USER MOD reduce.3.24.130724 H: found=0, std=0, add=752, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 752 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 52 SER OG : rot -120:sc= 1.02 USER MOD Set 1.2: A 54 ASN : amide:sc= 0.809 K(o=1.8,f=-5.6!) USER MOD Set 2.1: A 40 TYR OH : rot -140:sc= 0.107 USER MOD Set 2.2: A 78 LYS NZ :NH3+ 151:sc= 1.11 (180deg=-0.559) USER MOD Set 3.1: A 31 SER OG : rot -104:sc= 0.266 USER MOD Set 3.2: A 32 THR OG1 : rot -150:sc= 0.877 USER MOD Set 3.3: A 84 LYS NZ :NH3+ 179:sc= 2.1 (180deg=1.16) USER MOD Single : A 1 GLN : amide:sc= -0.673! C(o=-0.67!,f=-4.2!) USER MOD Single : A 1 GLN N :NH3+ -162:sc= -0.234 (180deg=-1.16!) USER MOD Single : A 3 HIS : no HD1:sc= 0.2 K(o=0.2,f=-2.9!) USER MOD Single : A 4 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ 166:sc= -0.0315 (180deg=-0.226) USER MOD Single : A 10 LYS NZ :NH3+ -153:sc= -0.161 (180deg=-0.832) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 CYS SG : rot 180:sc= -0.105 USER MOD Single : A 21 TYR OH : rot -161:sc= -1.02 USER MOD Single : A 25 MET CE :methyl -136:sc=-0.000527 (180deg=-0.0262) USER MOD Single : A 26 THR OG1 : rot 180:sc= 0.00635 USER MOD Single : A 27 THR OG1 : rot 170:sc= 0.409 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 THR OG1 : rot -90:sc=-0.00841 USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 THR OG1 : rot -90:sc= 1.24 USER MOD Single : A 41 GLN : amide:sc= 0.957 K(o=0.96,f=-0.27) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ -152:sc= 0.43 (180deg=0.0109) USER MOD Single : A 50 ASN : amide:sc= -0.131 X(o=-0.13,f=-0.15) USER MOD Single : A 51 THR OG1 : rot 126:sc= 1.08 USER MOD Single : A 53 LYS NZ :NH3+ -172:sc=-0.00411 (180deg=-0.0873) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 TYR OH : rot 99:sc= 0.00189 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 61 ASN : amide:sc= 0.163 X(o=0.16,f=0) USER MOD Single : A 63 SER OG : rot 43:sc= -2.14! USER MOD Single : A 64 MET CE :methyl -178:sc= -1.78 (180deg=-1.79) USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 68 ASN : amide:sc= -2.45! K(o=-2.5!,f=-1.8) USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 73 ASN : amide:sc= -1.07 K(o=-1.1,f=-3.7!) USER MOD Single : A 77 GLN : amide:sc= 0 X(o=0,f=-0.14) USER MOD Single : A 80 SER OG : rot 2:sc= 1.15 USER MOD Single : A 81 GLN : amide:sc= -1.62 K(o=-1.6,f=-0.057) USER MOD Single : A 87 GLN : amide:sc= 0.143 K(o=0.14,f=-4.7!) USER MOD Single : A 88 THR OG1 : rot 96:sc= 0.573 USER MOD Single : A 91 SER OG : rot 180:sc= 0.00241 USER MOD ----------------------------------------------------------------- ATOM 1 N GLN A 1 1.616 -5.965 -0.370 1.00 0.00 N ATOM 2 CA GLN A 1 2.339 -7.203 0.002 1.00 0.00 C ATOM 3 C GLN A 1 3.276 -7.624 -1.130 1.00 0.00 C ATOM 4 O GLN A 1 4.486 -7.391 -1.055 1.00 0.00 O ATOM 5 CB GLN A 1 1.351 -8.339 0.338 1.00 0.00 C ATOM 6 CG GLN A 1 0.551 -8.120 1.624 1.00 0.00 C ATOM 7 CD GLN A 1 -0.346 -6.894 1.567 1.00 0.00 C ATOM 8 OE1 GLN A 1 0.076 -5.789 1.908 1.00 0.00 O ATOM 9 NE2 GLN A 1 -1.583 -7.074 1.139 1.00 0.00 N ATOM 0 H1 GLN A 1 1.226 -5.520 0.486 1.00 0.00 H new ATOM 0 H2 GLN A 1 2.273 -5.306 -0.835 1.00 0.00 H new ATOM 0 H3 GLN A 1 0.840 -6.199 -1.022 1.00 0.00 H new ATOM 0 HA GLN A 1 2.933 -7.000 0.893 1.00 0.00 H new ATOM 0 HB2 GLN A 1 0.655 -8.457 -0.493 1.00 0.00 H new ATOM 0 HB3 GLN A 1 1.906 -9.273 0.424 1.00 0.00 H new ATOM 0 HG2 GLN A 1 -0.060 -9.001 1.819 1.00 0.00 H new ATOM 0 HG3 GLN A 1 1.241 -8.019 2.461 1.00 0.00 H new ATOM 0 HE21 GLN A 1 -1.897 -8.005 0.865 1.00 0.00 H new ATOM 0 HE22 GLN A 1 -2.223 -6.282 1.083 1.00 0.00 H new ATOM 20 N GLY A 2 2.712 -8.216 -2.185 1.00 0.00 N ATOM 21 CA GLY A 2 3.508 -8.638 -3.327 1.00 0.00 C ATOM 22 C GLY A 2 4.594 -9.632 -2.950 1.00 0.00 C ATOM 23 O GLY A 2 4.304 -10.787 -2.622 1.00 0.00 O ATOM 0 H GLY A 2 1.714 -8.411 -2.267 1.00 0.00 H new ATOM 0 HA2 GLY A 2 2.854 -9.087 -4.075 1.00 0.00 H new ATOM 0 HA3 GLY A 2 3.966 -7.763 -3.788 1.00 0.00 H new ATOM 27 N HIS A 3 5.844 -9.181 -2.990 1.00 0.00 N ATOM 28 CA HIS A 3 6.984 -10.021 -2.635 1.00 0.00 C ATOM 29 C HIS A 3 7.285 -9.893 -1.147 1.00 0.00 C ATOM 30 O HIS A 3 7.707 -8.831 -0.684 1.00 0.00 O ATOM 31 CB HIS A 3 8.222 -9.625 -3.454 1.00 0.00 C ATOM 32 CG HIS A 3 9.460 -10.402 -3.102 1.00 0.00 C ATOM 33 ND1 HIS A 3 10.455 -9.910 -2.283 1.00 0.00 N ATOM 34 CD2 HIS A 3 9.866 -11.638 -3.476 1.00 0.00 C ATOM 35 CE1 HIS A 3 11.415 -10.809 -2.172 1.00 0.00 C ATOM 36 NE2 HIS A 3 11.083 -11.867 -2.886 1.00 0.00 N ATOM 0 H HIS A 3 6.095 -8.232 -3.267 1.00 0.00 H new ATOM 0 HA HIS A 3 6.733 -11.057 -2.861 1.00 0.00 H new ATOM 0 HB2 HIS A 3 8.005 -9.766 -4.513 1.00 0.00 H new ATOM 0 HB3 HIS A 3 8.418 -8.563 -3.308 1.00 0.00 H new ATOM 0 HD2 HIS A 3 9.330 -12.319 -4.121 1.00 0.00 H new ATOM 0 HE1 HIS A 3 12.320 -10.697 -1.594 1.00 0.00 H new ATOM 0 HE2 HIS A 3 11.640 -12.716 -2.983 1.00 0.00 H new ATOM 45 N MET A 4 7.058 -10.972 -0.406 1.00 0.00 N ATOM 46 CA MET A 4 7.355 -11.004 1.025 1.00 0.00 C ATOM 47 C MET A 4 8.865 -10.884 1.255 1.00 0.00 C ATOM 48 O MET A 4 9.653 -11.205 0.361 1.00 0.00 O ATOM 49 CB MET A 4 6.828 -12.309 1.648 1.00 0.00 C ATOM 50 CG MET A 4 5.317 -12.476 1.541 1.00 0.00 C ATOM 51 SD MET A 4 4.411 -11.133 2.334 1.00 0.00 S ATOM 52 CE MET A 4 2.717 -11.645 2.043 1.00 0.00 C ATOM 0 H MET A 4 6.668 -11.840 -0.773 1.00 0.00 H new ATOM 0 HA MET A 4 6.858 -10.160 1.504 1.00 0.00 H new ATOM 0 HB2 MET A 4 7.313 -13.155 1.161 1.00 0.00 H new ATOM 0 HB3 MET A 4 7.114 -12.340 2.699 1.00 0.00 H new ATOM 0 HG2 MET A 4 5.035 -12.528 0.489 1.00 0.00 H new ATOM 0 HG3 MET A 4 5.027 -13.423 1.996 1.00 0.00 H new ATOM 0 HE1 MET A 4 2.036 -10.913 2.476 1.00 0.00 H new ATOM 0 HE2 MET A 4 2.538 -11.717 0.970 1.00 0.00 H new ATOM 0 HE3 MET A 4 2.546 -12.617 2.505 1.00 0.00 H new ATOM 62 N PRO A 5 9.292 -10.405 2.445 1.00 0.00 N ATOM 63 CA PRO A 5 10.718 -10.322 2.801 1.00 0.00 C ATOM 64 C PRO A 5 11.432 -11.653 2.568 1.00 0.00 C ATOM 65 O PRO A 5 12.565 -11.695 2.083 1.00 0.00 O ATOM 66 CB PRO A 5 10.693 -9.967 4.294 1.00 0.00 C ATOM 67 CG PRO A 5 9.399 -9.248 4.483 1.00 0.00 C ATOM 68 CD PRO A 5 8.425 -9.890 3.526 1.00 0.00 C ATOM 0 HA PRO A 5 11.259 -9.594 2.196 1.00 0.00 H new ATOM 0 HB2 PRO A 5 10.745 -10.861 4.916 1.00 0.00 H new ATOM 0 HB3 PRO A 5 11.540 -9.338 4.567 1.00 0.00 H new ATOM 0 HG2 PRO A 5 9.050 -9.335 5.512 1.00 0.00 H new ATOM 0 HG3 PRO A 5 9.509 -8.184 4.273 1.00 0.00 H new ATOM 0 HD2 PRO A 5 7.861 -10.691 4.004 1.00 0.00 H new ATOM 0 HD3 PRO A 5 7.699 -9.170 3.149 1.00 0.00 H new ATOM 76 N SER A 6 10.751 -12.737 2.920 1.00 0.00 N ATOM 77 CA SER A 6 11.240 -14.077 2.647 1.00 0.00 C ATOM 78 C SER A 6 11.092 -14.389 1.161 1.00 0.00 C ATOM 79 O SER A 6 9.981 -14.631 0.681 1.00 0.00 O ATOM 80 CB SER A 6 10.461 -15.100 3.480 1.00 0.00 C ATOM 81 OG SER A 6 10.567 -14.819 4.866 1.00 0.00 O ATOM 0 H SER A 6 9.851 -12.710 3.399 1.00 0.00 H new ATOM 0 HA SER A 6 12.294 -14.133 2.918 1.00 0.00 H new ATOM 0 HB2 SER A 6 9.412 -15.091 3.184 1.00 0.00 H new ATOM 0 HB3 SER A 6 10.841 -16.102 3.279 1.00 0.00 H new ATOM 0 HG SER A 6 10.060 -15.485 5.375 1.00 0.00 H new ATOM 87 N ASP A 7 12.205 -14.348 0.430 1.00 0.00 N ATOM 88 CA ASP A 7 12.192 -14.671 -0.994 1.00 0.00 C ATOM 89 C ASP A 7 11.735 -16.111 -1.197 1.00 0.00 C ATOM 90 O ASP A 7 11.106 -16.443 -2.206 1.00 0.00 O ATOM 91 CB ASP A 7 13.576 -14.460 -1.618 1.00 0.00 C ATOM 92 CG ASP A 7 13.564 -14.668 -3.125 1.00 0.00 C ATOM 93 OD1 ASP A 7 13.056 -13.783 -3.845 1.00 0.00 O ATOM 94 OD2 ASP A 7 14.043 -15.720 -3.598 1.00 0.00 O ATOM 0 H ASP A 7 13.122 -14.096 0.799 1.00 0.00 H new ATOM 0 HA ASP A 7 11.491 -14.001 -1.492 1.00 0.00 H new ATOM 0 HB2 ASP A 7 13.923 -13.451 -1.395 1.00 0.00 H new ATOM 0 HB3 ASP A 7 14.287 -15.150 -1.163 1.00 0.00 H new ATOM 99 N SER A 8 12.064 -16.961 -0.228 1.00 0.00 N ATOM 100 CA SER A 8 11.595 -18.336 -0.215 1.00 0.00 C ATOM 101 C SER A 8 10.082 -18.362 0.010 1.00 0.00 C ATOM 102 O SER A 8 9.604 -18.167 1.131 1.00 0.00 O ATOM 103 CB SER A 8 12.314 -19.123 0.885 1.00 0.00 C ATOM 104 OG SER A 8 13.724 -18.993 0.760 1.00 0.00 O ATOM 0 H SER A 8 12.659 -16.715 0.563 1.00 0.00 H new ATOM 0 HA SER A 8 11.816 -18.802 -1.175 1.00 0.00 H new ATOM 0 HB2 SER A 8 11.996 -18.762 1.863 1.00 0.00 H new ATOM 0 HB3 SER A 8 12.035 -20.175 0.827 1.00 0.00 H new ATOM 0 HG SER A 8 14.164 -19.502 1.473 1.00 0.00 H new ATOM 110 N LYS A 9 9.340 -18.568 -1.071 1.00 0.00 N ATOM 111 CA LYS A 9 7.881 -18.580 -1.026 1.00 0.00 C ATOM 112 C LYS A 9 7.387 -19.739 -0.162 1.00 0.00 C ATOM 113 O LYS A 9 7.917 -20.849 -0.246 1.00 0.00 O ATOM 114 CB LYS A 9 7.322 -18.699 -2.454 1.00 0.00 C ATOM 115 CG LYS A 9 7.867 -17.640 -3.414 1.00 0.00 C ATOM 116 CD LYS A 9 7.481 -17.919 -4.867 1.00 0.00 C ATOM 117 CE LYS A 9 5.984 -17.758 -5.117 1.00 0.00 C ATOM 118 NZ LYS A 9 5.523 -16.368 -4.858 1.00 0.00 N ATOM 0 H LYS A 9 9.729 -18.731 -2.000 1.00 0.00 H new ATOM 0 HA LYS A 9 7.529 -17.648 -0.583 1.00 0.00 H new ATOM 0 HB2 LYS A 9 7.557 -19.689 -2.846 1.00 0.00 H new ATOM 0 HB3 LYS A 9 6.235 -18.620 -2.418 1.00 0.00 H new ATOM 0 HG2 LYS A 9 7.490 -16.660 -3.122 1.00 0.00 H new ATOM 0 HG3 LYS A 9 8.953 -17.601 -3.330 1.00 0.00 H new ATOM 0 HD2 LYS A 9 8.030 -17.242 -5.521 1.00 0.00 H new ATOM 0 HD3 LYS A 9 7.783 -18.932 -5.131 1.00 0.00 H new ATOM 0 HE2 LYS A 9 5.757 -18.029 -6.148 1.00 0.00 H new ATOM 0 HE3 LYS A 9 5.433 -18.448 -4.478 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 4.572 -16.237 -5.258 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 5.493 -16.198 -3.832 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 6.181 -15.696 -5.302 1.00 0.00 H new ATOM 132 N LYS A 10 6.389 -19.476 0.677 1.00 0.00 N ATOM 133 CA LYS A 10 5.809 -20.512 1.529 1.00 0.00 C ATOM 134 C LYS A 10 5.140 -21.583 0.665 1.00 0.00 C ATOM 135 O LYS A 10 4.284 -21.263 -0.164 1.00 0.00 O ATOM 136 CB LYS A 10 4.789 -19.900 2.512 1.00 0.00 C ATOM 137 CG LYS A 10 5.371 -19.433 3.855 1.00 0.00 C ATOM 138 CD LYS A 10 6.544 -18.454 3.712 1.00 0.00 C ATOM 139 CE LYS A 10 7.899 -19.166 3.713 1.00 0.00 C ATOM 140 NZ LYS A 10 8.118 -19.947 4.963 1.00 0.00 N ATOM 0 H LYS A 10 5.965 -18.555 0.786 1.00 0.00 H new ATOM 0 HA LYS A 10 6.607 -20.974 2.110 1.00 0.00 H new ATOM 0 HB2 LYS A 10 4.308 -19.050 2.028 1.00 0.00 H new ATOM 0 HB3 LYS A 10 4.011 -20.638 2.709 1.00 0.00 H new ATOM 0 HG2 LYS A 10 4.582 -18.958 4.437 1.00 0.00 H new ATOM 0 HG3 LYS A 10 5.703 -20.304 4.420 1.00 0.00 H new ATOM 0 HD2 LYS A 10 6.433 -17.890 2.786 1.00 0.00 H new ATOM 0 HD3 LYS A 10 6.514 -17.733 4.529 1.00 0.00 H new ATOM 0 HE2 LYS A 10 7.958 -19.833 2.853 1.00 0.00 H new ATOM 0 HE3 LYS A 10 8.695 -18.430 3.601 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 9.138 -20.026 5.149 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 7.657 -19.463 5.760 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 7.712 -20.898 4.854 1.00 0.00 H new ATOM 154 N PRO A 11 5.538 -22.861 0.835 1.00 0.00 N ATOM 155 CA PRO A 11 4.988 -23.973 0.051 1.00 0.00 C ATOM 156 C PRO A 11 3.463 -24.006 0.095 1.00 0.00 C ATOM 157 O PRO A 11 2.868 -24.279 1.141 1.00 0.00 O ATOM 158 CB PRO A 11 5.577 -25.222 0.727 1.00 0.00 C ATOM 159 CG PRO A 11 6.821 -24.743 1.392 1.00 0.00 C ATOM 160 CD PRO A 11 6.550 -23.320 1.809 1.00 0.00 C ATOM 0 HA PRO A 11 5.243 -23.893 -1.006 1.00 0.00 H new ATOM 0 HB2 PRO A 11 4.880 -25.646 1.450 1.00 0.00 H new ATOM 0 HB3 PRO A 11 5.794 -26.002 -0.003 1.00 0.00 H new ATOM 0 HG2 PRO A 11 7.065 -25.362 2.255 1.00 0.00 H new ATOM 0 HG3 PRO A 11 7.671 -24.795 0.712 1.00 0.00 H new ATOM 0 HD2 PRO A 11 6.176 -23.266 2.832 1.00 0.00 H new ATOM 0 HD3 PRO A 11 7.453 -22.711 1.767 1.00 0.00 H new ATOM 168 N THR A 12 2.834 -23.701 -1.035 1.00 0.00 N ATOM 169 CA THR A 12 1.385 -23.724 -1.127 1.00 0.00 C ATOM 170 C THR A 12 0.878 -25.148 -0.912 1.00 0.00 C ATOM 171 O THR A 12 1.083 -26.030 -1.751 1.00 0.00 O ATOM 172 CB THR A 12 0.903 -23.187 -2.496 1.00 0.00 C ATOM 173 OG1 THR A 12 1.449 -21.876 -2.721 1.00 0.00 O ATOM 174 CG2 THR A 12 -0.623 -23.124 -2.564 1.00 0.00 C ATOM 0 H THR A 12 3.308 -23.435 -1.898 1.00 0.00 H new ATOM 0 HA THR A 12 0.981 -23.074 -0.351 1.00 0.00 H new ATOM 0 HB THR A 12 1.250 -23.872 -3.269 1.00 0.00 H new ATOM 0 HG1 THR A 12 1.144 -21.539 -3.589 1.00 0.00 H new ATOM 0 HG21 THR A 12 -0.928 -22.743 -3.538 1.00 0.00 H new ATOM 0 HG22 THR A 12 -1.035 -24.123 -2.420 1.00 0.00 H new ATOM 0 HG23 THR A 12 -0.995 -22.462 -1.782 1.00 0.00 H new ATOM 182 N ILE A 13 0.235 -25.364 0.227 1.00 0.00 N ATOM 183 CA ILE A 13 -0.260 -26.679 0.605 1.00 0.00 C ATOM 184 C ILE A 13 -1.615 -26.942 -0.044 1.00 0.00 C ATOM 185 O ILE A 13 -2.492 -26.079 -0.037 1.00 0.00 O ATOM 186 CB ILE A 13 -0.374 -26.799 2.148 1.00 0.00 C ATOM 187 CG1 ILE A 13 1.002 -26.559 2.802 1.00 0.00 C ATOM 188 CG2 ILE A 13 -0.939 -28.163 2.552 1.00 0.00 C ATOM 189 CD1 ILE A 13 2.041 -27.607 2.454 1.00 0.00 C ATOM 0 H ILE A 13 0.042 -24.634 0.913 1.00 0.00 H new ATOM 0 HA ILE A 13 0.450 -27.426 0.252 1.00 0.00 H new ATOM 0 HB ILE A 13 -1.066 -26.035 2.503 1.00 0.00 H new ATOM 0 HG12 ILE A 13 1.372 -25.580 2.497 1.00 0.00 H new ATOM 0 HG13 ILE A 13 0.878 -26.530 3.885 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -1.009 -28.221 3.638 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -1.931 -28.289 2.118 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -0.281 -28.952 2.188 1.00 0.00 H new ATOM 0 HD11 ILE A 13 2.980 -27.368 2.952 1.00 0.00 H new ATOM 0 HD12 ILE A 13 1.695 -28.586 2.784 1.00 0.00 H new ATOM 0 HD13 ILE A 13 2.196 -27.622 1.375 1.00 0.00 H new ATOM 201 N ILE A 14 -1.768 -28.130 -0.617 1.00 0.00 N ATOM 202 CA ILE A 14 -3.001 -28.506 -1.294 1.00 0.00 C ATOM 203 C ILE A 14 -4.065 -28.931 -0.286 1.00 0.00 C ATOM 204 O ILE A 14 -3.836 -29.825 0.535 1.00 0.00 O ATOM 205 CB ILE A 14 -2.754 -29.652 -2.309 1.00 0.00 C ATOM 206 CG1 ILE A 14 -1.791 -29.186 -3.415 1.00 0.00 C ATOM 207 CG2 ILE A 14 -4.068 -30.152 -2.907 1.00 0.00 C ATOM 208 CD1 ILE A 14 -2.288 -27.990 -4.205 1.00 0.00 C ATOM 0 H ILE A 14 -1.048 -28.853 -0.625 1.00 0.00 H new ATOM 0 HA ILE A 14 -3.357 -27.631 -1.837 1.00 0.00 H new ATOM 0 HB ILE A 14 -2.295 -30.486 -1.778 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -0.830 -28.936 -2.964 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -1.615 -30.014 -4.102 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -3.863 -30.955 -3.615 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -4.711 -30.526 -2.110 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -4.568 -29.332 -3.423 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -1.552 -27.724 -4.964 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -3.233 -28.240 -4.687 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -2.436 -27.145 -3.532 1.00 0.00 H new ATOM 220 N TYR A 15 -5.217 -28.271 -0.345 1.00 0.00 N ATOM 221 CA TYR A 15 -6.353 -28.600 0.509 1.00 0.00 C ATOM 222 C TYR A 15 -7.474 -29.220 -0.335 1.00 0.00 C ATOM 223 O TYR A 15 -7.733 -28.763 -1.451 1.00 0.00 O ATOM 224 CB TYR A 15 -6.858 -27.345 1.240 1.00 0.00 C ATOM 225 CG TYR A 15 -5.937 -26.863 2.353 1.00 0.00 C ATOM 226 CD1 TYR A 15 -4.774 -26.152 2.070 1.00 0.00 C ATOM 227 CD2 TYR A 15 -6.231 -27.125 3.689 1.00 0.00 C ATOM 228 CE1 TYR A 15 -3.937 -25.717 3.081 1.00 0.00 C ATOM 229 CE2 TYR A 15 -5.399 -26.692 4.704 1.00 0.00 C ATOM 230 CZ TYR A 15 -4.254 -25.990 4.396 1.00 0.00 C ATOM 231 OH TYR A 15 -3.423 -25.558 5.407 1.00 0.00 O ATOM 0 H TYR A 15 -5.389 -27.495 -0.984 1.00 0.00 H new ATOM 0 HA TYR A 15 -6.034 -29.324 1.259 1.00 0.00 H new ATOM 0 HB2 TYR A 15 -6.986 -26.541 0.515 1.00 0.00 H new ATOM 0 HB3 TYR A 15 -7.841 -27.554 1.661 1.00 0.00 H new ATOM 0 HD1 TYR A 15 -4.521 -25.936 1.042 1.00 0.00 H new ATOM 0 HD2 TYR A 15 -7.126 -27.677 3.936 1.00 0.00 H new ATOM 0 HE1 TYR A 15 -3.039 -25.166 2.843 1.00 0.00 H new ATOM 0 HE2 TYR A 15 -5.645 -26.903 5.734 1.00 0.00 H new ATOM 0 HH TYR A 15 -3.792 -25.832 6.273 1.00 0.00 H new ATOM 241 N PRO A 16 -8.172 -30.253 0.183 1.00 0.00 N ATOM 242 CA PRO A 16 -7.980 -30.760 1.546 1.00 0.00 C ATOM 243 C PRO A 16 -6.796 -31.721 1.671 1.00 0.00 C ATOM 244 O PRO A 16 -6.255 -32.202 0.669 1.00 0.00 O ATOM 245 CB PRO A 16 -9.300 -31.482 1.821 1.00 0.00 C ATOM 246 CG PRO A 16 -9.724 -32.003 0.488 1.00 0.00 C ATOM 247 CD PRO A 16 -9.207 -31.021 -0.541 1.00 0.00 C ATOM 0 HA PRO A 16 -7.747 -29.963 2.252 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -9.168 -32.291 2.540 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -10.045 -30.804 2.237 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -9.317 -32.999 0.313 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -10.809 -32.088 0.432 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -8.790 -31.534 -1.407 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -10.002 -30.372 -0.907 1.00 0.00 H new ATOM 255 N CYS A 17 -6.404 -31.992 2.911 1.00 0.00 N ATOM 256 CA CYS A 17 -5.269 -32.863 3.195 1.00 0.00 C ATOM 257 C CYS A 17 -5.337 -33.361 4.638 1.00 0.00 C ATOM 258 O CYS A 17 -5.953 -32.721 5.493 1.00 0.00 O ATOM 259 CB CYS A 17 -3.955 -32.102 2.954 1.00 0.00 C ATOM 260 SG CYS A 17 -2.464 -33.129 3.020 1.00 0.00 S ATOM 0 H CYS A 17 -6.860 -31.617 3.743 1.00 0.00 H new ATOM 0 HA CYS A 17 -5.305 -33.725 2.528 1.00 0.00 H new ATOM 0 HB2 CYS A 17 -4.004 -31.619 1.978 1.00 0.00 H new ATOM 0 HB3 CYS A 17 -3.868 -31.310 3.698 1.00 0.00 H new ATOM 0 HG CYS A 17 -1.418 -32.389 2.802 1.00 0.00 H new ATOM 266 N LEU A 18 -4.721 -34.510 4.897 1.00 0.00 N ATOM 267 CA LEU A 18 -4.645 -35.062 6.247 1.00 0.00 C ATOM 268 C LEU A 18 -3.526 -34.384 7.031 1.00 0.00 C ATOM 269 O LEU A 18 -2.341 -34.672 6.826 1.00 0.00 O ATOM 270 CB LEU A 18 -4.415 -36.579 6.188 1.00 0.00 C ATOM 271 CG LEU A 18 -5.605 -37.397 5.664 1.00 0.00 C ATOM 272 CD1 LEU A 18 -5.182 -38.825 5.339 1.00 0.00 C ATOM 273 CD2 LEU A 18 -6.744 -37.398 6.681 1.00 0.00 C ATOM 0 H LEU A 18 -4.264 -35.081 4.186 1.00 0.00 H new ATOM 0 HA LEU A 18 -5.590 -34.874 6.757 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -3.551 -36.776 5.553 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -4.163 -36.932 7.188 1.00 0.00 H new ATOM 0 HG LEU A 18 -5.959 -36.929 4.746 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -6.042 -39.384 4.970 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -4.404 -38.809 4.575 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -4.797 -39.304 6.239 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -7.578 -37.982 6.293 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -6.397 -37.838 7.616 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -7.071 -36.374 6.862 1.00 0.00 H new ATOM 285 N TRP A 19 -3.905 -33.478 7.921 1.00 0.00 N ATOM 286 CA TRP A 19 -2.945 -32.731 8.721 1.00 0.00 C ATOM 287 C TRP A 19 -2.686 -33.461 10.040 1.00 0.00 C ATOM 288 O TRP A 19 -3.600 -34.054 10.623 1.00 0.00 O ATOM 289 CB TRP A 19 -3.464 -31.310 8.987 1.00 0.00 C ATOM 290 CG TRP A 19 -2.411 -30.368 9.503 1.00 0.00 C ATOM 291 CD1 TRP A 19 -1.995 -30.220 10.797 1.00 0.00 C ATOM 292 CD2 TRP A 19 -1.640 -29.439 8.729 1.00 0.00 C ATOM 293 NE1 TRP A 19 -1.014 -29.262 10.872 1.00 0.00 N ATOM 294 CE2 TRP A 19 -0.780 -28.767 9.618 1.00 0.00 C ATOM 295 CE3 TRP A 19 -1.594 -29.112 7.370 1.00 0.00 C ATOM 296 CZ2 TRP A 19 0.116 -27.789 9.192 1.00 0.00 C ATOM 297 CZ3 TRP A 19 -0.704 -28.141 6.949 1.00 0.00 C ATOM 298 CH2 TRP A 19 0.138 -27.489 7.857 1.00 0.00 C ATOM 0 H TRP A 19 -4.879 -33.241 8.108 1.00 0.00 H new ATOM 0 HA TRP A 19 -2.007 -32.657 8.170 1.00 0.00 H new ATOM 0 HB2 TRP A 19 -3.879 -30.906 8.064 1.00 0.00 H new ATOM 0 HB3 TRP A 19 -4.279 -31.360 9.709 1.00 0.00 H new ATOM 0 HD1 TRP A 19 -2.382 -30.776 11.638 1.00 0.00 H new ATOM 0 HE1 TRP A 19 -0.537 -28.967 11.724 1.00 0.00 H new ATOM 0 HE3 TRP A 19 -2.242 -29.609 6.663 1.00 0.00 H new ATOM 0 HZ2 TRP A 19 0.769 -27.286 9.890 1.00 0.00 H new ATOM 0 HZ3 TRP A 19 -0.658 -27.881 5.902 1.00 0.00 H new ATOM 0 HH2 TRP A 19 0.820 -26.733 7.496 1.00 0.00 H new ATOM 309 N ASP A 20 -1.435 -33.426 10.489 1.00 0.00 N ATOM 310 CA ASP A 20 -1.031 -34.070 11.739 1.00 0.00 C ATOM 311 C ASP A 20 -0.840 -33.029 12.839 1.00 0.00 C ATOM 312 O ASP A 20 -0.152 -32.021 12.646 1.00 0.00 O ATOM 313 CB ASP A 20 0.267 -34.869 11.539 1.00 0.00 C ATOM 314 CG ASP A 20 1.418 -34.007 11.038 1.00 0.00 C ATOM 315 OD1 ASP A 20 1.393 -33.613 9.854 1.00 0.00 O ATOM 316 OD2 ASP A 20 2.347 -33.711 11.822 1.00 0.00 O ATOM 0 H ASP A 20 -0.674 -32.953 10.001 1.00 0.00 H new ATOM 0 HA ASP A 20 -1.822 -34.757 12.040 1.00 0.00 H new ATOM 0 HB2 ASP A 20 0.551 -35.334 12.483 1.00 0.00 H new ATOM 0 HB3 ASP A 20 0.086 -35.675 10.828 1.00 0.00 H new ATOM 321 N TYR A 21 -1.462 -33.275 13.984 1.00 0.00 N ATOM 322 CA TYR A 21 -1.357 -32.392 15.139 1.00 0.00 C ATOM 323 C TYR A 21 -0.647 -33.107 16.286 1.00 0.00 C ATOM 324 O TYR A 21 -1.154 -34.100 16.818 1.00 0.00 O ATOM 325 CB TYR A 21 -2.752 -31.937 15.598 1.00 0.00 C ATOM 326 CG TYR A 21 -3.503 -31.101 14.572 1.00 0.00 C ATOM 327 CD1 TYR A 21 -3.317 -29.723 14.496 1.00 0.00 C ATOM 328 CD2 TYR A 21 -4.401 -31.690 13.685 1.00 0.00 C ATOM 329 CE1 TYR A 21 -4.002 -28.959 13.569 1.00 0.00 C ATOM 330 CE2 TYR A 21 -5.086 -30.931 12.755 1.00 0.00 C ATOM 331 CZ TYR A 21 -4.885 -29.568 12.702 1.00 0.00 C ATOM 332 OH TYR A 21 -5.571 -28.813 11.778 1.00 0.00 O ATOM 0 H TYR A 21 -2.053 -34.092 14.139 1.00 0.00 H new ATOM 0 HA TYR A 21 -0.778 -31.515 14.849 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -3.348 -32.817 15.840 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -2.650 -31.359 16.517 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -2.626 -29.243 15.173 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -4.565 -32.757 13.725 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -3.846 -27.891 13.524 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -5.776 -31.404 12.072 1.00 0.00 H new ATOM 0 HH TYR A 21 -6.351 -29.314 11.460 1.00 0.00 H new ATOM 342 N ARG A 22 0.530 -32.610 16.650 1.00 0.00 N ATOM 343 CA ARG A 22 1.280 -33.142 17.786 1.00 0.00 C ATOM 344 C ARG A 22 0.755 -32.512 19.076 1.00 0.00 C ATOM 345 O ARG A 22 0.952 -31.317 19.321 1.00 0.00 O ATOM 346 CB ARG A 22 2.775 -32.841 17.611 1.00 0.00 C ATOM 347 CG ARG A 22 3.687 -33.440 18.681 1.00 0.00 C ATOM 348 CD ARG A 22 3.796 -34.957 18.568 1.00 0.00 C ATOM 349 NE ARG A 22 4.891 -35.482 19.396 1.00 0.00 N ATOM 350 CZ ARG A 22 5.624 -36.554 19.081 1.00 0.00 C ATOM 351 NH1 ARG A 22 5.350 -37.252 17.987 1.00 0.00 N ATOM 352 NH2 ARG A 22 6.637 -36.924 19.859 1.00 0.00 N ATOM 0 H ARG A 22 0.989 -31.834 16.172 1.00 0.00 H new ATOM 0 HA ARG A 22 1.150 -34.223 17.839 1.00 0.00 H new ATOM 0 HB2 ARG A 22 3.093 -33.211 16.636 1.00 0.00 H new ATOM 0 HB3 ARG A 22 2.913 -31.760 17.602 1.00 0.00 H new ATOM 0 HG2 ARG A 22 4.680 -33.000 18.596 1.00 0.00 H new ATOM 0 HG3 ARG A 22 3.306 -33.178 19.668 1.00 0.00 H new ATOM 0 HD2 ARG A 22 2.855 -35.414 18.875 1.00 0.00 H new ATOM 0 HD3 ARG A 22 3.961 -35.234 17.527 1.00 0.00 H new ATOM 0 HE ARG A 22 5.105 -34.997 20.267 1.00 0.00 H new ATOM 0 HH11 ARG A 22 4.578 -36.971 17.383 1.00 0.00 H new ATOM 0 HH12 ARG A 22 5.912 -38.070 17.750 1.00 0.00 H new ATOM 0 HH21 ARG A 22 6.857 -36.389 20.699 1.00 0.00 H new ATOM 0 HH22 ARG A 22 7.194 -37.743 19.616 1.00 0.00 H new ATOM 366 N VAL A 23 0.080 -33.316 19.890 1.00 0.00 N ATOM 367 CA VAL A 23 -0.568 -32.830 21.106 1.00 0.00 C ATOM 368 C VAL A 23 0.179 -33.317 22.346 1.00 0.00 C ATOM 369 O VAL A 23 0.093 -34.489 22.704 1.00 0.00 O ATOM 370 CB VAL A 23 -2.041 -33.311 21.182 1.00 0.00 C ATOM 371 CG1 VAL A 23 -2.749 -32.718 22.401 1.00 0.00 C ATOM 372 CG2 VAL A 23 -2.789 -32.972 19.892 1.00 0.00 C ATOM 0 H VAL A 23 -0.034 -34.317 19.729 1.00 0.00 H new ATOM 0 HA VAL A 23 -0.549 -31.741 21.074 1.00 0.00 H new ATOM 0 HB VAL A 23 -2.038 -34.395 21.295 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -3.780 -33.071 22.431 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -2.233 -33.030 23.309 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -2.740 -31.630 22.334 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -3.820 -33.318 19.967 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -2.779 -31.893 19.739 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -2.302 -33.463 19.049 1.00 0.00 H new ATOM 382 N ILE A 24 0.918 -32.422 22.992 1.00 0.00 N ATOM 383 CA ILE A 24 1.670 -32.772 24.196 1.00 0.00 C ATOM 384 C ILE A 24 0.918 -32.303 25.443 1.00 0.00 C ATOM 385 O ILE A 24 0.885 -31.106 25.747 1.00 0.00 O ATOM 386 CB ILE A 24 3.092 -32.152 24.175 1.00 0.00 C ATOM 387 CG1 ILE A 24 3.845 -32.586 22.904 1.00 0.00 C ATOM 388 CG2 ILE A 24 3.873 -32.553 25.428 1.00 0.00 C ATOM 389 CD1 ILE A 24 5.231 -31.988 22.771 1.00 0.00 C ATOM 0 H ILE A 24 1.014 -31.448 22.704 1.00 0.00 H new ATOM 0 HA ILE A 24 1.772 -33.857 24.221 1.00 0.00 H new ATOM 0 HB ILE A 24 2.997 -31.066 24.167 1.00 0.00 H new ATOM 0 HG12 ILE A 24 3.928 -33.673 22.897 1.00 0.00 H new ATOM 0 HG13 ILE A 24 3.255 -32.306 22.032 1.00 0.00 H new ATOM 0 HG21 ILE A 24 4.868 -32.108 25.395 1.00 0.00 H new ATOM 0 HG22 ILE A 24 3.346 -32.198 26.314 1.00 0.00 H new ATOM 0 HG23 ILE A 24 3.962 -33.639 25.469 1.00 0.00 H new ATOM 0 HD11 ILE A 24 5.694 -32.343 21.850 1.00 0.00 H new ATOM 0 HD12 ILE A 24 5.157 -30.901 22.744 1.00 0.00 H new ATOM 0 HD13 ILE A 24 5.841 -32.289 23.623 1.00 0.00 H new ATOM 401 N MET A 25 0.298 -33.250 26.148 1.00 0.00 N ATOM 402 CA MET A 25 -0.464 -32.944 27.361 1.00 0.00 C ATOM 403 C MET A 25 0.207 -33.564 28.582 1.00 0.00 C ATOM 404 O MET A 25 1.033 -34.467 28.453 1.00 0.00 O ATOM 405 CB MET A 25 -1.913 -33.457 27.252 1.00 0.00 C ATOM 406 CG MET A 25 -2.688 -32.886 26.070 1.00 0.00 C ATOM 407 SD MET A 25 -4.479 -33.063 26.248 1.00 0.00 S ATOM 408 CE MET A 25 -4.663 -34.844 26.336 1.00 0.00 C ATOM 0 H MET A 25 0.308 -34.239 25.899 1.00 0.00 H new ATOM 0 HA MET A 25 -0.487 -31.860 27.473 1.00 0.00 H new ATOM 0 HB2 MET A 25 -1.897 -34.544 27.171 1.00 0.00 H new ATOM 0 HB3 MET A 25 -2.444 -33.213 28.172 1.00 0.00 H new ATOM 0 HG2 MET A 25 -2.442 -31.830 25.957 1.00 0.00 H new ATOM 0 HG3 MET A 25 -2.368 -33.387 25.156 1.00 0.00 H new ATOM 0 HE1 MET A 25 -5.500 -35.155 25.711 1.00 0.00 H new ATOM 0 HE2 MET A 25 -3.749 -35.322 25.983 1.00 0.00 H new ATOM 0 HE3 MET A 25 -4.852 -35.140 27.368 1.00 0.00 H new ATOM 418 N THR A 26 -0.150 -33.070 29.765 1.00 0.00 N ATOM 419 CA THR A 26 0.372 -33.610 31.017 1.00 0.00 C ATOM 420 C THR A 26 -0.507 -34.752 31.524 1.00 0.00 C ATOM 421 O THR A 26 -0.228 -35.352 32.564 1.00 0.00 O ATOM 422 CB THR A 26 0.467 -32.510 32.099 1.00 0.00 C ATOM 423 OG1 THR A 26 -0.772 -31.790 32.171 1.00 0.00 O ATOM 424 CG2 THR A 26 1.607 -31.541 31.803 1.00 0.00 C ATOM 0 H THR A 26 -0.801 -32.294 29.882 1.00 0.00 H new ATOM 0 HA THR A 26 1.373 -33.993 30.817 1.00 0.00 H new ATOM 0 HB THR A 26 0.668 -32.992 33.056 1.00 0.00 H new ATOM 0 HG1 THR A 26 -0.707 -31.095 32.859 1.00 0.00 H new ATOM 0 HG21 THR A 26 1.648 -30.779 32.581 1.00 0.00 H new ATOM 0 HG22 THR A 26 2.551 -32.086 31.778 1.00 0.00 H new ATOM 0 HG23 THR A 26 1.438 -31.064 30.837 1.00 0.00 H new ATOM 432 N THR A 27 -1.565 -35.051 30.777 1.00 0.00 N ATOM 433 CA THR A 27 -2.480 -36.128 31.124 1.00 0.00 C ATOM 434 C THR A 27 -2.708 -37.030 29.917 1.00 0.00 C ATOM 435 O THR A 27 -2.571 -36.595 28.769 1.00 0.00 O ATOM 436 CB THR A 27 -3.851 -35.586 31.609 1.00 0.00 C ATOM 437 OG1 THR A 27 -4.667 -36.669 32.082 1.00 0.00 O ATOM 438 CG2 THR A 27 -4.586 -34.857 30.487 1.00 0.00 C ATOM 0 H THR A 27 -1.810 -34.556 29.919 1.00 0.00 H new ATOM 0 HA THR A 27 -2.022 -36.691 31.937 1.00 0.00 H new ATOM 0 HB THR A 27 -3.664 -34.881 32.419 1.00 0.00 H new ATOM 0 HG1 THR A 27 -5.459 -36.309 32.532 1.00 0.00 H new ATOM 0 HG21 THR A 27 -5.543 -34.489 30.858 1.00 0.00 H new ATOM 0 HG22 THR A 27 -3.983 -34.017 30.143 1.00 0.00 H new ATOM 0 HG23 THR A 27 -4.758 -35.544 29.658 1.00 0.00 H new ATOM 446 N LYS A 28 -3.046 -38.284 30.182 1.00 0.00 N ATOM 447 CA LYS A 28 -3.435 -39.218 29.133 1.00 0.00 C ATOM 448 C LYS A 28 -4.954 -39.255 29.015 1.00 0.00 C ATOM 449 O LYS A 28 -5.520 -40.060 28.266 1.00 0.00 O ATOM 450 CB LYS A 28 -2.873 -40.614 29.423 1.00 0.00 C ATOM 451 CG LYS A 28 -1.348 -40.647 29.466 1.00 0.00 C ATOM 452 CD LYS A 28 -0.809 -42.038 29.776 1.00 0.00 C ATOM 453 CE LYS A 28 -1.318 -42.559 31.114 1.00 0.00 C ATOM 454 NZ LYS A 28 -0.703 -43.863 31.466 1.00 0.00 N ATOM 0 H LYS A 28 -3.059 -38.681 31.122 1.00 0.00 H new ATOM 0 HA LYS A 28 -3.020 -38.882 28.183 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -3.265 -40.966 30.377 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -3.224 -41.307 28.658 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -0.952 -40.312 28.507 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -0.993 -39.945 30.221 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -1.102 -42.726 28.983 1.00 0.00 H new ATOM 0 HD3 LYS A 28 0.281 -42.011 29.788 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -1.099 -41.831 31.895 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -2.402 -42.667 31.074 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -1.074 -44.186 32.383 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -0.933 -44.564 30.733 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 0.329 -43.754 31.529 1.00 0.00 H new ATOM 468 N ASP A 29 -5.608 -38.365 29.761 1.00 0.00 N ATOM 469 CA ASP A 29 -7.053 -38.208 29.691 1.00 0.00 C ATOM 470 C ASP A 29 -7.414 -37.466 28.416 1.00 0.00 C ATOM 471 O ASP A 29 -7.684 -36.261 28.425 1.00 0.00 O ATOM 472 CB ASP A 29 -7.587 -37.454 30.921 1.00 0.00 C ATOM 473 CG ASP A 29 -9.084 -37.166 30.843 1.00 0.00 C ATOM 474 OD1 ASP A 29 -9.886 -38.094 31.071 1.00 0.00 O ATOM 475 OD2 ASP A 29 -9.467 -36.004 30.577 1.00 0.00 O ATOM 0 H ASP A 29 -5.152 -37.739 30.425 1.00 0.00 H new ATOM 0 HA ASP A 29 -7.516 -39.195 29.682 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -7.382 -38.041 31.817 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -7.047 -36.513 31.026 1.00 0.00 H new ATOM 480 N THR A 30 -7.349 -38.172 27.301 1.00 0.00 N ATOM 481 CA THR A 30 -7.731 -37.593 26.036 1.00 0.00 C ATOM 482 C THR A 30 -9.233 -37.778 25.832 1.00 0.00 C ATOM 483 O THR A 30 -9.713 -38.851 25.462 1.00 0.00 O ATOM 484 CB THR A 30 -6.915 -38.192 24.860 1.00 0.00 C ATOM 485 OG1 THR A 30 -7.389 -37.680 23.608 1.00 0.00 O ATOM 486 CG2 THR A 30 -6.966 -39.717 24.854 1.00 0.00 C ATOM 0 H THR A 30 -7.036 -39.142 27.251 1.00 0.00 H new ATOM 0 HA THR A 30 -7.505 -36.527 26.053 1.00 0.00 H new ATOM 0 HB THR A 30 -5.876 -37.893 25.000 1.00 0.00 H new ATOM 0 HG1 THR A 30 -8.096 -38.264 23.262 1.00 0.00 H new ATOM 0 HG21 THR A 30 -6.383 -40.097 24.016 1.00 0.00 H new ATOM 0 HG22 THR A 30 -6.552 -40.099 25.787 1.00 0.00 H new ATOM 0 HG23 THR A 30 -8.000 -40.046 24.755 1.00 0.00 H new ATOM 494 N SER A 31 -9.970 -36.720 26.122 1.00 0.00 N ATOM 495 CA SER A 31 -11.419 -36.724 26.024 1.00 0.00 C ATOM 496 C SER A 31 -11.873 -35.416 25.394 1.00 0.00 C ATOM 497 O SER A 31 -12.485 -35.402 24.321 1.00 0.00 O ATOM 498 CB SER A 31 -12.018 -36.896 27.425 1.00 0.00 C ATOM 499 OG SER A 31 -11.485 -35.931 28.327 1.00 0.00 O ATOM 0 H SER A 31 -9.579 -35.831 26.433 1.00 0.00 H new ATOM 0 HA SER A 31 -11.759 -37.550 25.400 1.00 0.00 H new ATOM 0 HB2 SER A 31 -13.102 -36.795 27.376 1.00 0.00 H new ATOM 0 HB3 SER A 31 -11.808 -37.900 27.794 1.00 0.00 H new ATOM 0 HG SER A 31 -10.826 -36.359 28.913 1.00 0.00 H new ATOM 505 N THR A 32 -11.528 -34.319 26.063 1.00 0.00 N ATOM 506 CA THR A 32 -11.757 -32.977 25.550 1.00 0.00 C ATOM 507 C THR A 32 -11.172 -32.847 24.139 1.00 0.00 C ATOM 508 O THR A 32 -11.738 -32.183 23.266 1.00 0.00 O ATOM 509 CB THR A 32 -11.091 -31.937 26.483 1.00 0.00 C ATOM 510 OG1 THR A 32 -11.179 -32.381 27.849 1.00 0.00 O ATOM 511 CG2 THR A 32 -11.754 -30.570 26.347 1.00 0.00 C ATOM 0 H THR A 32 -11.080 -34.339 26.979 1.00 0.00 H new ATOM 0 HA THR A 32 -12.831 -32.793 25.511 1.00 0.00 H new ATOM 0 HB THR A 32 -10.045 -31.842 26.192 1.00 0.00 H new ATOM 0 HG1 THR A 32 -11.218 -31.603 28.444 1.00 0.00 H new ATOM 0 HG21 THR A 32 -11.265 -29.860 27.014 1.00 0.00 H new ATOM 0 HG22 THR A 32 -11.663 -30.222 25.318 1.00 0.00 H new ATOM 0 HG23 THR A 32 -12.808 -30.649 26.611 1.00 0.00 H new ATOM 519 N LEU A 33 -10.037 -33.519 23.933 1.00 0.00 N ATOM 520 CA LEU A 33 -9.338 -33.517 22.652 1.00 0.00 C ATOM 521 C LEU A 33 -10.193 -34.164 21.562 1.00 0.00 C ATOM 522 O LEU A 33 -10.255 -33.672 20.442 1.00 0.00 O ATOM 523 CB LEU A 33 -7.994 -34.253 22.786 1.00 0.00 C ATOM 524 CG LEU A 33 -7.128 -34.301 21.513 1.00 0.00 C ATOM 525 CD1 LEU A 33 -6.782 -32.893 21.033 1.00 0.00 C ATOM 526 CD2 LEU A 33 -5.858 -35.115 21.757 1.00 0.00 C ATOM 0 H LEU A 33 -9.579 -34.079 24.652 1.00 0.00 H new ATOM 0 HA LEU A 33 -9.150 -32.483 22.363 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -7.417 -33.776 23.578 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -8.191 -35.276 23.108 1.00 0.00 H new ATOM 0 HG LEU A 33 -7.706 -34.791 20.730 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -6.170 -32.955 20.133 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -7.700 -32.349 20.811 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -6.229 -32.369 21.812 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -5.260 -35.137 20.846 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -5.280 -34.656 22.560 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -6.127 -36.133 22.039 1.00 0.00 H new ATOM 538 N LYS A 34 -10.866 -35.259 21.899 1.00 0.00 N ATOM 539 CA LYS A 34 -11.685 -35.973 20.922 1.00 0.00 C ATOM 540 C LYS A 34 -12.947 -35.180 20.594 1.00 0.00 C ATOM 541 O LYS A 34 -13.333 -35.072 19.430 1.00 0.00 O ATOM 542 CB LYS A 34 -12.052 -37.370 21.437 1.00 0.00 C ATOM 543 CG LYS A 34 -10.850 -38.292 21.627 1.00 0.00 C ATOM 544 CD LYS A 34 -11.275 -39.697 22.050 1.00 0.00 C ATOM 545 CE LYS A 34 -12.004 -39.694 23.390 1.00 0.00 C ATOM 546 NZ LYS A 34 -12.517 -41.044 23.746 1.00 0.00 N ATOM 0 H LYS A 34 -10.862 -35.670 22.833 1.00 0.00 H new ATOM 0 HA LYS A 34 -11.100 -36.085 20.009 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -12.576 -37.271 22.388 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -12.747 -37.834 20.737 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -10.284 -38.348 20.697 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -10.184 -37.871 22.381 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -11.923 -40.125 21.286 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -10.395 -40.337 22.117 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -11.328 -39.345 24.170 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -12.834 -38.989 23.350 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -13.006 -40.999 24.663 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -13.182 -41.367 23.015 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -11.722 -41.712 23.810 1.00 0.00 H new ATOM 560 N GLU A 35 -13.567 -34.609 21.626 1.00 0.00 N ATOM 561 CA GLU A 35 -14.792 -33.824 21.461 1.00 0.00 C ATOM 562 C GLU A 35 -14.626 -32.756 20.383 1.00 0.00 C ATOM 563 O GLU A 35 -15.465 -32.628 19.489 1.00 0.00 O ATOM 564 CB GLU A 35 -15.185 -33.159 22.788 1.00 0.00 C ATOM 565 CG GLU A 35 -15.740 -34.122 23.832 1.00 0.00 C ATOM 566 CD GLU A 35 -17.071 -34.735 23.417 1.00 0.00 C ATOM 567 OE1 GLU A 35 -17.970 -33.980 22.983 1.00 0.00 O ATOM 568 OE2 GLU A 35 -17.235 -35.967 23.547 1.00 0.00 O ATOM 0 H GLU A 35 -13.240 -34.675 22.590 1.00 0.00 H new ATOM 0 HA GLU A 35 -15.582 -34.508 21.151 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -14.311 -32.657 23.202 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -15.930 -32.389 22.588 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -15.017 -34.918 24.007 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -15.867 -33.594 24.777 1.00 0.00 H new ATOM 575 N LEU A 36 -13.538 -31.994 20.464 1.00 0.00 N ATOM 576 CA LEU A 36 -13.301 -30.906 19.520 1.00 0.00 C ATOM 577 C LEU A 36 -13.102 -31.454 18.108 1.00 0.00 C ATOM 578 O LEU A 36 -13.488 -30.820 17.135 1.00 0.00 O ATOM 579 CB LEU A 36 -12.094 -30.052 19.963 1.00 0.00 C ATOM 580 CG LEU A 36 -10.704 -30.718 19.852 1.00 0.00 C ATOM 581 CD1 LEU A 36 -10.071 -30.475 18.481 1.00 0.00 C ATOM 582 CD2 LEU A 36 -9.777 -30.234 20.964 1.00 0.00 C ATOM 0 H LEU A 36 -12.810 -32.109 21.170 1.00 0.00 H new ATOM 0 HA LEU A 36 -14.179 -30.261 19.509 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -12.084 -29.139 19.367 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -12.248 -29.754 21.000 1.00 0.00 H new ATOM 0 HG LEU A 36 -10.848 -31.792 19.966 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -9.095 -30.958 18.440 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -10.714 -30.890 17.705 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -9.953 -29.404 18.320 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -8.805 -30.717 20.864 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -9.654 -29.153 20.891 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -10.209 -30.485 21.933 1.00 0.00 H new ATOM 594 N LEU A 37 -12.517 -32.646 18.014 1.00 0.00 N ATOM 595 CA LEU A 37 -12.247 -33.279 16.724 1.00 0.00 C ATOM 596 C LEU A 37 -13.543 -33.772 16.083 1.00 0.00 C ATOM 597 O LEU A 37 -13.749 -33.629 14.875 1.00 0.00 O ATOM 598 CB LEU A 37 -11.274 -34.457 16.901 1.00 0.00 C ATOM 599 CG LEU A 37 -9.888 -34.093 17.459 1.00 0.00 C ATOM 600 CD1 LEU A 37 -9.094 -35.351 17.800 1.00 0.00 C ATOM 601 CD2 LEU A 37 -9.117 -33.222 16.470 1.00 0.00 C ATOM 0 H LEU A 37 -12.219 -33.196 18.820 1.00 0.00 H new ATOM 0 HA LEU A 37 -11.793 -32.536 16.069 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -11.733 -35.188 17.566 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -11.141 -34.944 15.935 1.00 0.00 H new ATOM 0 HG LEU A 37 -10.032 -33.522 18.376 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -8.117 -35.069 18.193 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -9.634 -35.930 18.550 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -8.964 -35.954 16.901 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -8.140 -32.977 16.886 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -8.987 -33.763 15.533 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -9.673 -32.303 16.284 1.00 0.00 H new ATOM 613 N GLU A 38 -14.420 -34.336 16.910 1.00 0.00 N ATOM 614 CA GLU A 38 -15.653 -34.956 16.429 1.00 0.00 C ATOM 615 C GLU A 38 -16.656 -33.919 15.925 1.00 0.00 C ATOM 616 O GLU A 38 -17.525 -34.246 15.122 1.00 0.00 O ATOM 617 CB GLU A 38 -16.293 -35.816 17.529 1.00 0.00 C ATOM 618 CG GLU A 38 -15.399 -36.952 18.018 1.00 0.00 C ATOM 619 CD GLU A 38 -16.118 -37.911 18.952 1.00 0.00 C ATOM 620 OE1 GLU A 38 -16.230 -37.608 20.159 1.00 0.00 O ATOM 621 OE2 GLU A 38 -16.586 -38.971 18.482 1.00 0.00 O ATOM 0 H GLU A 38 -14.299 -34.377 17.922 1.00 0.00 H new ATOM 0 HA GLU A 38 -15.383 -35.594 15.588 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -16.549 -35.177 18.374 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -17.226 -36.236 17.153 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -15.021 -37.505 17.158 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -14.535 -36.532 18.532 1.00 0.00 H new ATOM 628 N THR A 39 -16.531 -32.671 16.380 1.00 0.00 N ATOM 629 CA THR A 39 -17.467 -31.614 15.982 1.00 0.00 C ATOM 630 C THR A 39 -17.479 -31.432 14.461 1.00 0.00 C ATOM 631 O THR A 39 -18.511 -31.107 13.868 1.00 0.00 O ATOM 632 CB THR A 39 -17.125 -30.263 16.650 1.00 0.00 C ATOM 633 OG1 THR A 39 -15.785 -29.876 16.315 1.00 0.00 O ATOM 634 CG2 THR A 39 -17.273 -30.342 18.167 1.00 0.00 C ATOM 0 H THR A 39 -15.797 -32.367 17.020 1.00 0.00 H new ATOM 0 HA THR A 39 -18.455 -31.930 16.318 1.00 0.00 H new ATOM 0 HB THR A 39 -17.826 -29.516 16.277 1.00 0.00 H new ATOM 0 HG1 THR A 39 -15.164 -30.233 16.984 1.00 0.00 H new ATOM 0 HG21 THR A 39 -17.025 -29.376 18.608 1.00 0.00 H new ATOM 0 HG22 THR A 39 -18.301 -30.603 18.419 1.00 0.00 H new ATOM 0 HG23 THR A 39 -16.599 -31.103 18.559 1.00 0.00 H new ATOM 642 N TYR A 40 -16.329 -31.669 13.835 1.00 0.00 N ATOM 643 CA TYR A 40 -16.183 -31.509 12.388 1.00 0.00 C ATOM 644 C TYR A 40 -16.778 -32.711 11.650 1.00 0.00 C ATOM 645 O TYR A 40 -16.819 -32.737 10.420 1.00 0.00 O ATOM 646 CB TYR A 40 -14.699 -31.325 12.028 1.00 0.00 C ATOM 647 CG TYR A 40 -14.040 -30.188 12.792 1.00 0.00 C ATOM 648 CD1 TYR A 40 -14.053 -28.885 12.301 1.00 0.00 C ATOM 649 CD2 TYR A 40 -13.427 -30.417 14.019 1.00 0.00 C ATOM 650 CE1 TYR A 40 -13.475 -27.849 13.013 1.00 0.00 C ATOM 651 CE2 TYR A 40 -12.845 -29.387 14.732 1.00 0.00 C ATOM 652 CZ TYR A 40 -12.873 -28.106 14.226 1.00 0.00 C ATOM 653 OH TYR A 40 -12.313 -27.071 14.942 1.00 0.00 O ATOM 0 H TYR A 40 -15.479 -31.974 14.309 1.00 0.00 H new ATOM 0 HA TYR A 40 -16.730 -30.620 12.075 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -14.163 -32.252 12.233 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -14.611 -31.136 10.958 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -14.521 -28.680 11.350 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -13.406 -31.419 14.422 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -13.495 -26.843 12.620 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -12.370 -29.585 15.682 1.00 0.00 H new ATOM 0 HH TYR A 40 -11.471 -27.370 15.344 1.00 0.00 H new ATOM 663 N GLN A 41 -17.221 -33.710 12.424 1.00 0.00 N ATOM 664 CA GLN A 41 -17.895 -34.902 11.891 1.00 0.00 C ATOM 665 C GLN A 41 -17.027 -35.631 10.858 1.00 0.00 C ATOM 666 O GLN A 41 -17.535 -36.374 10.013 1.00 0.00 O ATOM 667 CB GLN A 41 -19.255 -34.521 11.277 1.00 0.00 C ATOM 668 CG GLN A 41 -20.275 -33.986 12.283 1.00 0.00 C ATOM 669 CD GLN A 41 -20.670 -35.014 13.336 1.00 0.00 C ATOM 670 OE1 GLN A 41 -21.601 -35.797 13.145 1.00 0.00 O ATOM 671 NE2 GLN A 41 -19.982 -35.001 14.464 1.00 0.00 N ATOM 0 H GLN A 41 -17.122 -33.715 13.439 1.00 0.00 H new ATOM 0 HA GLN A 41 -18.061 -35.586 12.723 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -19.094 -33.767 10.506 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -19.675 -35.397 10.783 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -19.862 -33.107 12.778 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -21.167 -33.660 11.749 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -19.217 -34.338 14.587 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -20.216 -35.654 15.212 1.00 0.00 H new ATOM 680 N ARG A 42 -15.716 -35.430 10.941 1.00 0.00 N ATOM 681 CA ARG A 42 -14.777 -36.062 10.017 1.00 0.00 C ATOM 682 C ARG A 42 -13.929 -37.098 10.755 1.00 0.00 C ATOM 683 O ARG A 42 -13.780 -37.023 11.979 1.00 0.00 O ATOM 684 CB ARG A 42 -13.874 -35.008 9.357 1.00 0.00 C ATOM 685 CG ARG A 42 -12.929 -34.295 10.322 1.00 0.00 C ATOM 686 CD ARG A 42 -11.912 -33.431 9.583 1.00 0.00 C ATOM 687 NE ARG A 42 -12.519 -32.274 8.916 1.00 0.00 N ATOM 688 CZ ARG A 42 -12.854 -32.230 7.623 1.00 0.00 C ATOM 689 NH1 ARG A 42 -12.729 -33.308 6.852 1.00 0.00 N ATOM 690 NH2 ARG A 42 -13.317 -31.105 7.098 1.00 0.00 N ATOM 0 H ARG A 42 -15.277 -34.832 11.641 1.00 0.00 H new ATOM 0 HA ARG A 42 -15.347 -36.564 9.235 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -13.283 -35.490 8.578 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -14.502 -34.264 8.867 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -13.508 -33.672 11.004 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -12.406 -35.033 10.930 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -11.159 -33.082 10.289 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -11.396 -34.041 8.842 1.00 0.00 H new ATOM 0 HE ARG A 42 -12.698 -31.443 9.480 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -12.374 -34.179 7.247 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -12.988 -33.263 5.866 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -13.417 -30.274 7.681 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -13.573 -31.070 6.111 1.00 0.00 H new ATOM 704 N PRO A 43 -13.369 -38.086 10.026 1.00 0.00 N ATOM 705 CA PRO A 43 -12.526 -39.128 10.626 1.00 0.00 C ATOM 706 C PRO A 43 -11.191 -38.577 11.133 1.00 0.00 C ATOM 707 O PRO A 43 -10.608 -37.669 10.530 1.00 0.00 O ATOM 708 CB PRO A 43 -12.304 -40.118 9.472 1.00 0.00 C ATOM 709 CG PRO A 43 -12.470 -39.302 8.236 1.00 0.00 C ATOM 710 CD PRO A 43 -13.524 -38.279 8.566 1.00 0.00 C ATOM 0 HA PRO A 43 -12.994 -39.578 11.502 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -11.312 -40.566 9.520 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -13.025 -40.935 9.507 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -11.533 -38.822 7.954 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -12.776 -39.923 7.394 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -13.367 -37.349 8.019 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -14.523 -38.634 8.311 1.00 0.00 H new ATOM 718 N PHE A 44 -10.714 -39.133 12.243 1.00 0.00 N ATOM 719 CA PHE A 44 -9.427 -38.751 12.811 1.00 0.00 C ATOM 720 C PHE A 44 -8.780 -39.953 13.491 1.00 0.00 C ATOM 721 O PHE A 44 -9.469 -40.894 13.895 1.00 0.00 O ATOM 722 CB PHE A 44 -9.591 -37.593 13.812 1.00 0.00 C ATOM 723 CG PHE A 44 -10.446 -37.928 15.014 1.00 0.00 C ATOM 724 CD1 PHE A 44 -11.821 -37.738 14.981 1.00 0.00 C ATOM 725 CD2 PHE A 44 -9.872 -38.428 16.177 1.00 0.00 C ATOM 726 CE1 PHE A 44 -12.603 -38.041 16.081 1.00 0.00 C ATOM 727 CE2 PHE A 44 -10.650 -38.732 17.278 1.00 0.00 C ATOM 728 CZ PHE A 44 -12.017 -38.538 17.230 1.00 0.00 C ATOM 0 H PHE A 44 -11.205 -39.855 12.770 1.00 0.00 H new ATOM 0 HA PHE A 44 -8.780 -38.410 12.003 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -8.604 -37.284 14.157 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -10.030 -36.740 13.295 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -12.285 -37.349 14.087 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -8.804 -38.581 16.221 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -13.672 -37.889 16.042 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -10.190 -39.121 18.175 1.00 0.00 H new ATOM 0 HZ PHE A 44 -12.627 -38.774 18.089 1.00 0.00 H new ATOM 738 N LYS A 45 -7.459 -39.923 13.613 1.00 0.00 N ATOM 739 CA LYS A 45 -6.723 -40.992 14.276 1.00 0.00 C ATOM 740 C LYS A 45 -6.048 -40.449 15.531 1.00 0.00 C ATOM 741 O LYS A 45 -5.280 -39.490 15.461 1.00 0.00 O ATOM 742 CB LYS A 45 -5.681 -41.595 13.325 1.00 0.00 C ATOM 743 CG LYS A 45 -4.970 -42.824 13.882 1.00 0.00 C ATOM 744 CD LYS A 45 -4.065 -43.475 12.838 1.00 0.00 C ATOM 745 CE LYS A 45 -3.352 -44.703 13.392 1.00 0.00 C ATOM 746 NZ LYS A 45 -2.623 -45.450 12.331 1.00 0.00 N ATOM 0 H LYS A 45 -6.873 -39.166 13.260 1.00 0.00 H new ATOM 0 HA LYS A 45 -7.421 -41.780 14.561 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -6.171 -41.864 12.389 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -4.937 -40.834 13.088 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -4.377 -42.539 14.751 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -5.709 -43.548 14.225 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -4.659 -43.761 11.970 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -3.327 -42.750 12.495 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -2.650 -44.396 14.167 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -4.080 -45.362 13.865 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -2.152 -46.277 12.750 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -3.296 -45.766 11.604 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -1.910 -44.829 11.897 1.00 0.00 H new ATOM 760 N LEU A 46 -6.356 -41.058 16.670 1.00 0.00 N ATOM 761 CA LEU A 46 -5.806 -40.646 17.959 1.00 0.00 C ATOM 762 C LEU A 46 -4.708 -41.619 18.382 1.00 0.00 C ATOM 763 O LEU A 46 -4.976 -42.803 18.593 1.00 0.00 O ATOM 764 CB LEU A 46 -6.926 -40.620 19.010 1.00 0.00 C ATOM 765 CG LEU A 46 -6.502 -40.207 20.430 1.00 0.00 C ATOM 766 CD1 LEU A 46 -6.051 -38.749 20.463 1.00 0.00 C ATOM 767 CD2 LEU A 46 -7.644 -40.444 21.415 1.00 0.00 C ATOM 0 H LEU A 46 -6.994 -41.852 16.728 1.00 0.00 H new ATOM 0 HA LEU A 46 -5.378 -39.647 17.872 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -7.702 -39.935 18.669 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -7.375 -41.612 19.059 1.00 0.00 H new ATOM 0 HG LEU A 46 -5.655 -40.825 20.728 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -5.757 -38.482 21.478 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -5.202 -38.615 19.792 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -6.872 -38.107 20.143 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -7.329 -40.147 22.415 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -8.510 -39.853 21.117 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -7.909 -41.501 21.417 1.00 0.00 H new ATOM 779 N GLU A 47 -3.475 -41.130 18.485 1.00 0.00 N ATOM 780 CA GLU A 47 -2.336 -41.985 18.823 1.00 0.00 C ATOM 781 C GLU A 47 -1.565 -41.451 20.024 1.00 0.00 C ATOM 782 O GLU A 47 -1.502 -40.242 20.246 1.00 0.00 O ATOM 783 CB GLU A 47 -1.369 -42.079 17.639 1.00 0.00 C ATOM 784 CG GLU A 47 -2.000 -42.544 16.338 1.00 0.00 C ATOM 785 CD GLU A 47 -0.977 -42.632 15.222 1.00 0.00 C ATOM 786 OE1 GLU A 47 -0.721 -41.609 14.562 1.00 0.00 O ATOM 787 OE2 GLU A 47 -0.405 -43.723 15.020 1.00 0.00 O ATOM 0 H GLU A 47 -3.237 -40.149 18.340 1.00 0.00 H new ATOM 0 HA GLU A 47 -2.740 -42.968 19.066 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -0.917 -41.100 17.478 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -0.562 -42.763 17.900 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -2.463 -43.520 16.486 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -2.794 -41.855 16.051 1.00 0.00 H new ATOM 794 N PHE A 48 -0.972 -42.367 20.780 1.00 0.00 N ATOM 795 CA PHE A 48 0.005 -42.023 21.808 1.00 0.00 C ATOM 796 C PHE A 48 1.400 -42.392 21.296 1.00 0.00 C ATOM 797 O PHE A 48 1.713 -43.572 21.140 1.00 0.00 O ATOM 798 CB PHE A 48 -0.308 -42.769 23.116 1.00 0.00 C ATOM 799 CG PHE A 48 0.700 -42.533 24.218 1.00 0.00 C ATOM 800 CD1 PHE A 48 0.699 -41.347 24.940 1.00 0.00 C ATOM 801 CD2 PHE A 48 1.650 -43.497 24.530 1.00 0.00 C ATOM 802 CE1 PHE A 48 1.620 -41.130 25.948 1.00 0.00 C ATOM 803 CE2 PHE A 48 2.573 -43.283 25.536 1.00 0.00 C ATOM 804 CZ PHE A 48 2.558 -42.099 26.245 1.00 0.00 C ATOM 0 H PHE A 48 -1.154 -43.367 20.699 1.00 0.00 H new ATOM 0 HA PHE A 48 -0.037 -40.954 22.017 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -1.293 -42.464 23.468 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -0.360 -43.838 22.909 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -0.031 -40.584 24.711 1.00 0.00 H new ATOM 0 HD2 PHE A 48 1.668 -44.426 23.979 1.00 0.00 H new ATOM 0 HE1 PHE A 48 1.606 -40.203 26.503 1.00 0.00 H new ATOM 0 HE2 PHE A 48 3.306 -44.042 25.767 1.00 0.00 H new ATOM 0 HZ PHE A 48 3.279 -41.930 27.031 1.00 0.00 H new ATOM 814 N LYS A 49 2.221 -41.389 21.005 1.00 0.00 N ATOM 815 CA LYS A 49 3.538 -41.625 20.413 1.00 0.00 C ATOM 816 C LYS A 49 4.568 -41.974 21.488 1.00 0.00 C ATOM 817 O LYS A 49 5.002 -43.121 21.597 1.00 0.00 O ATOM 818 CB LYS A 49 4.004 -40.391 19.619 1.00 0.00 C ATOM 819 CG LYS A 49 3.084 -39.970 18.465 1.00 0.00 C ATOM 820 CD LYS A 49 3.169 -40.899 17.241 1.00 0.00 C ATOM 821 CE LYS A 49 2.282 -42.137 17.368 1.00 0.00 C ATOM 822 NZ LYS A 49 2.214 -42.909 16.095 1.00 0.00 N ATOM 0 H LYS A 49 2.001 -40.406 21.168 1.00 0.00 H new ATOM 0 HA LYS A 49 3.450 -42.471 19.731 1.00 0.00 H new ATOM 0 HB2 LYS A 49 4.103 -39.552 20.308 1.00 0.00 H new ATOM 0 HB3 LYS A 49 4.997 -40.592 19.216 1.00 0.00 H new ATOM 0 HG2 LYS A 49 2.054 -39.946 18.822 1.00 0.00 H new ATOM 0 HG3 LYS A 49 3.339 -38.955 18.159 1.00 0.00 H new ATOM 0 HD2 LYS A 49 2.881 -40.343 16.349 1.00 0.00 H new ATOM 0 HD3 LYS A 49 4.203 -41.213 17.101 1.00 0.00 H new ATOM 0 HE2 LYS A 49 2.667 -42.779 18.161 1.00 0.00 H new ATOM 0 HE3 LYS A 49 1.277 -41.834 17.662 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 1.307 -43.416 16.044 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 2.292 -42.257 15.289 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 2.996 -43.594 16.062 1.00 0.00 H new ATOM 836 N ASN A 50 4.941 -40.979 22.289 1.00 0.00 N ATOM 837 CA ASN A 50 6.013 -41.136 23.275 1.00 0.00 C ATOM 838 C ASN A 50 5.676 -40.374 24.552 1.00 0.00 C ATOM 839 O ASN A 50 4.652 -39.691 24.627 1.00 0.00 O ATOM 840 CB ASN A 50 7.351 -40.611 22.714 1.00 0.00 C ATOM 841 CG ASN A 50 7.769 -41.276 21.410 1.00 0.00 C ATOM 842 OD1 ASN A 50 7.421 -40.810 20.325 1.00 0.00 O ATOM 843 ND2 ASN A 50 8.522 -42.362 21.505 1.00 0.00 N ATOM 0 H ASN A 50 4.517 -40.052 22.276 1.00 0.00 H new ATOM 0 HA ASN A 50 6.109 -42.199 23.498 1.00 0.00 H new ATOM 0 HB2 ASN A 50 7.271 -39.536 22.554 1.00 0.00 H new ATOM 0 HB3 ASN A 50 8.133 -40.766 23.458 1.00 0.00 H new ATOM 0 HD21 ASN A 50 8.834 -42.842 20.661 1.00 0.00 H new ATOM 0 HD22 ASN A 50 8.790 -42.718 22.422 1.00 0.00 H new ATOM 850 N THR A 51 6.546 -40.493 25.550 1.00 0.00 N ATOM 851 CA THR A 51 6.413 -39.746 26.793 1.00 0.00 C ATOM 852 C THR A 51 7.797 -39.424 27.354 1.00 0.00 C ATOM 853 O THR A 51 8.739 -40.210 27.197 1.00 0.00 O ATOM 854 CB THR A 51 5.583 -40.518 27.852 1.00 0.00 C ATOM 855 OG1 THR A 51 5.390 -39.704 29.017 1.00 0.00 O ATOM 856 CG2 THR A 51 6.261 -41.829 28.249 1.00 0.00 C ATOM 0 H THR A 51 7.359 -41.108 25.519 1.00 0.00 H new ATOM 0 HA THR A 51 5.880 -38.823 26.566 1.00 0.00 H new ATOM 0 HB THR A 51 4.617 -40.755 27.406 1.00 0.00 H new ATOM 0 HG1 THR A 51 4.433 -39.650 29.223 1.00 0.00 H new ATOM 0 HG21 THR A 51 5.652 -42.343 28.992 1.00 0.00 H new ATOM 0 HG22 THR A 51 6.371 -42.463 27.369 1.00 0.00 H new ATOM 0 HG23 THR A 51 7.244 -41.617 28.669 1.00 0.00 H new ATOM 864 N SER A 52 7.917 -38.257 27.976 1.00 0.00 N ATOM 865 CA SER A 52 9.169 -37.822 28.584 1.00 0.00 C ATOM 866 C SER A 52 9.598 -38.786 29.693 1.00 0.00 C ATOM 867 O SER A 52 8.776 -39.522 30.242 1.00 0.00 O ATOM 868 CB SER A 52 9.009 -36.402 29.141 1.00 0.00 C ATOM 869 OG SER A 52 10.219 -35.923 29.704 1.00 0.00 O ATOM 0 H SER A 52 7.153 -37.588 28.073 1.00 0.00 H new ATOM 0 HA SER A 52 9.947 -37.819 27.820 1.00 0.00 H new ATOM 0 HB2 SER A 52 8.688 -35.732 28.344 1.00 0.00 H new ATOM 0 HB3 SER A 52 8.226 -36.394 29.899 1.00 0.00 H new ATOM 0 HG SER A 52 10.078 -35.710 30.650 1.00 0.00 H new ATOM 875 N LYS A 53 10.886 -38.768 30.024 1.00 0.00 N ATOM 876 CA LYS A 53 11.434 -39.661 31.045 1.00 0.00 C ATOM 877 C LYS A 53 10.803 -39.384 32.410 1.00 0.00 C ATOM 878 O LYS A 53 10.675 -40.288 33.238 1.00 0.00 O ATOM 879 CB LYS A 53 12.966 -39.529 31.131 1.00 0.00 C ATOM 880 CG LYS A 53 13.727 -40.203 29.983 1.00 0.00 C ATOM 881 CD LYS A 53 13.416 -39.570 28.630 1.00 0.00 C ATOM 882 CE LYS A 53 14.145 -40.265 27.487 1.00 0.00 C ATOM 883 NZ LYS A 53 15.623 -40.167 27.618 1.00 0.00 N ATOM 0 H LYS A 53 11.572 -38.144 29.600 1.00 0.00 H new ATOM 0 HA LYS A 53 11.192 -40.683 30.753 1.00 0.00 H new ATOM 0 HB2 LYS A 53 13.226 -38.471 31.151 1.00 0.00 H new ATOM 0 HB3 LYS A 53 13.303 -39.958 32.075 1.00 0.00 H new ATOM 0 HG2 LYS A 53 14.798 -40.139 30.174 1.00 0.00 H new ATOM 0 HG3 LYS A 53 13.471 -41.262 29.953 1.00 0.00 H new ATOM 0 HD2 LYS A 53 12.342 -39.610 28.451 1.00 0.00 H new ATOM 0 HD3 LYS A 53 13.697 -38.517 28.651 1.00 0.00 H new ATOM 0 HE2 LYS A 53 13.854 -41.315 27.458 1.00 0.00 H new ATOM 0 HE3 LYS A 53 13.836 -39.823 26.540 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 16.073 -40.533 26.755 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 15.894 -39.172 27.755 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 15.937 -40.727 28.436 1.00 0.00 H new ATOM 897 N ASN A 54 10.398 -38.134 32.635 1.00 0.00 N ATOM 898 CA ASN A 54 9.760 -37.741 33.896 1.00 0.00 C ATOM 899 C ASN A 54 8.244 -37.939 33.810 1.00 0.00 C ATOM 900 O ASN A 54 7.519 -37.700 34.779 1.00 0.00 O ATOM 901 CB ASN A 54 10.097 -36.276 34.239 1.00 0.00 C ATOM 902 CG ASN A 54 9.422 -35.270 33.319 1.00 0.00 C ATOM 903 OD1 ASN A 54 9.069 -35.581 32.181 1.00 0.00 O ATOM 904 ND2 ASN A 54 9.250 -34.048 33.801 1.00 0.00 N ATOM 0 H ASN A 54 10.499 -37.375 31.962 1.00 0.00 H new ATOM 0 HA ASN A 54 10.147 -38.376 34.693 1.00 0.00 H new ATOM 0 HB2 ASN A 54 9.799 -36.074 35.268 1.00 0.00 H new ATOM 0 HB3 ASN A 54 11.177 -36.137 34.187 1.00 0.00 H new ATOM 0 HD21 ASN A 54 8.813 -33.329 33.224 1.00 0.00 H new ATOM 0 HD22 ASN A 54 9.555 -33.826 34.749 1.00 0.00 H new ATOM 911 N ALA A 55 7.782 -38.363 32.630 1.00 0.00 N ATOM 912 CA ALA A 55 6.371 -38.678 32.379 1.00 0.00 C ATOM 913 C ALA A 55 5.460 -37.461 32.569 1.00 0.00 C ATOM 914 O ALA A 55 4.244 -37.605 32.695 1.00 0.00 O ATOM 915 CB ALA A 55 5.915 -39.840 33.259 1.00 0.00 C ATOM 0 H ALA A 55 8.381 -38.499 31.815 1.00 0.00 H new ATOM 0 HA ALA A 55 6.289 -38.976 31.334 1.00 0.00 H new ATOM 0 HB1 ALA A 55 4.866 -40.059 33.058 1.00 0.00 H new ATOM 0 HB2 ALA A 55 6.518 -40.721 33.039 1.00 0.00 H new ATOM 0 HB3 ALA A 55 6.035 -39.571 34.308 1.00 0.00 H new ATOM 921 N LYS A 56 6.048 -36.265 32.575 1.00 0.00 N ATOM 922 CA LYS A 56 5.263 -35.032 32.663 1.00 0.00 C ATOM 923 C LYS A 56 4.634 -34.716 31.310 1.00 0.00 C ATOM 924 O LYS A 56 3.563 -34.114 31.229 1.00 0.00 O ATOM 925 CB LYS A 56 6.142 -33.849 33.103 1.00 0.00 C ATOM 926 CG LYS A 56 5.389 -32.519 33.168 1.00 0.00 C ATOM 927 CD LYS A 56 6.321 -31.333 33.402 1.00 0.00 C ATOM 928 CE LYS A 56 7.014 -31.394 34.757 1.00 0.00 C ATOM 929 NZ LYS A 56 7.894 -30.217 34.976 1.00 0.00 N ATOM 0 H LYS A 56 7.057 -36.123 32.521 1.00 0.00 H new ATOM 0 HA LYS A 56 4.481 -35.183 33.407 1.00 0.00 H new ATOM 0 HB2 LYS A 56 6.565 -34.066 34.084 1.00 0.00 H new ATOM 0 HB3 LYS A 56 6.978 -33.751 32.410 1.00 0.00 H new ATOM 0 HG2 LYS A 56 4.841 -32.369 32.238 1.00 0.00 H new ATOM 0 HG3 LYS A 56 4.651 -32.561 33.969 1.00 0.00 H new ATOM 0 HD2 LYS A 56 7.073 -31.305 32.614 1.00 0.00 H new ATOM 0 HD3 LYS A 56 5.750 -30.407 33.331 1.00 0.00 H new ATOM 0 HE2 LYS A 56 6.265 -31.441 35.547 1.00 0.00 H new ATOM 0 HE3 LYS A 56 7.605 -32.308 34.823 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 8.349 -30.292 35.908 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 8.624 -30.187 34.236 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 7.326 -29.347 34.938 1.00 0.00 H new ATOM 943 N PHE A 57 5.314 -35.134 30.250 1.00 0.00 N ATOM 944 CA PHE A 57 4.891 -34.829 28.890 1.00 0.00 C ATOM 945 C PHE A 57 4.458 -36.101 28.170 1.00 0.00 C ATOM 946 O PHE A 57 5.257 -37.019 27.981 1.00 0.00 O ATOM 947 CB PHE A 57 6.036 -34.154 28.118 1.00 0.00 C ATOM 948 CG PHE A 57 6.573 -32.910 28.788 1.00 0.00 C ATOM 949 CD1 PHE A 57 5.876 -31.711 28.717 1.00 0.00 C ATOM 950 CD2 PHE A 57 7.774 -32.939 29.484 1.00 0.00 C ATOM 951 CE1 PHE A 57 6.365 -30.572 29.327 1.00 0.00 C ATOM 952 CE2 PHE A 57 8.267 -31.801 30.093 1.00 0.00 C ATOM 953 CZ PHE A 57 7.562 -30.616 30.013 1.00 0.00 C ATOM 0 H PHE A 57 6.167 -35.690 30.308 1.00 0.00 H new ATOM 0 HA PHE A 57 4.043 -34.146 28.936 1.00 0.00 H new ATOM 0 HB2 PHE A 57 6.850 -34.869 27.995 1.00 0.00 H new ATOM 0 HB3 PHE A 57 5.685 -33.895 27.119 1.00 0.00 H new ATOM 0 HD1 PHE A 57 4.941 -31.668 28.179 1.00 0.00 H new ATOM 0 HD2 PHE A 57 8.330 -33.863 29.550 1.00 0.00 H new ATOM 0 HE1 PHE A 57 5.811 -29.647 29.267 1.00 0.00 H new ATOM 0 HE2 PHE A 57 9.203 -31.838 30.631 1.00 0.00 H new ATOM 0 HZ PHE A 57 7.947 -29.725 30.487 1.00 0.00 H new ATOM 963 N TYR A 58 3.184 -36.162 27.807 1.00 0.00 N ATOM 964 CA TYR A 58 2.652 -37.255 27.005 1.00 0.00 C ATOM 965 C TYR A 58 2.403 -36.762 25.584 1.00 0.00 C ATOM 966 O TYR A 58 1.569 -35.879 25.360 1.00 0.00 O ATOM 967 CB TYR A 58 1.354 -37.791 27.619 1.00 0.00 C ATOM 968 CG TYR A 58 1.521 -38.316 29.033 1.00 0.00 C ATOM 969 CD1 TYR A 58 2.210 -39.499 29.280 1.00 0.00 C ATOM 970 CD2 TYR A 58 0.984 -37.634 30.118 1.00 0.00 C ATOM 971 CE1 TYR A 58 2.362 -39.982 30.566 1.00 0.00 C ATOM 972 CE2 TYR A 58 1.133 -38.111 31.406 1.00 0.00 C ATOM 973 CZ TYR A 58 1.821 -39.285 31.626 1.00 0.00 C ATOM 974 OH TYR A 58 1.965 -39.765 32.911 1.00 0.00 O ATOM 0 H TYR A 58 2.492 -35.457 28.060 1.00 0.00 H new ATOM 0 HA TYR A 58 3.377 -38.069 26.983 1.00 0.00 H new ATOM 0 HB2 TYR A 58 0.608 -36.996 27.621 1.00 0.00 H new ATOM 0 HB3 TYR A 58 0.966 -38.590 26.987 1.00 0.00 H new ATOM 0 HD1 TYR A 58 2.633 -40.049 28.453 1.00 0.00 H new ATOM 0 HD2 TYR A 58 0.441 -36.715 29.952 1.00 0.00 H new ATOM 0 HE1 TYR A 58 2.902 -40.901 30.740 1.00 0.00 H new ATOM 0 HE2 TYR A 58 0.712 -37.566 32.238 1.00 0.00 H new ATOM 0 HH TYR A 58 2.699 -39.292 33.356 1.00 0.00 H new ATOM 984 N SER A 59 3.142 -37.318 24.633 1.00 0.00 N ATOM 985 CA SER A 59 3.059 -36.894 23.245 1.00 0.00 C ATOM 986 C SER A 59 2.013 -37.706 22.484 1.00 0.00 C ATOM 987 O SER A 59 2.177 -38.910 22.266 1.00 0.00 O ATOM 988 CB SER A 59 4.428 -37.035 22.575 1.00 0.00 C ATOM 989 OG SER A 59 5.407 -36.258 23.247 1.00 0.00 O ATOM 0 H SER A 59 3.810 -38.070 24.802 1.00 0.00 H new ATOM 0 HA SER A 59 2.754 -35.848 23.223 1.00 0.00 H new ATOM 0 HB2 SER A 59 4.729 -38.083 22.573 1.00 0.00 H new ATOM 0 HB3 SER A 59 4.361 -36.720 21.534 1.00 0.00 H new ATOM 0 HG SER A 59 6.273 -36.366 22.801 1.00 0.00 H new ATOM 995 N PHE A 60 0.944 -37.032 22.084 1.00 0.00 N ATOM 996 CA PHE A 60 -0.106 -37.634 21.272 1.00 0.00 C ATOM 997 C PHE A 60 0.010 -37.151 19.832 1.00 0.00 C ATOM 998 O PHE A 60 0.645 -36.128 19.558 1.00 0.00 O ATOM 999 CB PHE A 60 -1.497 -37.278 21.820 1.00 0.00 C ATOM 1000 CG PHE A 60 -1.804 -37.884 23.166 1.00 0.00 C ATOM 1001 CD1 PHE A 60 -2.235 -39.200 23.264 1.00 0.00 C ATOM 1002 CD2 PHE A 60 -1.669 -37.141 24.330 1.00 0.00 C ATOM 1003 CE1 PHE A 60 -2.520 -39.762 24.491 1.00 0.00 C ATOM 1004 CE2 PHE A 60 -1.954 -37.700 25.561 1.00 0.00 C ATOM 1005 CZ PHE A 60 -2.380 -39.012 25.641 1.00 0.00 C ATOM 0 H PHE A 60 0.779 -36.052 22.313 1.00 0.00 H new ATOM 0 HA PHE A 60 0.016 -38.717 21.308 1.00 0.00 H new ATOM 0 HB2 PHE A 60 -1.579 -36.194 21.895 1.00 0.00 H new ATOM 0 HB3 PHE A 60 -2.252 -37.606 21.105 1.00 0.00 H new ATOM 0 HD1 PHE A 60 -2.349 -39.792 22.368 1.00 0.00 H new ATOM 0 HD2 PHE A 60 -1.338 -36.115 24.273 1.00 0.00 H new ATOM 0 HE1 PHE A 60 -2.852 -40.788 24.552 1.00 0.00 H new ATOM 0 HE2 PHE A 60 -1.844 -37.112 26.460 1.00 0.00 H new ATOM 0 HZ PHE A 60 -2.603 -39.450 26.603 1.00 0.00 H new ATOM 1015 N ASN A 61 -0.607 -37.889 18.920 1.00 0.00 N ATOM 1016 CA ASN A 61 -0.602 -37.541 17.504 1.00 0.00 C ATOM 1017 C ASN A 61 -1.996 -37.729 16.926 1.00 0.00 C ATOM 1018 O ASN A 61 -2.564 -38.819 17.010 1.00 0.00 O ATOM 1019 CB ASN A 61 0.406 -38.410 16.740 1.00 0.00 C ATOM 1020 CG ASN A 61 0.444 -38.094 15.253 1.00 0.00 C ATOM 1021 OD1 ASN A 61 1.188 -37.216 14.813 1.00 0.00 O ATOM 1022 ND2 ASN A 61 -0.341 -38.814 14.465 1.00 0.00 N ATOM 0 H ASN A 61 -1.123 -38.742 19.138 1.00 0.00 H new ATOM 0 HA ASN A 61 -0.306 -36.497 17.399 1.00 0.00 H new ATOM 0 HB2 ASN A 61 1.400 -38.265 17.164 1.00 0.00 H new ATOM 0 HB3 ASN A 61 0.151 -39.461 16.878 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -0.342 -38.649 13.458 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -0.944 -39.533 14.865 1.00 0.00 H new ATOM 1029 N VAL A 62 -2.548 -36.662 16.364 1.00 0.00 N ATOM 1030 CA VAL A 62 -3.870 -36.705 15.753 1.00 0.00 C ATOM 1031 C VAL A 62 -3.768 -36.434 14.257 1.00 0.00 C ATOM 1032 O VAL A 62 -3.300 -35.374 13.844 1.00 0.00 O ATOM 1033 CB VAL A 62 -4.821 -35.664 16.396 1.00 0.00 C ATOM 1034 CG1 VAL A 62 -6.187 -35.677 15.710 1.00 0.00 C ATOM 1035 CG2 VAL A 62 -4.961 -35.913 17.899 1.00 0.00 C ATOM 0 H VAL A 62 -2.096 -35.749 16.319 1.00 0.00 H new ATOM 0 HA VAL A 62 -4.279 -37.702 15.920 1.00 0.00 H new ATOM 0 HB VAL A 62 -4.385 -34.675 16.257 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -6.837 -34.938 16.179 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -6.066 -35.436 14.654 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -6.634 -36.667 15.807 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -5.633 -35.171 18.330 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -5.367 -36.911 18.066 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -3.983 -35.835 18.373 1.00 0.00 H new ATOM 1045 N SER A 63 -4.194 -37.397 13.450 1.00 0.00 N ATOM 1046 CA SER A 63 -4.227 -37.227 12.003 1.00 0.00 C ATOM 1047 C SER A 63 -5.671 -37.069 11.533 1.00 0.00 C ATOM 1048 O SER A 63 -6.466 -38.013 11.607 1.00 0.00 O ATOM 1049 CB SER A 63 -3.556 -38.423 11.309 1.00 0.00 C ATOM 1050 OG SER A 63 -4.179 -39.642 11.667 1.00 0.00 O ATOM 0 H SER A 63 -4.522 -38.307 13.774 1.00 0.00 H new ATOM 0 HA SER A 63 -3.673 -36.327 11.737 1.00 0.00 H new ATOM 0 HB2 SER A 63 -3.603 -38.292 10.228 1.00 0.00 H new ATOM 0 HB3 SER A 63 -2.501 -38.458 11.580 1.00 0.00 H new ATOM 0 HG SER A 63 -5.152 -39.527 11.657 1.00 0.00 H new ATOM 1056 N MET A 64 -6.017 -35.875 11.067 1.00 0.00 N ATOM 1057 CA MET A 64 -7.374 -35.590 10.610 1.00 0.00 C ATOM 1058 C MET A 64 -7.338 -34.737 9.350 1.00 0.00 C ATOM 1059 O MET A 64 -6.314 -34.134 9.027 1.00 0.00 O ATOM 1060 CB MET A 64 -8.175 -34.878 11.712 1.00 0.00 C ATOM 1061 CG MET A 64 -7.697 -33.462 12.016 1.00 0.00 C ATOM 1062 SD MET A 64 -8.578 -32.711 13.399 1.00 0.00 S ATOM 1063 CE MET A 64 -10.280 -32.841 12.853 1.00 0.00 C ATOM 0 H MET A 64 -5.375 -35.086 10.995 1.00 0.00 H new ATOM 0 HA MET A 64 -7.867 -36.535 10.380 1.00 0.00 H new ATOM 0 HB2 MET A 64 -9.224 -34.840 11.417 1.00 0.00 H new ATOM 0 HB3 MET A 64 -8.122 -35.471 12.625 1.00 0.00 H new ATOM 0 HG2 MET A 64 -6.630 -33.483 12.239 1.00 0.00 H new ATOM 0 HG3 MET A 64 -7.825 -32.842 11.129 1.00 0.00 H new ATOM 0 HE1 MET A 64 -10.936 -32.384 13.594 1.00 0.00 H new ATOM 0 HE2 MET A 64 -10.396 -32.327 11.899 1.00 0.00 H new ATOM 0 HE3 MET A 64 -10.545 -33.892 12.734 1.00 0.00 H new ATOM 1073 N GLU A 65 -8.456 -34.698 8.636 1.00 0.00 N ATOM 1074 CA GLU A 65 -8.555 -33.921 7.406 1.00 0.00 C ATOM 1075 C GLU A 65 -8.726 -32.438 7.715 1.00 0.00 C ATOM 1076 O GLU A 65 -9.308 -32.071 8.738 1.00 0.00 O ATOM 1077 CB GLU A 65 -9.752 -34.385 6.569 1.00 0.00 C ATOM 1078 CG GLU A 65 -9.801 -35.880 6.305 1.00 0.00 C ATOM 1079 CD GLU A 65 -11.062 -36.281 5.561 1.00 0.00 C ATOM 1080 OE1 GLU A 65 -12.165 -36.055 6.102 1.00 0.00 O ATOM 1081 OE2 GLU A 65 -10.961 -36.797 4.426 1.00 0.00 O ATOM 0 H GLU A 65 -9.309 -35.197 8.888 1.00 0.00 H new ATOM 0 HA GLU A 65 -7.632 -34.074 6.847 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -10.670 -34.089 7.077 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -9.734 -33.861 5.613 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -8.927 -36.175 5.724 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -9.751 -36.418 7.252 1.00 0.00 H new ATOM 1088 N VAL A 66 -8.210 -31.599 6.832 1.00 0.00 N ATOM 1089 CA VAL A 66 -8.498 -30.172 6.852 1.00 0.00 C ATOM 1090 C VAL A 66 -8.854 -29.721 5.437 1.00 0.00 C ATOM 1091 O VAL A 66 -8.110 -29.983 4.489 1.00 0.00 O ATOM 1092 CB VAL A 66 -7.305 -29.335 7.397 1.00 0.00 C ATOM 1093 CG1 VAL A 66 -7.110 -29.578 8.894 1.00 0.00 C ATOM 1094 CG2 VAL A 66 -6.018 -29.647 6.634 1.00 0.00 C ATOM 0 H VAL A 66 -7.581 -31.886 6.082 1.00 0.00 H new ATOM 0 HA VAL A 66 -9.336 -30.004 7.528 1.00 0.00 H new ATOM 0 HB VAL A 66 -7.542 -28.282 7.246 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -6.271 -28.982 9.253 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -8.014 -29.290 9.430 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -6.906 -30.635 9.068 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -5.202 -29.047 7.037 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -5.779 -30.705 6.742 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -6.155 -29.412 5.579 1.00 0.00 H new ATOM 1104 N SER A 67 -10.002 -29.071 5.293 1.00 0.00 N ATOM 1105 CA SER A 67 -10.479 -28.622 3.989 1.00 0.00 C ATOM 1106 C SER A 67 -9.960 -27.219 3.690 1.00 0.00 C ATOM 1107 O SER A 67 -9.781 -26.848 2.528 1.00 0.00 O ATOM 1108 CB SER A 67 -12.015 -28.657 3.943 1.00 0.00 C ATOM 1109 OG SER A 67 -12.508 -28.320 2.655 1.00 0.00 O ATOM 0 H SER A 67 -10.624 -28.841 6.068 1.00 0.00 H new ATOM 0 HA SER A 67 -10.098 -29.298 3.223 1.00 0.00 H new ATOM 0 HB2 SER A 67 -12.365 -29.652 4.218 1.00 0.00 H new ATOM 0 HB3 SER A 67 -12.417 -27.962 4.680 1.00 0.00 H new ATOM 0 HG SER A 67 -13.487 -28.353 2.661 1.00 0.00 H new ATOM 1115 N ASN A 68 -9.712 -26.443 4.744 1.00 0.00 N ATOM 1116 CA ASN A 68 -9.134 -25.108 4.599 1.00 0.00 C ATOM 1117 C ASN A 68 -8.388 -24.705 5.862 1.00 0.00 C ATOM 1118 O ASN A 68 -8.482 -25.377 6.893 1.00 0.00 O ATOM 1119 CB ASN A 68 -10.195 -24.048 4.255 1.00 0.00 C ATOM 1120 CG ASN A 68 -11.240 -23.821 5.344 1.00 0.00 C ATOM 1121 OD1 ASN A 68 -11.666 -22.691 5.571 1.00 0.00 O ATOM 1122 ND2 ASN A 68 -11.693 -24.881 5.997 1.00 0.00 N ATOM 0 H ASN A 68 -9.902 -26.716 5.708 1.00 0.00 H new ATOM 0 HA ASN A 68 -8.433 -25.156 3.766 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -9.692 -23.103 4.049 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -10.703 -24.345 3.338 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -12.414 -24.771 6.710 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -11.320 -25.807 5.787 1.00 0.00 H new ATOM 1129 N GLU A 69 -7.663 -23.593 5.778 1.00 0.00 N ATOM 1130 CA GLU A 69 -6.810 -23.146 6.878 1.00 0.00 C ATOM 1131 C GLU A 69 -7.641 -22.750 8.096 1.00 0.00 C ATOM 1132 O GLU A 69 -7.160 -22.830 9.224 1.00 0.00 O ATOM 1133 CB GLU A 69 -5.907 -21.979 6.450 1.00 0.00 C ATOM 1134 CG GLU A 69 -5.019 -21.457 7.580 1.00 0.00 C ATOM 1135 CD GLU A 69 -4.072 -20.347 7.153 1.00 0.00 C ATOM 1136 OE1 GLU A 69 -4.549 -19.310 6.644 1.00 0.00 O ATOM 1137 OE2 GLU A 69 -2.847 -20.498 7.355 1.00 0.00 O ATOM 0 H GLU A 69 -7.648 -22.984 4.960 1.00 0.00 H new ATOM 0 HA GLU A 69 -6.173 -23.987 7.153 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -5.277 -22.301 5.621 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -6.529 -21.164 6.080 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -5.653 -21.091 8.388 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -4.435 -22.285 7.983 1.00 0.00 H new ATOM 1144 N SER A 70 -8.887 -22.334 7.869 1.00 0.00 N ATOM 1145 CA SER A 70 -9.783 -21.976 8.965 1.00 0.00 C ATOM 1146 C SER A 70 -9.847 -23.114 9.986 1.00 0.00 C ATOM 1147 O SER A 70 -9.841 -22.878 11.194 1.00 0.00 O ATOM 1148 CB SER A 70 -11.185 -21.653 8.432 1.00 0.00 C ATOM 1149 OG SER A 70 -12.051 -21.232 9.475 1.00 0.00 O ATOM 0 H SER A 70 -9.296 -22.237 6.940 1.00 0.00 H new ATOM 0 HA SER A 70 -9.392 -21.086 9.458 1.00 0.00 H new ATOM 0 HB2 SER A 70 -11.117 -20.871 7.675 1.00 0.00 H new ATOM 0 HB3 SER A 70 -11.602 -22.534 7.944 1.00 0.00 H new ATOM 0 HG SER A 70 -12.936 -21.032 9.105 1.00 0.00 H new ATOM 1155 N GLU A 71 -9.873 -24.348 9.488 1.00 0.00 N ATOM 1156 CA GLU A 71 -9.869 -25.531 10.346 1.00 0.00 C ATOM 1157 C GLU A 71 -8.472 -25.772 10.903 1.00 0.00 C ATOM 1158 O GLU A 71 -8.309 -26.075 12.080 1.00 0.00 O ATOM 1159 CB GLU A 71 -10.333 -26.758 9.556 1.00 0.00 C ATOM 1160 CG GLU A 71 -11.760 -26.645 9.036 1.00 0.00 C ATOM 1161 CD GLU A 71 -12.071 -27.684 7.975 1.00 0.00 C ATOM 1162 OE1 GLU A 71 -11.624 -27.498 6.826 1.00 0.00 O ATOM 1163 OE2 GLU A 71 -12.749 -28.688 8.282 1.00 0.00 O ATOM 0 H GLU A 71 -9.897 -24.555 8.490 1.00 0.00 H new ATOM 0 HA GLU A 71 -10.556 -25.362 11.175 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -9.659 -26.913 8.713 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -10.256 -27.640 10.192 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -12.457 -26.758 9.867 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -11.916 -25.649 8.622 1.00 0.00 H new ATOM 1170 N ARG A 72 -7.466 -25.617 10.045 1.00 0.00 N ATOM 1171 CA ARG A 72 -6.071 -25.839 10.432 1.00 0.00 C ATOM 1172 C ARG A 72 -5.707 -24.944 11.624 1.00 0.00 C ATOM 1173 O ARG A 72 -4.939 -25.340 12.503 1.00 0.00 O ATOM 1174 CB ARG A 72 -5.151 -25.576 9.220 1.00 0.00 C ATOM 1175 CG ARG A 72 -3.735 -26.153 9.336 1.00 0.00 C ATOM 1176 CD ARG A 72 -2.812 -25.296 10.197 1.00 0.00 C ATOM 1177 NE ARG A 72 -2.656 -23.942 9.656 1.00 0.00 N ATOM 1178 CZ ARG A 72 -1.898 -22.997 10.216 1.00 0.00 C ATOM 1179 NH1 ARG A 72 -1.187 -23.268 11.304 1.00 0.00 N ATOM 1180 NH2 ARG A 72 -1.836 -21.785 9.679 1.00 0.00 N ATOM 0 H ARG A 72 -7.590 -25.337 9.072 1.00 0.00 H new ATOM 0 HA ARG A 72 -5.934 -26.875 10.743 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -5.623 -25.991 8.329 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -5.076 -24.499 9.069 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -3.791 -27.156 9.759 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -3.306 -26.251 8.339 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -3.211 -25.238 11.210 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -1.835 -25.773 10.267 1.00 0.00 H new ATOM 0 HE ARG A 72 -3.158 -23.708 8.799 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -1.219 -24.201 11.715 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -0.609 -22.543 11.729 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -2.369 -21.573 8.835 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -1.256 -21.065 10.110 1.00 0.00 H new ATOM 1194 N ASN A 73 -6.283 -23.743 11.650 1.00 0.00 N ATOM 1195 CA ASN A 73 -6.082 -22.804 12.753 1.00 0.00 C ATOM 1196 C ASN A 73 -7.025 -23.132 13.908 1.00 0.00 C ATOM 1197 O ASN A 73 -6.590 -23.314 15.045 1.00 0.00 O ATOM 1198 CB ASN A 73 -6.325 -21.354 12.297 1.00 0.00 C ATOM 1199 CG ASN A 73 -5.292 -20.848 11.303 1.00 0.00 C ATOM 1200 OD1 ASN A 73 -4.146 -21.289 11.300 1.00 0.00 O ATOM 1201 ND2 ASN A 73 -5.689 -19.898 10.466 1.00 0.00 N ATOM 0 H ASN A 73 -6.897 -23.395 10.914 1.00 0.00 H new ATOM 0 HA ASN A 73 -5.049 -22.900 13.086 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -7.315 -21.285 11.846 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -6.326 -20.702 13.171 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -5.033 -19.508 9.789 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -6.650 -19.558 10.500 1.00 0.00 H new ATOM 1208 N GLU A 74 -8.319 -23.218 13.596 1.00 0.00 N ATOM 1209 CA GLU A 74 -9.354 -23.436 14.607 1.00 0.00 C ATOM 1210 C GLU A 74 -9.053 -24.669 15.456 1.00 0.00 C ATOM 1211 O GLU A 74 -9.068 -24.599 16.682 1.00 0.00 O ATOM 1212 CB GLU A 74 -10.734 -23.565 13.946 1.00 0.00 C ATOM 1213 CG GLU A 74 -11.853 -23.905 14.922 1.00 0.00 C ATOM 1214 CD GLU A 74 -13.238 -23.769 14.312 1.00 0.00 C ATOM 1215 OE1 GLU A 74 -13.674 -22.626 14.061 1.00 0.00 O ATOM 1216 OE2 GLU A 74 -13.897 -24.803 14.089 1.00 0.00 O ATOM 0 H GLU A 74 -8.677 -23.139 12.644 1.00 0.00 H new ATOM 0 HA GLU A 74 -9.361 -22.569 15.267 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -10.975 -22.628 13.443 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -10.688 -24.336 13.177 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -11.718 -24.926 15.278 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -11.780 -23.252 15.791 1.00 0.00 H new ATOM 1223 N ILE A 75 -8.768 -25.787 14.799 1.00 0.00 N ATOM 1224 CA ILE A 75 -8.453 -27.036 15.493 1.00 0.00 C ATOM 1225 C ILE A 75 -7.222 -26.857 16.376 1.00 0.00 C ATOM 1226 O ILE A 75 -7.205 -27.284 17.531 1.00 0.00 O ATOM 1227 CB ILE A 75 -8.218 -28.193 14.488 1.00 0.00 C ATOM 1228 CG1 ILE A 75 -9.477 -28.398 13.631 1.00 0.00 C ATOM 1229 CG2 ILE A 75 -7.841 -29.484 15.219 1.00 0.00 C ATOM 1230 CD1 ILE A 75 -9.302 -29.369 12.487 1.00 0.00 C ATOM 0 H ILE A 75 -8.748 -25.857 13.782 1.00 0.00 H new ATOM 0 HA ILE A 75 -9.308 -27.294 16.118 1.00 0.00 H new ATOM 0 HB ILE A 75 -7.386 -27.928 13.836 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -10.284 -28.752 14.272 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -9.789 -27.434 13.229 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -7.681 -30.280 14.492 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -6.926 -29.325 15.790 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -8.647 -29.767 15.896 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -10.238 -29.454 11.935 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -8.519 -29.008 11.820 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -9.022 -30.347 12.879 1.00 0.00 H new ATOM 1242 N PHE A 76 -6.208 -26.192 15.831 1.00 0.00 N ATOM 1243 CA PHE A 76 -4.981 -25.898 16.567 1.00 0.00 C ATOM 1244 C PHE A 76 -5.299 -25.104 17.838 1.00 0.00 C ATOM 1245 O PHE A 76 -4.660 -25.285 18.879 1.00 0.00 O ATOM 1246 CB PHE A 76 -4.013 -25.119 15.666 1.00 0.00 C ATOM 1247 CG PHE A 76 -2.718 -24.732 16.334 1.00 0.00 C ATOM 1248 CD1 PHE A 76 -1.744 -25.685 16.588 1.00 0.00 C ATOM 1249 CD2 PHE A 76 -2.474 -23.415 16.704 1.00 0.00 C ATOM 1250 CE1 PHE A 76 -0.556 -25.335 17.196 1.00 0.00 C ATOM 1251 CE2 PHE A 76 -1.287 -23.062 17.312 1.00 0.00 C ATOM 1252 CZ PHE A 76 -0.326 -24.023 17.558 1.00 0.00 C ATOM 0 H PHE A 76 -6.212 -25.843 14.873 1.00 0.00 H new ATOM 0 HA PHE A 76 -4.508 -26.834 16.864 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -3.788 -25.723 14.787 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -4.511 -24.215 15.314 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -1.917 -26.713 16.307 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -3.222 -22.659 16.514 1.00 0.00 H new ATOM 0 HE1 PHE A 76 0.194 -26.088 17.389 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -1.109 -22.035 17.595 1.00 0.00 H new ATOM 0 HZ PHE A 76 0.604 -23.748 18.033 1.00 0.00 H new ATOM 1262 N GLN A 77 -6.302 -24.236 17.740 1.00 0.00 N ATOM 1263 CA GLN A 77 -6.761 -23.441 18.875 1.00 0.00 C ATOM 1264 C GLN A 77 -7.598 -24.297 19.828 1.00 0.00 C ATOM 1265 O GLN A 77 -7.497 -24.169 21.048 1.00 0.00 O ATOM 1266 CB GLN A 77 -7.582 -22.243 18.384 1.00 0.00 C ATOM 1267 CG GLN A 77 -6.787 -21.264 17.524 1.00 0.00 C ATOM 1268 CD GLN A 77 -7.626 -20.092 17.039 1.00 0.00 C ATOM 1269 OE1 GLN A 77 -8.207 -20.129 15.950 1.00 0.00 O ATOM 1270 NE2 GLN A 77 -7.707 -19.051 17.850 1.00 0.00 N ATOM 0 H GLN A 77 -6.817 -24.064 16.877 1.00 0.00 H new ATOM 0 HA GLN A 77 -5.888 -23.074 19.415 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -8.433 -22.608 17.810 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -7.984 -21.711 19.247 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -5.941 -20.887 18.098 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -6.377 -21.793 16.663 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -7.212 -19.059 18.742 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -8.265 -18.240 17.584 1.00 0.00 H new ATOM 1279 N LYS A 78 -8.417 -25.181 19.263 1.00 0.00 N ATOM 1280 CA LYS A 78 -9.251 -26.082 20.057 1.00 0.00 C ATOM 1281 C LYS A 78 -8.380 -26.909 20.997 1.00 0.00 C ATOM 1282 O LYS A 78 -8.691 -27.074 22.177 1.00 0.00 O ATOM 1283 CB LYS A 78 -10.042 -27.030 19.145 1.00 0.00 C ATOM 1284 CG LYS A 78 -11.046 -26.352 18.218 1.00 0.00 C ATOM 1285 CD LYS A 78 -12.233 -25.768 18.977 1.00 0.00 C ATOM 1286 CE LYS A 78 -13.310 -25.267 18.021 1.00 0.00 C ATOM 1287 NZ LYS A 78 -13.806 -26.355 17.134 1.00 0.00 N ATOM 0 H LYS A 78 -8.522 -25.293 18.255 1.00 0.00 H new ATOM 0 HA LYS A 78 -9.948 -25.477 20.637 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -9.336 -27.597 18.538 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -10.575 -27.748 19.769 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -10.546 -25.558 17.663 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -11.406 -27.074 17.485 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -12.654 -26.526 19.637 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -11.895 -24.947 19.609 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -14.142 -24.856 18.593 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -12.909 -24.456 17.413 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -14.794 -26.165 16.871 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -13.221 -26.396 16.275 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -13.749 -27.264 17.635 1.00 0.00 H new ATOM 1301 N ILE A 79 -7.275 -27.404 20.451 1.00 0.00 N ATOM 1302 CA ILE A 79 -6.366 -28.287 21.177 1.00 0.00 C ATOM 1303 C ILE A 79 -5.735 -27.578 22.380 1.00 0.00 C ATOM 1304 O ILE A 79 -5.393 -28.211 23.374 1.00 0.00 O ATOM 1305 CB ILE A 79 -5.254 -28.838 20.245 1.00 0.00 C ATOM 1306 CG1 ILE A 79 -5.876 -29.595 19.058 1.00 0.00 C ATOM 1307 CG2 ILE A 79 -4.302 -29.751 21.018 1.00 0.00 C ATOM 1308 CD1 ILE A 79 -4.864 -30.082 18.042 1.00 0.00 C ATOM 0 H ILE A 79 -6.983 -27.206 19.494 1.00 0.00 H new ATOM 0 HA ILE A 79 -6.960 -29.124 21.544 1.00 0.00 H new ATOM 0 HB ILE A 79 -4.682 -27.994 19.860 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -6.435 -30.450 19.438 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -6.592 -28.942 18.559 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -3.531 -30.126 20.345 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -3.836 -29.189 21.827 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -4.860 -30.590 21.434 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -5.380 -30.605 17.237 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -4.321 -29.230 17.632 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -4.162 -30.761 18.525 1.00 0.00 H new ATOM 1320 N SER A 80 -5.572 -26.264 22.290 1.00 0.00 N ATOM 1321 CA SER A 80 -4.975 -25.505 23.385 1.00 0.00 C ATOM 1322 C SER A 80 -6.004 -25.193 24.475 1.00 0.00 C ATOM 1323 O SER A 80 -5.644 -24.884 25.611 1.00 0.00 O ATOM 1324 CB SER A 80 -4.345 -24.219 22.854 1.00 0.00 C ATOM 1325 OG SER A 80 -5.290 -23.428 22.152 1.00 0.00 O ATOM 0 H SER A 80 -5.841 -25.705 21.480 1.00 0.00 H new ATOM 0 HA SER A 80 -4.195 -26.119 23.835 1.00 0.00 H new ATOM 0 HB2 SER A 80 -3.933 -23.645 23.684 1.00 0.00 H new ATOM 0 HB3 SER A 80 -3.514 -24.466 22.194 1.00 0.00 H new ATOM 0 HG SER A 80 -6.167 -23.864 22.181 1.00 0.00 H new ATOM 1331 N GLN A 81 -7.287 -25.313 24.134 1.00 0.00 N ATOM 1332 CA GLN A 81 -8.372 -24.962 25.055 1.00 0.00 C ATOM 1333 C GLN A 81 -8.611 -26.062 26.091 1.00 0.00 C ATOM 1334 O GLN A 81 -9.505 -25.950 26.929 1.00 0.00 O ATOM 1335 CB GLN A 81 -9.667 -24.694 24.272 1.00 0.00 C ATOM 1336 CG GLN A 81 -9.579 -23.500 23.326 1.00 0.00 C ATOM 1337 CD GLN A 81 -10.846 -23.289 22.511 1.00 0.00 C ATOM 1338 OE1 GLN A 81 -11.190 -22.162 22.156 1.00 0.00 O ATOM 1339 NE2 GLN A 81 -11.543 -24.372 22.195 1.00 0.00 N ATOM 0 H GLN A 81 -7.603 -25.651 23.225 1.00 0.00 H new ATOM 0 HA GLN A 81 -8.074 -24.058 25.586 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -9.923 -25.584 23.696 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -10.480 -24.527 24.979 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -9.373 -22.600 23.905 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -8.738 -23.643 22.648 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -11.227 -25.291 22.507 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -12.395 -24.287 21.640 1.00 0.00 H new ATOM 1348 N LEU A 82 -7.812 -27.124 26.034 1.00 0.00 N ATOM 1349 CA LEU A 82 -7.977 -28.250 26.952 1.00 0.00 C ATOM 1350 C LEU A 82 -7.391 -27.915 28.321 1.00 0.00 C ATOM 1351 O LEU A 82 -7.804 -28.489 29.331 1.00 0.00 O ATOM 1352 CB LEU A 82 -7.301 -29.517 26.398 1.00 0.00 C ATOM 1353 CG LEU A 82 -7.412 -29.706 24.879 1.00 0.00 C ATOM 1354 CD1 LEU A 82 -6.653 -30.950 24.428 1.00 0.00 C ATOM 1355 CD2 LEU A 82 -8.869 -29.764 24.439 1.00 0.00 C ATOM 0 H LEU A 82 -7.048 -27.230 25.367 1.00 0.00 H new ATOM 0 HA LEU A 82 -9.045 -28.440 27.056 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -6.245 -29.494 26.669 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -7.738 -30.387 26.889 1.00 0.00 H new ATOM 0 HG LEU A 82 -6.954 -28.841 24.399 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -6.747 -31.062 23.348 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -5.600 -30.850 24.692 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -7.069 -31.829 24.921 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -8.918 -29.898 23.358 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -9.365 -30.601 24.931 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -9.369 -28.835 24.712 1.00 0.00 H new ATOM 1367 N ASP A 83 -6.402 -27.005 28.335 1.00 0.00 N ATOM 1368 CA ASP A 83 -5.670 -26.617 29.560 1.00 0.00 C ATOM 1369 C ASP A 83 -4.719 -27.732 30.019 1.00 0.00 C ATOM 1370 O ASP A 83 -3.656 -27.468 30.581 1.00 0.00 O ATOM 1371 CB ASP A 83 -6.645 -26.237 30.689 1.00 0.00 C ATOM 1372 CG ASP A 83 -5.951 -25.936 32.010 1.00 0.00 C ATOM 1373 OD1 ASP A 83 -5.435 -24.809 32.180 1.00 0.00 O ATOM 1374 OD2 ASP A 83 -5.942 -26.817 32.898 1.00 0.00 O ATOM 0 H ASP A 83 -6.085 -26.515 27.498 1.00 0.00 H new ATOM 0 HA ASP A 83 -5.068 -25.741 29.319 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -7.222 -25.364 30.383 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -7.354 -27.052 30.837 1.00 0.00 H new ATOM 1379 N LYS A 84 -5.118 -28.974 29.766 1.00 0.00 N ATOM 1380 CA LYS A 84 -4.311 -30.155 30.059 1.00 0.00 C ATOM 1381 C LYS A 84 -3.060 -30.192 29.178 1.00 0.00 C ATOM 1382 O LYS A 84 -2.081 -30.875 29.488 1.00 0.00 O ATOM 1383 CB LYS A 84 -5.161 -31.404 29.796 1.00 0.00 C ATOM 1384 CG LYS A 84 -6.481 -31.426 30.566 1.00 0.00 C ATOM 1385 CD LYS A 84 -7.485 -32.400 29.952 1.00 0.00 C ATOM 1386 CE LYS A 84 -8.755 -32.507 30.791 1.00 0.00 C ATOM 1387 NZ LYS A 84 -9.788 -33.359 30.142 1.00 0.00 N ATOM 0 H LYS A 84 -6.022 -29.192 29.347 1.00 0.00 H new ATOM 0 HA LYS A 84 -3.993 -30.122 31.101 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -5.373 -31.470 28.729 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -4.582 -32.289 30.061 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -6.292 -31.706 31.602 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -6.910 -30.424 30.580 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -7.741 -32.071 28.945 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -7.026 -33.384 29.859 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -8.508 -32.920 31.769 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -9.162 -31.510 30.959 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -10.626 -33.417 30.755 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -10.056 -32.943 29.227 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -9.405 -34.314 29.989 1.00 0.00 H new ATOM 1401 N VAL A 85 -3.115 -29.462 28.069 1.00 0.00 N ATOM 1402 CA VAL A 85 -2.036 -29.451 27.089 1.00 0.00 C ATOM 1403 C VAL A 85 -0.998 -28.381 27.429 1.00 0.00 C ATOM 1404 O VAL A 85 -1.346 -27.290 27.884 1.00 0.00 O ATOM 1405 CB VAL A 85 -2.591 -29.206 25.663 1.00 0.00 C ATOM 1406 CG1 VAL A 85 -3.255 -27.835 25.565 1.00 0.00 C ATOM 1407 CG2 VAL A 85 -1.496 -29.364 24.610 1.00 0.00 C ATOM 0 H VAL A 85 -3.905 -28.864 27.825 1.00 0.00 H new ATOM 0 HA VAL A 85 -1.554 -30.428 27.118 1.00 0.00 H new ATOM 0 HB VAL A 85 -3.351 -29.962 25.465 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -3.636 -27.687 24.555 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -4.079 -27.778 26.276 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -2.524 -27.060 25.794 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -1.915 -29.186 23.620 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -0.700 -28.644 24.802 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -1.090 -30.375 24.656 1.00 0.00 H new ATOM 1417 N VAL A 86 0.275 -28.700 27.214 1.00 0.00 N ATOM 1418 CA VAL A 86 1.364 -27.761 27.483 1.00 0.00 C ATOM 1419 C VAL A 86 2.022 -27.291 26.188 1.00 0.00 C ATOM 1420 O VAL A 86 2.613 -26.210 26.143 1.00 0.00 O ATOM 1421 CB VAL A 86 2.438 -28.382 28.411 1.00 0.00 C ATOM 1422 CG1 VAL A 86 1.856 -28.664 29.794 1.00 0.00 C ATOM 1423 CG2 VAL A 86 3.021 -29.655 27.797 1.00 0.00 C ATOM 0 H VAL A 86 0.580 -29.604 26.853 1.00 0.00 H new ATOM 0 HA VAL A 86 0.921 -26.903 27.989 1.00 0.00 H new ATOM 0 HB VAL A 86 3.248 -27.661 28.522 1.00 0.00 H new ATOM 0 HG11 VAL A 86 2.626 -29.100 30.431 1.00 0.00 H new ATOM 0 HG12 VAL A 86 1.503 -27.733 30.237 1.00 0.00 H new ATOM 0 HG13 VAL A 86 1.023 -29.361 29.703 1.00 0.00 H new ATOM 0 HG21 VAL A 86 3.772 -30.071 28.468 1.00 0.00 H new ATOM 0 HG22 VAL A 86 2.225 -30.384 27.647 1.00 0.00 H new ATOM 0 HG23 VAL A 86 3.482 -29.418 26.838 1.00 0.00 H new ATOM 1433 N GLN A 87 1.920 -28.099 25.134 1.00 0.00 N ATOM 1434 CA GLN A 87 2.505 -27.748 23.842 1.00 0.00 C ATOM 1435 C GLN A 87 1.683 -28.338 22.698 1.00 0.00 C ATOM 1436 O GLN A 87 1.247 -29.491 22.763 1.00 0.00 O ATOM 1437 CB GLN A 87 3.962 -28.234 23.757 1.00 0.00 C ATOM 1438 CG GLN A 87 4.667 -27.843 22.459 1.00 0.00 C ATOM 1439 CD GLN A 87 4.693 -26.338 22.237 1.00 0.00 C ATOM 1440 OE1 GLN A 87 3.777 -25.769 21.639 1.00 0.00 O ATOM 1441 NE2 GLN A 87 5.740 -25.685 22.715 1.00 0.00 N ATOM 0 H GLN A 87 1.439 -28.998 25.149 1.00 0.00 H new ATOM 0 HA GLN A 87 2.495 -26.662 23.750 1.00 0.00 H new ATOM 0 HB2 GLN A 87 4.521 -27.827 24.600 1.00 0.00 H new ATOM 0 HB3 GLN A 87 3.980 -29.319 23.857 1.00 0.00 H new ATOM 0 HG2 GLN A 87 5.689 -28.221 22.477 1.00 0.00 H new ATOM 0 HG3 GLN A 87 4.164 -28.322 21.619 1.00 0.00 H new ATOM 0 HE21 GLN A 87 6.478 -26.192 23.204 1.00 0.00 H new ATOM 0 HE22 GLN A 87 5.809 -24.675 22.594 1.00 0.00 H new ATOM 1450 N THR A 88 1.474 -27.534 21.659 1.00 0.00 N ATOM 1451 CA THR A 88 0.718 -27.948 20.481 1.00 0.00 C ATOM 1452 C THR A 88 1.507 -27.632 19.211 1.00 0.00 C ATOM 1453 O THR A 88 1.961 -26.502 19.021 1.00 0.00 O ATOM 1454 CB THR A 88 -0.656 -27.233 20.422 1.00 0.00 C ATOM 1455 OG1 THR A 88 -0.475 -25.812 20.511 1.00 0.00 O ATOM 1456 CG2 THR A 88 -1.572 -27.693 21.549 1.00 0.00 C ATOM 0 H THR A 88 1.824 -26.577 21.610 1.00 0.00 H new ATOM 0 HA THR A 88 0.551 -29.023 20.551 1.00 0.00 H new ATOM 0 HB THR A 88 -1.122 -27.490 19.471 1.00 0.00 H new ATOM 0 HG1 THR A 88 -0.463 -25.427 19.610 1.00 0.00 H new ATOM 0 HG21 THR A 88 -2.527 -27.172 21.478 1.00 0.00 H new ATOM 0 HG22 THR A 88 -1.738 -28.767 21.467 1.00 0.00 H new ATOM 0 HG23 THR A 88 -1.108 -27.470 22.509 1.00 0.00 H new ATOM 1464 N LEU A 89 1.691 -28.634 18.354 1.00 0.00 N ATOM 1465 CA LEU A 89 2.394 -28.441 17.088 1.00 0.00 C ATOM 1466 C LEU A 89 1.418 -28.554 15.918 1.00 0.00 C ATOM 1467 O LEU A 89 0.937 -29.644 15.595 1.00 0.00 O ATOM 1468 CB LEU A 89 3.543 -29.453 16.920 1.00 0.00 C ATOM 1469 CG LEU A 89 4.720 -29.326 17.913 1.00 0.00 C ATOM 1470 CD1 LEU A 89 5.270 -27.902 17.931 1.00 0.00 C ATOM 1471 CD2 LEU A 89 4.315 -29.772 19.318 1.00 0.00 C ATOM 0 H LEU A 89 1.363 -29.587 18.513 1.00 0.00 H new ATOM 0 HA LEU A 89 2.827 -27.441 17.098 1.00 0.00 H new ATOM 0 HB2 LEU A 89 3.129 -30.458 17.007 1.00 0.00 H new ATOM 0 HB3 LEU A 89 3.937 -29.357 15.908 1.00 0.00 H new ATOM 0 HG LEU A 89 5.513 -29.991 17.570 1.00 0.00 H new ATOM 0 HD11 LEU A 89 6.097 -27.840 18.638 1.00 0.00 H new ATOM 0 HD12 LEU A 89 5.623 -27.636 16.935 1.00 0.00 H new ATOM 0 HD13 LEU A 89 4.482 -27.212 18.233 1.00 0.00 H new ATOM 0 HD21 LEU A 89 5.166 -29.670 19.992 1.00 0.00 H new ATOM 0 HD22 LEU A 89 3.494 -29.150 19.674 1.00 0.00 H new ATOM 0 HD23 LEU A 89 3.996 -30.814 19.291 1.00 0.00 H new ATOM 1483 N GLY A 90 1.115 -27.410 15.315 1.00 0.00 N ATOM 1484 CA GLY A 90 0.246 -27.358 14.150 1.00 0.00 C ATOM 1485 C GLY A 90 0.489 -26.095 13.346 1.00 0.00 C ATOM 1486 O GLY A 90 -0.373 -25.637 12.591 1.00 0.00 O ATOM 0 H GLY A 90 1.463 -26.500 15.618 1.00 0.00 H new ATOM 0 HA2 GLY A 90 0.421 -28.232 13.522 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -0.796 -27.396 14.467 1.00 0.00 H new ATOM 1490 N SER A 91 1.667 -25.515 13.546 1.00 0.00 N ATOM 1491 CA SER A 91 2.091 -24.312 12.872 1.00 0.00 C ATOM 1492 C SER A 91 3.615 -24.336 12.714 1.00 0.00 C ATOM 1493 O SER A 91 4.106 -24.478 11.575 1.00 0.00 O ATOM 1494 CB SER A 91 1.665 -23.096 13.691 1.00 0.00 C ATOM 1495 OG SER A 91 0.249 -22.996 13.786 1.00 0.00 O ATOM 1496 OXT SER A 91 4.317 -24.244 13.749 1.00 0.00 O ATOM 0 H SER A 91 2.362 -25.882 14.196 1.00 0.00 H new ATOM 0 HA SER A 91 1.629 -24.254 11.886 1.00 0.00 H new ATOM 0 HB2 SER A 91 2.093 -23.163 14.691 1.00 0.00 H new ATOM 0 HB3 SER A 91 2.064 -22.191 13.233 1.00 0.00 H new ATOM 0 HG SER A 91 0.012 -22.208 14.318 1.00 0.00 H new TER 1502 SER A 91