00 C ATOM 1034 C VAL A 76 3.515 -4.795 -4.392 1.00 0.00 C ATOM 1035 O VAL A 76 3.588 -3.593 -4.181 1.00 0.00 O ATOM 1036 CB VAL A 76 5.024 -6.223 -2.926 1.00 0.00 C ATOM 1037 CG1 VAL A 76 5.835 -6.439 -4.198 1.00 0.00 C ATOM 1038 CG2 VAL A 76 5.706 -5.224 -2.002 1.00 0.00 C ATOM 0 H VAL A 76 3.214 -7.786 -3.722 1.00 0.00 H new ATOM 0 HA VAL A 76 3.186 -5.290 -2.336 1.00 0.00 H new ATOM 0 HB VAL A 76 4.975 -7.184 -2.415 1.00 0.00 H new ATOM 0 HG11 VAL A 76 6.848 -6.743 -3.936 1.00 0.00 H new ATOM 0 HG12 VAL A 76 5.367 -7.217 -4.800 1.00 0.00 H new ATOM 0 HG13 VAL A 76 5.871 -5.511 -4.769 1.00 0.00 H new ATOM 0 HG21 VAL A 76 6.727 -5.550 -1.803 1.00 0.00 H new ATOM 0 HG22 VAL A 76 5.725 -4.243 -2.477 1.00 0.00 H new ATOM 0 HG23 VAL A 76 5.155 -5.162 -1.063 1.00 0.00 H new ATOM 1048 N GLN A 77 3.342 -5.299 -5.614 1.00 0.00 N ATOM 1049 CA GLN A 77 3.243 -4.421 -6.773 1.00 0.00 C ATOM 1050 C GLN A 77 1.924 -3.657 -6.751 1.00 0.00 C ATOM 1051 O GLN A 77 1.877 -2.485 -7.097 1.00 0.00 O ATOM 1052 CB GLN A 77 3.378 -5.195 -8.088 1.00 0.00 C ATOM 1053 CG GLN A 77 3.172 -4.306 -9.309 1.00 0.00 C ATOM 1054 CD GLN A 77 3.485 -4.993 -10.624 1.00 0.00 C ATOM 1055 OE1 GLN A 77 3.354 -6.211 -10.760 1.00 0.00 O ATOM 1056 NE2 GLN A 77 3.893 -4.205 -11.607 1.00 0.00 N ATOM 0 H GLN A 77 3.269 -6.295 -5.823 1.00 0.00 H new ATOM 0 HA GLN A 77 4.070 -3.713 -6.716 1.00 0.00 H new ATOM 0 HB2 GLN A 77 4.366 -5.652 -8.137 1.00 0.00 H new ATOM 0 HB3 GLN A 77 2.650 -6.006 -8.105 1.00 0.00 H new ATOM 0 HG2 GLN A 77 2.138 -3.962 -9.326 1.00 0.00 H new ATOM 0 HG3 GLN A 77 3.801 -3.421 -9.213 1.00 0.00 H new ATOM 0 HE21 GLN A 77 3.987 -3.202 -11.450 1.00 0.00 H new ATOM 0 HE22 GLN A 77 4.113 -4.602 -12.521 1.00 0.00 H new ATOM 1065 N LYS A 78 0.854 -4.325 -6.338 1.00 0.00 N ATOM 1066 CA LYS A 78 -0.450 -3.675 -6.222 1.00 0.00 C ATOM 1067 C LYS A 78 -0.397 -2.563 -5.177 1.00 0.00 C ATOM 1068 O LYS A 78 -0.850 -1.434 -5.410 1.00 0.00 O ATOM 1069 CB LYS A 78 -1.524 -4.701 -5.848 1.00 0.00 C ATOM 1070 CG LYS A 78 -2.464 -5.095 -6.990 1.00 0.00 C ATOM 1071 CD LYS A 78 -1.769 -5.875 -8.108 1.00 0.00 C ATOM 1072 CE LYS A 78 -0.920 -4.980 -8.999 1.00 0.00 C ATOM 1073 NZ LYS A 78 -0.476 -5.674 -10.236 1.00 0.00 N ATOM 0 H LYS A 78 0.861 -5.311 -6.078 1.00 0.00 H new ATOM 0 HA LYS A 78 -0.706 -3.236 -7.186 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -1.033 -5.600 -5.475 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -2.120 -4.299 -5.028 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -3.278 -5.698 -6.589 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -2.911 -4.194 -7.410 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -1.139 -6.649 -7.670 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -2.520 -6.381 -8.715 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -1.492 -4.092 -9.269 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -0.047 -4.640 -8.442 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 0.099 -5.025 -10.811 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 0.092 -6.507 -9.982 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -1.308 -5.976 -10.782 1.00 0.00 H new ATOM 1086 N ALA A 79 0.179 -2.887 -4.032 1.00 0.00 N ATOM 1087 CA ALA A 79 0.342 -1.923 -2.961 1.00 0.00 C ATOM 1088 C ALA A 79 1.168 -0.730 -3.426 1.00 0.00 C ATOM 1089 O ALA A 79 0.764 0.422 -3.269 1.00 0.00 O ATOM 1090 CB ALA A 79 1.010 -2.583 -1.770 1.00 0.00 C ATOM 0 H ALA A 79 0.543 -3.816 -3.821 1.00 0.00 H new ATOM 0 HA ALA A 79 -0.644 -1.564 -2.668 1.00 0.00 H new ATOM 0 HB1 ALA A 79 1.129 -1.853 -0.969 1.00 0.00 H new ATOM 0 HB2 ALA A 79 0.393 -3.410 -1.419 1.00 0.00 H new ATOM 0 HB3 ALA A 79 1.989 -2.961 -2.065 1.00 0.00 H new ATOM 1096 N LYS A 80 2.312 -1.019 -4.030 1.00 0.00 N ATOM 1097 CA LYS A 80 3.246 0.020 -4.435 1.00 0.00 C ATOM 1098 C LYS A 80 2.768 0.769 -5.673 1.00 0.00 C ATOM 1099 O LYS A 80 3.221 1.879 -5.929 1.00 0.00 O ATOM 1100 CB LYS A 80 4.639 -0.559 -4.676 1.00 0.00 C ATOM 1101 CG LYS A 80 5.219 -1.259 -3.460 1.00 0.00 C ATOM 1102 CD LYS A 80 6.718 -1.466 -3.581 1.00 0.00 C ATOM 1103 CE LYS A 80 7.094 -2.243 -4.827 1.00 0.00 C ATOM 1104 NZ LYS A 80 8.570 -2.311 -5.005 1.00 0.00 N ATOM 0 H LYS A 80 2.616 -1.967 -4.251 1.00 0.00 H new ATOM 0 HA LYS A 80 3.298 0.735 -3.614 1.00 0.00 H new ATOM 0 HB2 LYS A 80 4.593 -1.265 -5.505 1.00 0.00 H new ATOM 0 HB3 LYS A 80 5.311 0.244 -4.979 1.00 0.00 H new ATOM 0 HG2 LYS A 80 5.006 -0.671 -2.568 1.00 0.00 H new ATOM 0 HG3 LYS A 80 4.730 -2.224 -3.330 1.00 0.00 H new ATOM 0 HD2 LYS A 80 7.216 -0.497 -3.596 1.00 0.00 H new ATOM 0 HD3 LYS A 80 7.081 -1.997 -2.701 1.00 0.00 H new ATOM 0 HE2 LYS A 80 6.688 -3.252 -4.764 1.00 0.00 H new ATOM 0 HE3 LYS A 80 6.643 -1.772 -5.700 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 8.800 -2.263 -6.018 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 9.016 -1.513 -4.510 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 8.926 -3.205 -4.611 1.00 0.00 H new ATOM 1117 N MET A 81 1.881 0.168 -6.460 1.00 0.00 N ATOM 1118 CA MET A 81 1.355 0.852 -7.637 1.00 0.00 C ATOM 1119 C MET A 81 0.460 2.007 -7.202 1.00 0.00 C ATOM 1120 O MET A 81 0.470 3.072 -7.820 1.00 0.00 O ATOM 1121 CB MET A 81 0.592 -0.101 -8.578 1.00 0.00 C ATOM 1122 CG MET A 81 -0.840 -0.396 -8.160 1.00 0.00 C ATOM 1123 SD MET A 81 -1.722 -1.422 -9.352 1.00 0.00 S ATOM 1124 CE MET A 81 -1.656 -0.379 -10.808 1.00 0.00 C ATOM 0 H MET A 81 1.517 -0.773 -6.309 1.00 0.00 H new ATOM 0 HA MET A 81 2.203 1.239 -8.202 1.00 0.00 H new ATOM 0 HB2 MET A 81 0.582 0.330 -9.579 1.00 0.00 H new ATOM 0 HB3 MET A 81 1.139 -1.042 -8.641 1.00 0.00 H new ATOM 0 HG2 MET A 81 -0.835 -0.896 -7.192 1.00 0.00 H new ATOM 0 HG3 MET A 81 -1.376 0.544 -8.030 1.00 0.00 H new ATOM 0 HE1 MET A 81 -2.467 -0.648 -11.485 1.00 0.00 H new ATOM 0 HE2 MET A 81 -1.761 0.665 -10.513 1.00 0.00 H new ATOM 0 HE3 MET A 81 -0.700 -0.519 -11.313 1.00 0.00 H new ATOM 1134 N MET A 82 -0.301 1.802 -6.122 1.00 0.00 N ATOM 1135 CA MET A 82 -1.106 2.884 -5.560 1.00 0.00 C ATOM 1136 C MET A 82 -0.202 3.954 -4.961 1.00 0.00 C ATOM 1137 O MET A 82 -0.421 5.147 -5.154 1.00 0.00 O ATOM 1138 CB MET A 82 -2.074 2.368 -4.491 1.00 0.00 C ATOM 1139 CG MET A 82 -3.196 1.495 -5.030 1.00 0.00 C ATOM 1140 SD MET A 82 -4.076 2.255 -6.409 1.00 0.00 S ATOM 1141 CE MET A 82 -4.726 3.732 -5.628 1.00 0.00 C ATOM 0 H MET A 82 -0.375 0.912 -5.629 1.00 0.00 H new ATOM 0 HA MET A 82 -1.694 3.314 -6.371 1.00 0.00 H new ATOM 0 HB2 MET A 82 -1.510 1.799 -3.752 1.00 0.00 H new ATOM 0 HB3 MET A 82 -2.511 3.221 -3.971 1.00 0.00 H new ATOM 0 HG2 MET A 82 -2.783 0.539 -5.352 1.00 0.00 H new ATOM 0 HG3 MET A 82 -3.902 1.283 -4.227 1.00 0.00 H new ATOM 0 HE1 MET A 82 -5.437 4.215 -6.298 1.00 0.00 H new ATOM 0 HE2 MET A 82 -5.228 3.461 -4.699 1.00 0.00 H new ATOM 0 HE3 MET A 82 -3.908 4.419 -5.411 1.00 0.00 H new ATOM 1151 N LEU A 83 0.822 3.505 -4.248 1.00 0.00 N ATOM 1152 CA LEU A 83 1.793 4.401 -3.623 1.00 0.00 C ATOM 1153 C LEU A 83 2.480 5.263 -4.670 1.00 0.00 C ATOM 1154 O LEU A 83 2.427 6.490 -4.606 1.00 0.00 O ATOM 1155 CB LEU A 83 2.839 3.594 -2.841 1.00 0.00 C ATOM 1156 CG LEU A 83 2.558 3.391 -1.346 1.00 0.00 C ATOM 1157 CD1 LEU A 83 2.594 4.727 -0.623 1.00 0.00 C ATOM 1158 CD2 LEU A 83 1.219 2.705 -1.123 1.00 0.00 C ATOM 0 H LEU A 83 1.005 2.515 -4.085 1.00 0.00 H new ATOM 0 HA LEU A 83 1.259 5.052 -2.931 1.00 0.00 H new ATOM 0 HB2 LEU A 83 2.935 2.614 -3.308 1.00 0.00 H new ATOM 0 HB3 LEU A 83 3.803 4.092 -2.944 1.00 0.00 H new ATOM 0 HG LEU A 83 3.336 2.744 -0.940 1.00 0.00 H new ATOM 0 HD11 LEU A 83 2.393 4.572 0.437 1.00 0.00 H new ATOM 0 HD12 LEU A 83 3.578 5.180 -0.744 1.00 0.00 H new ATOM 0 HD13 LEU A 83 1.836 5.388 -1.043 1.00 0.00 H new ATOM 0 HD21 LEU A 83 1.050 2.576 -0.054 1.00 0.00 H new ATOM 0 HD22 LEU A 83 0.422 3.317 -1.545 1.00 0.00 H new ATOM 0 HD23 LEU A 83 1.224 1.730 -1.610 1.00 0.00 H new ATOM 1170 N ASP A 84 3.099 4.606 -5.641 1.00 0.00 N ATOM 1171 CA ASP A 84 3.802 5.281 -6.726 1.00 0.00 C ATOM 1172 C ASP A 84 2.914 6.324 -7.387 1.00 0.00 C ATOM 1173 O ASP A 84 3.367 7.417 -7.714 1.00 0.00 O ATOM 1174 CB ASP A 84 4.265 4.253 -7.765 1.00 0.00 C ATOM 1175 CG ASP A 84 4.826 4.885 -9.023 1.00 0.00 C ATOM 1176 OD1 ASP A 84 6.038 5.184 -9.057 1.00 0.00 O ATOM 1177 OD2 ASP A 84 4.060 5.066 -9.992 1.00 0.00 O ATOM 0 H ASP A 84 3.129 3.588 -5.700 1.00 0.00 H new ATOM 0 HA ASP A 84 4.670 5.790 -6.307 1.00 0.00 H new ATOM 0 HB2 ASP A 84 5.025 3.612 -7.318 1.00 0.00 H new ATOM 0 HB3 ASP A 84 3.425 3.612 -8.032 1.00 0.00 H new ATOM 1182 N ASP A 85 1.641 5.986 -7.548 1.00 0.00 N ATOM 1183 CA ASP A 85 0.686 6.873 -8.197 1.00 0.00 C ATOM 1184 C ASP A 85 0.554 8.199 -7.450 1.00 0.00 C ATOM 1185 O ASP A 85 0.798 9.270 -8.012 1.00 0.00 O ATOM 1186 CB ASP A 85 -0.679 6.190 -8.302 1.00 0.00 C ATOM 1187 CG ASP A 85 -1.730 7.090 -8.927 1.00 0.00 C ATOM 1188 OD1 ASP A 85 -1.778 7.179 -10.170 1.00 0.00 O ATOM 1189 OD2 ASP A 85 -2.512 7.715 -8.182 1.00 0.00 O ATOM 0 H ASP A 85 1.245 5.099 -7.236 1.00 0.00 H new ATOM 0 HA ASP A 85 1.059 7.090 -9.198 1.00 0.00 H new ATOM 0 HB2 ASP A 85 -0.583 5.281 -8.896 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -1.008 5.887 -7.308 1.00 0.00 H new ATOM 1194 N ILE A 86 0.192 8.125 -6.176 1.00 0.00 N ATOM 1195 CA ILE A 86 -0.050 9.324 -5.384 1.00 0.00 C ATOM 1196 C ILE A 86 1.254 10.038 -5.036 1.00 0.00 C ATOM 1197 O ILE A 86 1.337 11.269 -5.096 1.00 0.00 O ATOM 1198 CB ILE A 86 -0.851 9.011 -4.094 1.00 0.00 C ATOM 1199 CG1 ILE A 86 -2.325 8.776 -4.427 1.00 0.00 C ATOM 1200 CG2 ILE A 86 -0.716 10.131 -3.073 1.00 0.00 C ATOM 1201 CD1 ILE A 86 -2.609 7.422 -5.038 1.00 0.00 C ATOM 0 H ILE A 86 0.060 7.249 -5.670 1.00 0.00 H new ATOM 0 HA ILE A 86 -0.652 9.990 -6.002 1.00 0.00 H new ATOM 0 HB ILE A 86 -0.436 8.103 -3.656 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -2.914 8.883 -3.516 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -2.659 9.552 -5.116 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -1.289 9.881 -2.180 1.00 0.00 H new ATOM 0 HG22 ILE A 86 0.334 10.256 -2.807 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -1.095 11.060 -3.499 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -3.675 7.333 -5.245 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -2.049 7.317 -5.967 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -2.308 6.639 -4.343 1.00 0.00 H new ATOM 1212 N VAL A 87 2.277 9.274 -4.700 1.00 0.00 N ATOM 1213 CA VAL A 87 3.554 9.863 -4.339 1.00 0.00 C ATOM 1214 C VAL A 87 4.126 10.656 -5.502 1.00 0.00 C ATOM 1215 O VAL A 87 4.648 11.752 -5.321 1.00 0.00 O ATOM 1216 CB VAL A 87 4.571 8.805 -3.873 1.00 0.00 C ATOM 1217 CG1 VAL A 87 5.929 9.445 -3.632 1.00 0.00 C ATOM 1218 CG2 VAL A 87 4.087 8.111 -2.609 1.00 0.00 C ATOM 0 H VAL A 87 2.251 8.255 -4.669 1.00 0.00 H new ATOM 0 HA VAL A 87 3.369 10.535 -3.501 1.00 0.00 H new ATOM 0 HB VAL A 87 4.669 8.058 -4.660 1.00 0.00 H new ATOM 0 HG11 VAL A 87 6.637 8.684 -3.303 1.00 0.00 H new ATOM 0 HG12 VAL A 87 6.287 9.898 -4.557 1.00 0.00 H new ATOM 0 HG13 VAL A 87 5.838 10.212 -2.863 1.00 0.00 H new ATOM 0 HG21 VAL A 87 4.821 7.368 -2.298 1.00 0.00 H new ATOM 0 HG22 VAL A 87 3.958 8.848 -1.816 1.00 0.00 H new ATOM 0 HG23 VAL A 87 3.134 7.620 -2.806 1.00 0.00 H new ATOM 1228 N SER A 88 3.998 10.120 -6.696 1.00 0.00 N ATOM 1229 CA SER A 88 4.491 10.796 -7.879 1.00 0.00 C ATOM 1230 C SER A 88 3.680 12.055 -8.182 1.00 0.00 C ATOM 1231 O SER A 88 4.234 13.064 -8.613 1.00 0.00 O ATOM 1232 CB SER A 88 4.447 9.852 -9.071 1.00 0.00 C ATOM 1233 OG SER A 88 5.360 8.778 -8.909 1.00 0.00 O ATOM 0 H SER A 88 3.557 9.218 -6.875 1.00 0.00 H new ATOM 0 HA SER A 88 5.521 11.097 -7.690 1.00 0.00 H new ATOM 0 HB2 SER A 88 3.437 9.459 -9.190 1.00 0.00 H new ATOM 0 HB3 SER A 88 4.685 10.401 -9.982 1.00 0.00 H new ATOM 0 HG SER A 88 4.912 8.034 -8.455 1.00 0.00 H new ATOM 1239 N ARG A 89 2.374 12.006 -7.939 1.00 0.00 N ATOM 1240 CA ARG A 89 1.510 13.136 -8.268 1.00 0.00 C ATOM 1241 C ARG A 89 1.588 14.239 -7.208 1.00 0.00 C ATOM 1242 O ARG A 89 1.023 15.317 -7.389 1.00 0.00 O ATOM 1243 CB ARG A 89 0.054 12.689 -8.467 1.00 0.00 C ATOM 1244 CG ARG A 89 -0.643 12.197 -7.205 1.00 0.00 C ATOM 1245 CD ARG A 89 -2.133 12.014 -7.431 1.00 0.00 C ATOM 1246 NE ARG A 89 -2.778 13.270 -7.800 1.00 0.00 N ATOM 1247 CZ ARG A 89 -3.870 13.351 -8.552 1.00 0.00 C ATOM 1248 NH1 ARG A 89 -4.438 12.254 -9.036 1.00 0.00 N ATOM 1249 NH2 ARG A 89 -4.392 14.535 -8.827 1.00 0.00 N ATOM 0 H ARG A 89 1.895 11.208 -7.521 1.00 0.00 H new ATOM 0 HA ARG A 89 1.875 13.548 -9.209 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -0.514 13.524 -8.877 1.00 0.00 H new ATOM 0 HB3 ARG A 89 0.032 11.893 -9.211 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -0.202 11.251 -6.889 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -0.481 12.910 -6.396 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -2.295 11.277 -8.217 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -2.593 11.620 -6.525 1.00 0.00 H new ATOM 0 HE ARG A 89 -2.365 14.138 -7.460 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -4.036 11.339 -8.832 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -5.276 12.326 -9.613 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -3.956 15.382 -8.462 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -5.230 14.601 -9.404 1.00 0.00 H new ATOM 1263 N GLY A 90 2.271 13.969 -6.100 1.00 0.00 N ATOM 1264 CA GLY A 90 2.432 14.990 -5.076 1.00 0.00 C ATOM 1265 C GLY A 90 3.866 15.149 -4.600 1.00 0.00 C ATOM 1266 O GLY A 90 4.121 15.843 -3.617 1.00 0.00 O ATOM 0 H GLY A 90 2.712 13.073 -5.892 1.00 0.00 H new ATOM 0 HA2 GLY A 90 2.079 15.944 -5.467 1.00 0.00 H new ATOM 0 HA3 GLY A 90 1.800 14.741 -4.224 1.00 0.00 H new ATOM 1270 N ARG A 91 4.803 14.510 -5.286 1.00 0.00 N ATOM 1271 CA ARG A 91 6.212 14.576 -4.904 1.00 0.00 C ATOM 1272 C ARG A 91 7.101 14.139 -6.063 1.00 0.00 C ATOM 1273 O ARG A 91 8.044 14.836 -6.438 1.00 0.00 O ATOM 1274 CB ARG A 91 6.477 13.687 -3.680 1.00 0.00 C ATOM 1275 CG ARG A 91 7.915 13.718 -3.181 1.00 0.00 C ATOM 1276 CD ARG A 91 8.271 15.066 -2.573 1.00 0.00 C ATOM 1277 NE ARG A 91 9.683 15.144 -2.198 1.00 0.00 N ATOM 1278 CZ ARG A 91 10.128 15.086 -0.943 1.00 0.00 C ATOM 1279 NH1 ARG A 91 9.272 14.896 0.056 1.00 0.00 N ATOM 1280 NH2 ARG A 91 11.427 15.205 -0.689 1.00 0.00 N ATOM 0 H ARG A 91 4.616 13.939 -6.110 1.00 0.00 H new ATOM 0 HA ARG A 91 6.449 15.609 -4.649 1.00 0.00 H new ATOM 0 HB2 ARG A 91 5.817 13.998 -2.870 1.00 0.00 H new ATOM 0 HB3 ARG A 91 6.213 12.659 -3.929 1.00 0.00 H new ATOM 0 HG2 ARG A 91 8.059 12.934 -2.437 1.00 0.00 H new ATOM 0 HG3 ARG A 91 8.592 13.502 -4.008 1.00 0.00 H new ATOM 0 HD2 ARG A 91 8.042 15.857 -3.287 1.00 0.00 H new ATOM 0 HD3 ARG A 91 7.652 15.241 -1.693 1.00 0.00 H new ATOM 0 HE ARG A 91 10.370 15.249 -2.944 1.00 0.00 H new ATOM 0 HH11 ARG A 91 8.276 14.795 -0.138 1.00 0.00 H new ATOM 0 HH12 ARG A 91 9.611 14.851 1.017 1.00 0.00 H new ATOM 0 HH21 ARG A 91 12.086 15.341 -1.455 1.00 0.00 H new ATOM 0 HH22 ARG A 91 11.765 15.160 0.272 1.00 0.00 H new ATOM 1294 N GLY A 92 6.795 12.975 -6.618 1.00 0.00 N ATOM 1295 CA GLY A 92 7.564 12.450 -7.729 1.00 0.00 C ATOM 1296 C GLY A 92 8.509 11.356 -7.285 1.00 0.00 C ATOM 1297 O GLY A 92 8.477 10.243 -7.808 1.00 0.00 O ATOM 0 H GLY A 92 6.023 12.381 -6.316 1.00 0.00 H new ATOM 0 HA2 GLY A 92 6.887 12.060 -8.489 1.00 0.00 H new ATOM 0 HA3 GLY A 92 8.132 13.257 -8.192 1.00 0.00 H new ATOM 1301 N GLY A 93 9.337 11.678 -6.305 1.00 0.00 N ATOM 1302 CA GLY A 93 10.276 10.721 -5.771 1.00 0.00 C ATOM 1303 C GLY A 93 11.495 11.413 -5.210 1.00 0.00 C ATOM 1304 O GLY A 93 11.372 12.585 -4.800 1.00 0.00 O ATOM 1305 OXT GLY A 93 12.581 10.804 -5.187 1.00 0.00 O ATOM 0 H GLY A 93 9.374 12.598 -5.866 1.00 0.00 H new ATOM 0 HA2 GLY A 93 9.796 10.132 -4.989 1.00 0.00 H new ATOM 0 HA3 GLY A 93 10.577 10.025 -6.554 1.00 0.00 H new TER 1309 GLY A 93