USER MOD reduce.3.24.130724 H: found=0, std=0, add=796, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 791 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 11 CYS SG : rot 180:sc= 0 USER MOD Single : A 14 ASN : amide:sc= -1.3 K(o=-1.3,f=-3.6!) USER MOD Single : A 19 SER OG : rot -80:sc= 0.694 USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 23 THR OG1 : rot 146:sc= 0.0693 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 33 THR OG1 : rot 54:sc= 1.13 USER MOD Single : A 34 TYR OH : rot 180:sc= -0.608 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 THR OG1 : rot -97:sc= 1.01 USER MOD Single : A 39 THR OG1 : rot 32:sc= -0.947 USER MOD Single : A 41 GLN : amide:sc=-0.00544 X(o=-0.0054,f=-0.0054) USER MOD Single : A 42 TYR OH : rot -109:sc= 0.791 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ 145:sc=-0.00847 (180deg=-0.243) USER MOD Single : A 52 ASN : amide:sc=-0.00424 X(o=-0.0042,f=0) USER MOD Single : A 54 SER OG : rot -34:sc= 0.22 USER MOD Single : A 55 ASN : amide:sc= -1.14 K(o=-1.1,f=-1.6) USER MOD Single : A 58 SER OG : rot 170:sc= -0.801 USER MOD Single : A 67 HIS : no HD1:sc= -2.85 X(o=-2.9,f=-2.9) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 THR OG1 : rot -16:sc= 0.59 USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 MET CE :methyl -141:sc= -1.08 (180deg=-5.32!) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 GLN : amide:sc= 0 K(o=0,f=-0.83) USER MOD Single : A 83 THR OG1 : rot 180:sc= -0.0342 USER MOD Single : A 85 HIS : no HD1:sc= 0 X(o=0,f=-0.08) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 90 HIS :FLIP no HE2:sc= -0.185 F(o=-1.4,f=-0.19) USER MOD Single : A 95 ASN : amide:sc= -0.167 X(o=-0.17,f=-0.64) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot 180:sc= 0.0257 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -9.418 10.144 -11.208 1.00 0.00 N ATOM 2 CA GLY A 1 -9.053 11.418 -10.618 1.00 0.00 C ATOM 3 C GLY A 1 -9.755 11.667 -9.298 1.00 0.00 C ATOM 4 O GLY A 1 -10.728 12.418 -9.236 1.00 0.00 O ATOM 0 H1 GLY A 1 -8.912 10.021 -12.108 1.00 0.00 H new ATOM 0 H2 GLY A 1 -9.161 9.374 -10.558 1.00 0.00 H new ATOM 0 H3 GLY A 1 -10.443 10.123 -11.381 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -7.974 11.448 -10.464 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -9.298 12.221 -11.314 1.00 0.00 H new ATOM 8 N SER A 2 -9.263 11.033 -8.238 1.00 0.00 N ATOM 9 CA SER A 2 -9.853 11.184 -6.913 1.00 0.00 C ATOM 10 C SER A 2 -8.946 10.583 -5.843 1.00 0.00 C ATOM 11 O SER A 2 -9.140 9.444 -5.420 1.00 0.00 O ATOM 12 CB SER A 2 -11.229 10.519 -6.866 1.00 0.00 C ATOM 13 OG SER A 2 -11.955 10.931 -5.721 1.00 0.00 O ATOM 0 H SER A 2 -8.457 10.409 -8.271 1.00 0.00 H new ATOM 0 HA SER A 2 -9.966 12.249 -6.711 1.00 0.00 H new ATOM 0 HB2 SER A 2 -11.789 10.771 -7.766 1.00 0.00 H new ATOM 0 HB3 SER A 2 -11.113 9.435 -6.856 1.00 0.00 H new ATOM 0 HG SER A 2 -12.832 10.493 -5.715 1.00 0.00 H new ATOM 19 N SER A 3 -7.956 11.358 -5.411 1.00 0.00 N ATOM 20 CA SER A 3 -7.018 10.901 -4.392 1.00 0.00 C ATOM 21 C SER A 3 -7.732 10.648 -3.069 1.00 0.00 C ATOM 22 O SER A 3 -8.870 11.074 -2.872 1.00 0.00 O ATOM 23 CB SER A 3 -5.907 11.934 -4.196 1.00 0.00 C ATOM 24 OG SER A 3 -4.683 11.478 -4.747 1.00 0.00 O ATOM 0 H SER A 3 -7.783 12.304 -5.750 1.00 0.00 H new ATOM 0 HA SER A 3 -6.579 9.963 -4.731 1.00 0.00 H new ATOM 0 HB2 SER A 3 -6.193 12.874 -4.667 1.00 0.00 H new ATOM 0 HB3 SER A 3 -5.778 12.136 -3.133 1.00 0.00 H new ATOM 0 HG SER A 3 -3.990 12.157 -4.610 1.00 0.00 H new ATOM 30 N GLY A 4 -7.056 9.949 -2.163 1.00 0.00 N ATOM 31 CA GLY A 4 -7.641 9.648 -0.869 1.00 0.00 C ATOM 32 C GLY A 4 -6.793 8.689 -0.058 1.00 0.00 C ATOM 33 O GLY A 4 -5.594 8.905 0.115 1.00 0.00 O ATOM 0 H GLY A 4 -6.113 9.585 -2.302 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -7.773 10.574 -0.309 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -8.632 9.219 -1.013 1.00 0.00 H new ATOM 37 N SER A 5 -7.417 7.629 0.444 1.00 0.00 N ATOM 38 CA SER A 5 -6.714 6.635 1.247 1.00 0.00 C ATOM 39 C SER A 5 -6.577 5.320 0.486 1.00 0.00 C ATOM 40 O SER A 5 -7.511 4.519 0.435 1.00 0.00 O ATOM 41 CB SER A 5 -7.450 6.400 2.566 1.00 0.00 C ATOM 42 OG SER A 5 -7.086 7.371 3.533 1.00 0.00 O ATOM 0 H SER A 5 -8.409 7.436 0.309 1.00 0.00 H new ATOM 0 HA SER A 5 -5.716 7.017 1.460 1.00 0.00 H new ATOM 0 HB2 SER A 5 -8.526 6.436 2.397 1.00 0.00 H new ATOM 0 HB3 SER A 5 -7.220 5.403 2.942 1.00 0.00 H new ATOM 0 HG SER A 5 -7.571 7.200 4.367 1.00 0.00 H new ATOM 48 N SER A 6 -5.406 5.104 -0.104 1.00 0.00 N ATOM 49 CA SER A 6 -5.147 3.887 -0.865 1.00 0.00 C ATOM 50 C SER A 6 -3.908 3.169 -0.337 1.00 0.00 C ATOM 51 O SER A 6 -3.770 1.956 -0.486 1.00 0.00 O ATOM 52 CB SER A 6 -4.965 4.217 -2.349 1.00 0.00 C ATOM 53 OG SER A 6 -3.955 5.195 -2.533 1.00 0.00 O ATOM 0 H SER A 6 -4.622 5.755 -0.070 1.00 0.00 H new ATOM 0 HA SER A 6 -6.006 3.226 -0.749 1.00 0.00 H new ATOM 0 HB2 SER A 6 -4.703 3.312 -2.897 1.00 0.00 H new ATOM 0 HB3 SER A 6 -5.906 4.579 -2.763 1.00 0.00 H new ATOM 0 HG SER A 6 -3.856 5.388 -3.489 1.00 0.00 H new ATOM 59 N GLY A 7 -3.010 3.929 0.281 1.00 0.00 N ATOM 60 CA GLY A 7 -1.794 3.349 0.821 1.00 0.00 C ATOM 61 C GLY A 7 -2.074 2.251 1.828 1.00 0.00 C ATOM 62 O GLY A 7 -3.189 2.138 2.341 1.00 0.00 O ATOM 0 H GLY A 7 -3.102 4.936 0.418 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -1.194 2.946 0.005 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -1.202 4.131 1.296 1.00 0.00 H new ATOM 66 N LEU A 8 -1.062 1.438 2.111 1.00 0.00 N ATOM 67 CA LEU A 8 -1.205 0.342 3.062 1.00 0.00 C ATOM 68 C LEU A 8 0.138 -0.009 3.694 1.00 0.00 C ATOM 69 O LEU A 8 1.134 -0.199 2.996 1.00 0.00 O ATOM 70 CB LEU A 8 -1.790 -0.889 2.367 1.00 0.00 C ATOM 71 CG LEU A 8 -3.316 -0.989 2.352 1.00 0.00 C ATOM 72 CD1 LEU A 8 -3.767 -2.135 1.461 1.00 0.00 C ATOM 73 CD2 LEU A 8 -3.854 -1.164 3.764 1.00 0.00 C ATOM 0 H LEU A 8 -0.134 1.517 1.695 1.00 0.00 H new ATOM 0 HA LEU A 8 -1.885 0.665 3.851 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -1.435 -0.903 1.337 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -1.392 -1.780 2.853 1.00 0.00 H new ATOM 0 HG LEU A 8 -3.717 -0.061 1.945 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -4.856 -2.191 1.463 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -3.414 -1.966 0.444 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -3.355 -3.072 1.837 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -4.941 -1.233 3.733 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -3.445 -2.076 4.199 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -3.562 -0.309 4.373 1.00 0.00 H new ATOM 85 N ILE A 9 0.159 -0.094 5.020 1.00 0.00 N ATOM 86 CA ILE A 9 1.378 -0.425 5.746 1.00 0.00 C ATOM 87 C ILE A 9 1.399 -1.897 6.144 1.00 0.00 C ATOM 88 O ILE A 9 0.835 -2.282 7.168 1.00 0.00 O ATOM 89 CB ILE A 9 1.532 0.439 7.011 1.00 0.00 C ATOM 90 CG1 ILE A 9 1.539 1.925 6.643 1.00 0.00 C ATOM 91 CG2 ILE A 9 2.807 0.067 7.755 1.00 0.00 C ATOM 92 CD1 ILE A 9 2.601 2.291 5.630 1.00 0.00 C ATOM 0 H ILE A 9 -0.656 0.062 5.614 1.00 0.00 H new ATOM 0 HA ILE A 9 2.211 -0.221 5.073 1.00 0.00 H new ATOM 0 HB ILE A 9 0.683 0.250 7.667 1.00 0.00 H new ATOM 0 HG12 ILE A 9 0.561 2.198 6.247 1.00 0.00 H new ATOM 0 HG13 ILE A 9 1.692 2.514 7.547 1.00 0.00 H new ATOM 0 HG21 ILE A 9 2.902 0.686 8.647 1.00 0.00 H new ATOM 0 HG22 ILE A 9 2.766 -0.983 8.045 1.00 0.00 H new ATOM 0 HG23 ILE A 9 3.668 0.231 7.106 1.00 0.00 H new ATOM 0 HD11 ILE A 9 2.548 3.359 5.416 1.00 0.00 H new ATOM 0 HD12 ILE A 9 3.585 2.050 6.032 1.00 0.00 H new ATOM 0 HD13 ILE A 9 2.436 1.728 4.711 1.00 0.00 H new ATOM 104 N ALA A 10 2.054 -2.716 5.328 1.00 0.00 N ATOM 105 CA ALA A 10 2.153 -4.145 5.596 1.00 0.00 C ATOM 106 C ALA A 10 3.407 -4.468 6.400 1.00 0.00 C ATOM 107 O ALA A 10 4.523 -4.155 5.980 1.00 0.00 O ATOM 108 CB ALA A 10 2.142 -4.929 4.292 1.00 0.00 C ATOM 0 H ALA A 10 2.524 -2.414 4.475 1.00 0.00 H new ATOM 0 HA ALA A 10 1.288 -4.438 6.190 1.00 0.00 H new ATOM 0 HB1 ALA A 10 2.217 -5.995 4.508 1.00 0.00 H new ATOM 0 HB2 ALA A 10 1.214 -4.731 3.756 1.00 0.00 H new ATOM 0 HB3 ALA A 10 2.988 -4.623 3.677 1.00 0.00 H new ATOM 114 N CYS A 11 3.219 -5.093 7.557 1.00 0.00 N ATOM 115 CA CYS A 11 4.336 -5.456 8.421 1.00 0.00 C ATOM 116 C CYS A 11 4.654 -6.943 8.303 1.00 0.00 C ATOM 117 O CYS A 11 3.859 -7.792 8.708 1.00 0.00 O ATOM 118 CB CYS A 11 4.021 -5.103 9.875 1.00 0.00 C ATOM 119 SG CYS A 11 5.431 -5.255 10.996 1.00 0.00 S ATOM 0 H CYS A 11 2.303 -5.359 7.918 1.00 0.00 H new ATOM 0 HA CYS A 11 5.210 -4.889 8.099 1.00 0.00 H new ATOM 0 HB2 CYS A 11 3.647 -4.080 9.916 1.00 0.00 H new ATOM 0 HB3 CYS A 11 3.218 -5.750 10.229 1.00 0.00 H new ATOM 0 HG CYS A 11 5.064 -4.933 12.201 1.00 0.00 H new ATOM 125 N VAL A 12 5.819 -7.252 7.744 1.00 0.00 N ATOM 126 CA VAL A 12 6.241 -8.637 7.571 1.00 0.00 C ATOM 127 C VAL A 12 7.216 -9.055 8.667 1.00 0.00 C ATOM 128 O VAL A 12 7.955 -8.229 9.202 1.00 0.00 O ATOM 129 CB VAL A 12 6.905 -8.855 6.199 1.00 0.00 C ATOM 130 CG1 VAL A 12 6.785 -10.309 5.772 1.00 0.00 C ATOM 131 CG2 VAL A 12 6.289 -7.933 5.157 1.00 0.00 C ATOM 0 H VAL A 12 6.488 -6.562 7.403 1.00 0.00 H new ATOM 0 HA VAL A 12 5.343 -9.251 7.633 1.00 0.00 H new ATOM 0 HB VAL A 12 7.964 -8.613 6.285 1.00 0.00 H new ATOM 0 HG11 VAL A 12 7.260 -10.443 4.800 1.00 0.00 H new ATOM 0 HG12 VAL A 12 7.277 -10.946 6.507 1.00 0.00 H new ATOM 0 HG13 VAL A 12 5.732 -10.582 5.702 1.00 0.00 H new ATOM 0 HG21 VAL A 12 6.770 -8.100 4.193 1.00 0.00 H new ATOM 0 HG22 VAL A 12 5.223 -8.142 5.071 1.00 0.00 H new ATOM 0 HG23 VAL A 12 6.432 -6.896 5.459 1.00 0.00 H new ATOM 141 N ALA A 13 7.212 -10.343 8.996 1.00 0.00 N ATOM 142 CA ALA A 13 8.097 -10.871 10.025 1.00 0.00 C ATOM 143 C ALA A 13 9.246 -11.662 9.409 1.00 0.00 C ATOM 144 O ALA A 13 10.301 -11.822 10.021 1.00 0.00 O ATOM 145 CB ALA A 13 7.316 -11.742 10.998 1.00 0.00 C ATOM 0 H ALA A 13 6.605 -11.040 8.564 1.00 0.00 H new ATOM 0 HA ALA A 13 8.522 -10.028 10.570 1.00 0.00 H new ATOM 0 HB1 ALA A 13 7.991 -12.130 11.761 1.00 0.00 H new ATOM 0 HB2 ALA A 13 6.535 -11.148 11.472 1.00 0.00 H new ATOM 0 HB3 ALA A 13 6.862 -12.574 10.459 1.00 0.00 H new ATOM 151 N ASN A 14 9.033 -12.155 8.193 1.00 0.00 N ATOM 152 CA ASN A 14 10.051 -12.931 7.494 1.00 0.00 C ATOM 153 C ASN A 14 11.135 -12.020 6.925 1.00 0.00 C ATOM 154 O ASN A 14 10.956 -11.412 5.869 1.00 0.00 O ATOM 155 CB ASN A 14 9.415 -13.750 6.369 1.00 0.00 C ATOM 156 CG ASN A 14 9.398 -15.236 6.674 1.00 0.00 C ATOM 157 OD1 ASN A 14 10.097 -15.704 7.572 1.00 0.00 O ATOM 158 ND2 ASN A 14 8.598 -15.984 5.924 1.00 0.00 N ATOM 0 H ASN A 14 8.165 -12.031 7.672 1.00 0.00 H new ATOM 0 HA ASN A 14 10.512 -13.609 8.212 1.00 0.00 H new ATOM 0 HB2 ASN A 14 8.395 -13.404 6.204 1.00 0.00 H new ATOM 0 HB3 ASN A 14 9.964 -13.578 5.443 1.00 0.00 H new ATOM 0 HD21 ASN A 14 8.545 -16.990 6.082 1.00 0.00 H new ATOM 0 HD22 ASN A 14 8.036 -15.552 5.190 1.00 0.00 H new ATOM 165 N ASP A 15 12.256 -11.931 7.631 1.00 0.00 N ATOM 166 CA ASP A 15 13.369 -11.096 7.196 1.00 0.00 C ATOM 167 C ASP A 15 13.736 -11.392 5.745 1.00 0.00 C ATOM 168 O ASP A 15 14.288 -10.541 5.048 1.00 0.00 O ATOM 169 CB ASP A 15 14.585 -11.319 8.098 1.00 0.00 C ATOM 170 CG ASP A 15 14.251 -11.162 9.568 1.00 0.00 C ATOM 171 OD1 ASP A 15 13.600 -10.158 9.925 1.00 0.00 O ATOM 172 OD2 ASP A 15 14.640 -12.044 10.362 1.00 0.00 O ATOM 0 H ASP A 15 12.418 -12.427 8.507 1.00 0.00 H new ATOM 0 HA ASP A 15 13.059 -10.054 7.268 1.00 0.00 H new ATOM 0 HB2 ASP A 15 14.985 -12.318 7.924 1.00 0.00 H new ATOM 0 HB3 ASP A 15 15.368 -10.611 7.829 1.00 0.00 H new ATOM 177 N ASP A 16 13.428 -12.605 5.297 1.00 0.00 N ATOM 178 CA ASP A 16 13.724 -13.013 3.929 1.00 0.00 C ATOM 179 C ASP A 16 13.022 -12.104 2.927 1.00 0.00 C ATOM 180 O ASP A 16 13.642 -11.599 1.989 1.00 0.00 O ATOM 181 CB ASP A 16 13.300 -14.466 3.705 1.00 0.00 C ATOM 182 CG ASP A 16 14.406 -15.304 3.096 1.00 0.00 C ATOM 183 OD1 ASP A 16 14.849 -14.977 1.974 1.00 0.00 O ATOM 184 OD2 ASP A 16 14.829 -16.286 3.739 1.00 0.00 O ATOM 0 H ASP A 16 12.973 -13.322 5.862 1.00 0.00 H new ATOM 0 HA ASP A 16 14.800 -12.929 3.775 1.00 0.00 H new ATOM 0 HB2 ASP A 16 12.998 -14.904 4.656 1.00 0.00 H new ATOM 0 HB3 ASP A 16 12.428 -14.490 3.052 1.00 0.00 H new ATOM 189 N VAL A 17 11.724 -11.900 3.128 1.00 0.00 N ATOM 190 CA VAL A 17 10.936 -11.051 2.241 1.00 0.00 C ATOM 191 C VAL A 17 11.711 -9.798 1.850 1.00 0.00 C ATOM 192 O VAL A 17 11.514 -9.246 0.767 1.00 0.00 O ATOM 193 CB VAL A 17 9.606 -10.636 2.897 1.00 0.00 C ATOM 194 CG1 VAL A 17 8.827 -9.706 1.980 1.00 0.00 C ATOM 195 CG2 VAL A 17 8.780 -11.864 3.250 1.00 0.00 C ATOM 0 H VAL A 17 11.195 -12.311 3.897 1.00 0.00 H new ATOM 0 HA VAL A 17 10.723 -11.637 1.347 1.00 0.00 H new ATOM 0 HB VAL A 17 9.827 -10.098 3.819 1.00 0.00 H new ATOM 0 HG11 VAL A 17 7.890 -9.423 2.460 1.00 0.00 H new ATOM 0 HG12 VAL A 17 9.418 -8.812 1.782 1.00 0.00 H new ATOM 0 HG13 VAL A 17 8.614 -10.216 1.040 1.00 0.00 H new ATOM 0 HG21 VAL A 17 7.844 -11.552 3.713 1.00 0.00 H new ATOM 0 HG22 VAL A 17 8.566 -12.431 2.344 1.00 0.00 H new ATOM 0 HG23 VAL A 17 9.338 -12.490 3.947 1.00 0.00 H new ATOM 205 N PHE A 18 12.592 -9.352 2.739 1.00 0.00 N ATOM 206 CA PHE A 18 13.397 -8.162 2.487 1.00 0.00 C ATOM 207 C PHE A 18 14.671 -8.517 1.725 1.00 0.00 C ATOM 208 O PHE A 18 15.711 -7.885 1.904 1.00 0.00 O ATOM 209 CB PHE A 18 13.754 -7.473 3.806 1.00 0.00 C ATOM 210 CG PHE A 18 12.555 -7.090 4.625 1.00 0.00 C ATOM 211 CD1 PHE A 18 11.869 -8.043 5.360 1.00 0.00 C ATOM 212 CD2 PHE A 18 12.116 -5.777 4.663 1.00 0.00 C ATOM 213 CE1 PHE A 18 10.764 -7.694 6.114 1.00 0.00 C ATOM 214 CE2 PHE A 18 11.013 -5.421 5.415 1.00 0.00 C ATOM 215 CZ PHE A 18 10.336 -6.381 6.143 1.00 0.00 C ATOM 0 H PHE A 18 12.767 -9.796 3.640 1.00 0.00 H new ATOM 0 HA PHE A 18 12.808 -7.479 1.875 1.00 0.00 H new ATOM 0 HB2 PHE A 18 14.388 -8.137 4.393 1.00 0.00 H new ATOM 0 HB3 PHE A 18 14.339 -6.579 3.593 1.00 0.00 H new ATOM 0 HD1 PHE A 18 12.201 -9.071 5.344 1.00 0.00 H new ATOM 0 HD2 PHE A 18 12.642 -5.022 4.098 1.00 0.00 H new ATOM 0 HE1 PHE A 18 10.236 -8.447 6.680 1.00 0.00 H new ATOM 0 HE2 PHE A 18 10.680 -4.394 5.434 1.00 0.00 H new ATOM 0 HZ PHE A 18 9.474 -6.105 6.733 1.00 0.00 H new ATOM 225 N SER A 19 14.580 -9.536 0.875 1.00 0.00 N ATOM 226 CA SER A 19 15.724 -9.979 0.089 1.00 0.00 C ATOM 227 C SER A 19 15.428 -9.885 -1.405 1.00 0.00 C ATOM 228 O SER A 19 14.268 -9.840 -1.816 1.00 0.00 O ATOM 229 CB SER A 19 16.097 -11.417 0.457 1.00 0.00 C ATOM 230 OG SER A 19 15.208 -12.343 -0.143 1.00 0.00 O ATOM 0 H SER A 19 13.726 -10.069 0.714 1.00 0.00 H new ATOM 0 HA SER A 19 16.564 -9.323 0.317 1.00 0.00 H new ATOM 0 HB2 SER A 19 17.117 -11.626 0.134 1.00 0.00 H new ATOM 0 HB3 SER A 19 16.075 -11.536 1.540 1.00 0.00 H new ATOM 0 HG SER A 19 14.384 -12.395 0.385 1.00 0.00 H new ATOM 236 N GLU A 20 16.484 -9.857 -2.212 1.00 0.00 N ATOM 237 CA GLU A 20 16.337 -9.767 -3.659 1.00 0.00 C ATOM 238 C GLU A 20 16.213 -11.156 -4.280 1.00 0.00 C ATOM 239 O GLU A 20 15.726 -11.306 -5.401 1.00 0.00 O ATOM 240 CB GLU A 20 17.527 -9.026 -4.271 1.00 0.00 C ATOM 241 CG GLU A 20 17.324 -7.523 -4.367 1.00 0.00 C ATOM 242 CD GLU A 20 18.587 -6.789 -4.772 1.00 0.00 C ATOM 243 OE1 GLU A 20 19.683 -7.222 -4.358 1.00 0.00 O ATOM 244 OE2 GLU A 20 18.480 -5.783 -5.503 1.00 0.00 O ATOM 0 H GLU A 20 17.450 -9.895 -1.888 1.00 0.00 H new ATOM 0 HA GLU A 20 15.425 -9.210 -3.872 1.00 0.00 H new ATOM 0 HB2 GLU A 20 18.416 -9.227 -3.673 1.00 0.00 H new ATOM 0 HB3 GLU A 20 17.718 -9.423 -5.268 1.00 0.00 H new ATOM 0 HG2 GLU A 20 16.537 -7.312 -5.091 1.00 0.00 H new ATOM 0 HG3 GLU A 20 16.981 -7.144 -3.404 1.00 0.00 H new ATOM 251 N SER A 21 16.660 -12.168 -3.544 1.00 0.00 N ATOM 252 CA SER A 21 16.605 -13.544 -4.024 1.00 0.00 C ATOM 253 C SER A 21 15.331 -13.789 -4.828 1.00 0.00 C ATOM 254 O SER A 21 15.377 -13.945 -6.048 1.00 0.00 O ATOM 255 CB SER A 21 16.673 -14.520 -2.847 1.00 0.00 C ATOM 256 OG SER A 21 17.539 -15.604 -3.133 1.00 0.00 O ATOM 0 H SER A 21 17.064 -12.061 -2.614 1.00 0.00 H new ATOM 0 HA SER A 21 17.463 -13.710 -4.675 1.00 0.00 H new ATOM 0 HB2 SER A 21 17.022 -13.997 -1.957 1.00 0.00 H new ATOM 0 HB3 SER A 21 15.675 -14.897 -2.625 1.00 0.00 H new ATOM 0 HG SER A 21 17.566 -16.212 -2.365 1.00 0.00 H new ATOM 262 N GLU A 22 14.198 -13.820 -4.135 1.00 0.00 N ATOM 263 CA GLU A 22 12.912 -14.047 -4.785 1.00 0.00 C ATOM 264 C GLU A 22 11.766 -13.897 -3.790 1.00 0.00 C ATOM 265 O GLU A 22 10.717 -13.337 -4.111 1.00 0.00 O ATOM 266 CB GLU A 22 12.874 -15.440 -5.418 1.00 0.00 C ATOM 267 CG GLU A 22 12.331 -15.449 -6.837 1.00 0.00 C ATOM 268 CD GLU A 22 12.213 -16.848 -7.408 1.00 0.00 C ATOM 269 OE1 GLU A 22 12.991 -17.729 -6.986 1.00 0.00 O ATOM 270 OE2 GLU A 22 11.345 -17.062 -8.279 1.00 0.00 O ATOM 0 H GLU A 22 14.144 -13.691 -3.125 1.00 0.00 H new ATOM 0 HA GLU A 22 12.792 -13.297 -5.567 1.00 0.00 H new ATOM 0 HB2 GLU A 22 13.881 -15.856 -5.421 1.00 0.00 H new ATOM 0 HB3 GLU A 22 12.260 -16.095 -4.799 1.00 0.00 H new ATOM 0 HG2 GLU A 22 11.351 -14.972 -6.850 1.00 0.00 H new ATOM 0 HG3 GLU A 22 12.984 -14.854 -7.476 1.00 0.00 H new ATOM 277 N THR A 23 11.972 -14.403 -2.577 1.00 0.00 N ATOM 278 CA THR A 23 10.957 -14.327 -1.535 1.00 0.00 C ATOM 279 C THR A 23 10.172 -13.023 -1.625 1.00 0.00 C ATOM 280 O THR A 23 8.956 -13.005 -1.431 1.00 0.00 O ATOM 281 CB THR A 23 11.582 -14.441 -0.132 1.00 0.00 C ATOM 282 OG1 THR A 23 12.412 -15.606 -0.058 1.00 0.00 O ATOM 283 CG2 THR A 23 10.503 -14.512 0.938 1.00 0.00 C ATOM 0 H THR A 23 12.833 -14.870 -2.293 1.00 0.00 H new ATOM 0 HA THR A 23 10.280 -15.167 -1.692 1.00 0.00 H new ATOM 0 HB THR A 23 12.188 -13.552 0.044 1.00 0.00 H new ATOM 0 HG1 THR A 23 13.177 -15.426 0.528 1.00 0.00 H new ATOM 0 HG21 THR A 23 10.969 -14.592 1.920 1.00 0.00 H new ATOM 0 HG22 THR A 23 9.892 -13.610 0.899 1.00 0.00 H new ATOM 0 HG23 THR A 23 9.874 -15.385 0.763 1.00 0.00 H new ATOM 291 N ARG A 24 10.874 -11.935 -1.921 1.00 0.00 N ATOM 292 CA ARG A 24 10.242 -10.626 -2.035 1.00 0.00 C ATOM 293 C ARG A 24 9.055 -10.677 -2.993 1.00 0.00 C ATOM 294 O ARG A 24 7.927 -10.359 -2.616 1.00 0.00 O ATOM 295 CB ARG A 24 11.257 -9.587 -2.519 1.00 0.00 C ATOM 296 CG ARG A 24 10.653 -8.213 -2.758 1.00 0.00 C ATOM 297 CD ARG A 24 11.328 -7.503 -3.922 1.00 0.00 C ATOM 298 NE ARG A 24 12.457 -6.685 -3.483 1.00 0.00 N ATOM 299 CZ ARG A 24 13.178 -5.929 -4.303 1.00 0.00 C ATOM 300 NH1 ARG A 24 12.891 -5.886 -5.596 1.00 0.00 N ATOM 301 NH2 ARG A 24 14.190 -5.213 -3.829 1.00 0.00 N ATOM 0 H ARG A 24 11.881 -11.933 -2.086 1.00 0.00 H new ATOM 0 HA ARG A 24 9.879 -10.338 -1.048 1.00 0.00 H new ATOM 0 HB2 ARG A 24 12.056 -9.501 -1.782 1.00 0.00 H new ATOM 0 HB3 ARG A 24 11.713 -9.940 -3.444 1.00 0.00 H new ATOM 0 HG2 ARG A 24 9.587 -8.313 -2.960 1.00 0.00 H new ATOM 0 HG3 ARG A 24 10.751 -7.609 -1.856 1.00 0.00 H new ATOM 0 HD2 ARG A 24 11.675 -8.241 -4.645 1.00 0.00 H new ATOM 0 HD3 ARG A 24 10.601 -6.873 -4.433 1.00 0.00 H new ATOM 0 HE ARG A 24 12.704 -6.695 -2.494 1.00 0.00 H new ATOM 0 HH11 ARG A 24 12.114 -6.435 -5.964 1.00 0.00 H new ATOM 0 HH12 ARG A 24 13.447 -5.304 -6.223 1.00 0.00 H new ATOM 0 HH21 ARG A 24 14.414 -5.243 -2.834 1.00 0.00 H new ATOM 0 HH22 ARG A 24 14.743 -4.633 -4.459 1.00 0.00 H new ATOM 315 N ALA A 25 9.318 -11.080 -4.231 1.00 0.00 N ATOM 316 CA ALA A 25 8.272 -11.175 -5.242 1.00 0.00 C ATOM 317 C ALA A 25 7.005 -11.796 -4.663 1.00 0.00 C ATOM 318 O ALA A 25 5.915 -11.237 -4.786 1.00 0.00 O ATOM 319 CB ALA A 25 8.761 -11.983 -6.434 1.00 0.00 C ATOM 0 H ALA A 25 10.247 -11.346 -4.559 1.00 0.00 H new ATOM 0 HA ALA A 25 8.031 -10.166 -5.576 1.00 0.00 H new ATOM 0 HB1 ALA A 25 7.969 -12.045 -7.181 1.00 0.00 H new ATOM 0 HB2 ALA A 25 9.634 -11.496 -6.870 1.00 0.00 H new ATOM 0 HB3 ALA A 25 9.031 -12.987 -6.107 1.00 0.00 H new ATOM 325 N LYS A 26 7.155 -12.957 -4.034 1.00 0.00 N ATOM 326 CA LYS A 26 6.023 -13.655 -3.436 1.00 0.00 C ATOM 327 C LYS A 26 5.130 -12.686 -2.668 1.00 0.00 C ATOM 328 O LYS A 26 3.903 -12.745 -2.768 1.00 0.00 O ATOM 329 CB LYS A 26 6.516 -14.760 -2.500 1.00 0.00 C ATOM 330 CG LYS A 26 7.216 -15.900 -3.221 1.00 0.00 C ATOM 331 CD LYS A 26 8.041 -16.742 -2.263 1.00 0.00 C ATOM 332 CE LYS A 26 9.286 -17.298 -2.939 1.00 0.00 C ATOM 333 NZ LYS A 26 9.167 -18.758 -3.207 1.00 0.00 N ATOM 0 H LYS A 26 8.050 -13.434 -3.925 1.00 0.00 H new ATOM 0 HA LYS A 26 5.438 -14.102 -4.240 1.00 0.00 H new ATOM 0 HB2 LYS A 26 7.201 -14.328 -1.770 1.00 0.00 H new ATOM 0 HB3 LYS A 26 5.668 -15.159 -1.944 1.00 0.00 H new ATOM 0 HG2 LYS A 26 6.475 -16.529 -3.714 1.00 0.00 H new ATOM 0 HG3 LYS A 26 7.862 -15.497 -4.001 1.00 0.00 H new ATOM 0 HD2 LYS A 26 8.332 -16.138 -1.404 1.00 0.00 H new ATOM 0 HD3 LYS A 26 7.434 -17.564 -1.884 1.00 0.00 H new ATOM 0 HE2 LYS A 26 9.457 -16.769 -3.877 1.00 0.00 H new ATOM 0 HE3 LYS A 26 10.155 -17.114 -2.307 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 10.035 -19.098 -3.668 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 9.030 -19.266 -2.310 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 8.353 -18.931 -3.831 1.00 0.00 H new ATOM 347 N PHE A 27 5.752 -11.794 -1.905 1.00 0.00 N ATOM 348 CA PHE A 27 5.012 -10.810 -1.121 1.00 0.00 C ATOM 349 C PHE A 27 4.432 -9.722 -2.020 1.00 0.00 C ATOM 350 O PHE A 27 3.377 -9.162 -1.730 1.00 0.00 O ATOM 351 CB PHE A 27 5.922 -10.182 -0.063 1.00 0.00 C ATOM 352 CG PHE A 27 5.368 -8.918 0.530 1.00 0.00 C ATOM 353 CD1 PHE A 27 5.422 -7.726 -0.174 1.00 0.00 C ATOM 354 CD2 PHE A 27 4.795 -8.923 1.791 1.00 0.00 C ATOM 355 CE1 PHE A 27 4.913 -6.561 0.369 1.00 0.00 C ATOM 356 CE2 PHE A 27 4.283 -7.761 2.338 1.00 0.00 C ATOM 357 CZ PHE A 27 4.344 -6.578 1.627 1.00 0.00 C ATOM 0 H PHE A 27 6.766 -11.731 -1.812 1.00 0.00 H new ATOM 0 HA PHE A 27 4.188 -11.323 -0.624 1.00 0.00 H new ATOM 0 HB2 PHE A 27 6.091 -10.905 0.735 1.00 0.00 H new ATOM 0 HB3 PHE A 27 6.893 -9.969 -0.510 1.00 0.00 H new ATOM 0 HD1 PHE A 27 5.867 -7.707 -1.158 1.00 0.00 H new ATOM 0 HD2 PHE A 27 4.748 -9.844 2.353 1.00 0.00 H new ATOM 0 HE1 PHE A 27 4.960 -5.638 -0.190 1.00 0.00 H new ATOM 0 HE2 PHE A 27 3.836 -7.778 3.321 1.00 0.00 H new ATOM 0 HZ PHE A 27 3.948 -5.669 2.054 1.00 0.00 H new ATOM 367 N GLU A 28 5.132 -9.430 -3.111 1.00 0.00 N ATOM 368 CA GLU A 28 4.688 -8.408 -4.052 1.00 0.00 C ATOM 369 C GLU A 28 3.486 -8.895 -4.856 1.00 0.00 C ATOM 370 O GLU A 28 2.389 -8.348 -4.747 1.00 0.00 O ATOM 371 CB GLU A 28 5.826 -8.023 -4.998 1.00 0.00 C ATOM 372 CG GLU A 28 6.662 -6.856 -4.500 1.00 0.00 C ATOM 373 CD GLU A 28 7.577 -6.294 -5.573 1.00 0.00 C ATOM 374 OE1 GLU A 28 7.330 -6.570 -6.766 1.00 0.00 O ATOM 375 OE2 GLU A 28 8.538 -5.581 -5.219 1.00 0.00 O ATOM 0 H GLU A 28 6.008 -9.886 -3.365 1.00 0.00 H new ATOM 0 HA GLU A 28 4.390 -7.530 -3.480 1.00 0.00 H new ATOM 0 HB2 GLU A 28 6.474 -8.887 -5.144 1.00 0.00 H new ATOM 0 HB3 GLU A 28 5.408 -7.770 -5.972 1.00 0.00 H new ATOM 0 HG2 GLU A 28 6.001 -6.067 -4.142 1.00 0.00 H new ATOM 0 HG3 GLU A 28 7.262 -7.180 -3.649 1.00 0.00 H new ATOM 382 N SER A 29 3.702 -9.928 -5.665 1.00 0.00 N ATOM 383 CA SER A 29 2.639 -10.487 -6.493 1.00 0.00 C ATOM 384 C SER A 29 1.295 -10.410 -5.775 1.00 0.00 C ATOM 385 O SER A 29 0.263 -10.145 -6.391 1.00 0.00 O ATOM 386 CB SER A 29 2.956 -11.940 -6.854 1.00 0.00 C ATOM 387 OG SER A 29 4.143 -12.027 -7.622 1.00 0.00 O ATOM 0 H SER A 29 4.603 -10.395 -5.765 1.00 0.00 H new ATOM 0 HA SER A 29 2.576 -9.899 -7.408 1.00 0.00 H new ATOM 0 HB2 SER A 29 3.064 -12.529 -5.943 1.00 0.00 H new ATOM 0 HB3 SER A 29 2.125 -12.369 -7.414 1.00 0.00 H new ATOM 0 HG SER A 29 4.325 -12.965 -7.838 1.00 0.00 H new ATOM 393 N LEU A 30 1.316 -10.646 -4.467 1.00 0.00 N ATOM 394 CA LEU A 30 0.099 -10.604 -3.663 1.00 0.00 C ATOM 395 C LEU A 30 -0.681 -9.319 -3.921 1.00 0.00 C ATOM 396 O LEU A 30 -1.863 -9.356 -4.262 1.00 0.00 O ATOM 397 CB LEU A 30 0.443 -10.716 -2.176 1.00 0.00 C ATOM 398 CG LEU A 30 0.870 -12.100 -1.688 1.00 0.00 C ATOM 399 CD1 LEU A 30 1.530 -12.004 -0.322 1.00 0.00 C ATOM 400 CD2 LEU A 30 -0.326 -13.040 -1.641 1.00 0.00 C ATOM 0 H LEU A 30 2.161 -10.868 -3.941 1.00 0.00 H new ATOM 0 HA LEU A 30 -0.526 -11.450 -3.950 1.00 0.00 H new ATOM 0 HB2 LEU A 30 1.245 -10.012 -1.955 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -0.426 -10.401 -1.598 1.00 0.00 H new ATOM 0 HG LEU A 30 1.598 -12.505 -2.392 1.00 0.00 H new ATOM 0 HD11 LEU A 30 1.827 -12.999 0.009 1.00 0.00 H new ATOM 0 HD12 LEU A 30 2.411 -11.365 -0.388 1.00 0.00 H new ATOM 0 HD13 LEU A 30 0.826 -11.579 0.393 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -0.004 -14.021 -1.291 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -1.077 -12.640 -0.959 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -0.755 -13.133 -2.639 1.00 0.00 H new ATOM 412 N PHE A 31 -0.010 -8.183 -3.759 1.00 0.00 N ATOM 413 CA PHE A 31 -0.640 -6.886 -3.976 1.00 0.00 C ATOM 414 C PHE A 31 -0.714 -6.560 -5.465 1.00 0.00 C ATOM 415 O PHE A 31 -1.771 -6.192 -5.978 1.00 0.00 O ATOM 416 CB PHE A 31 0.135 -5.790 -3.240 1.00 0.00 C ATOM 417 CG PHE A 31 0.474 -6.146 -1.821 1.00 0.00 C ATOM 418 CD1 PHE A 31 1.561 -6.955 -1.536 1.00 0.00 C ATOM 419 CD2 PHE A 31 -0.295 -5.671 -0.771 1.00 0.00 C ATOM 420 CE1 PHE A 31 1.877 -7.284 -0.232 1.00 0.00 C ATOM 421 CE2 PHE A 31 0.015 -5.995 0.535 1.00 0.00 C ATOM 422 CZ PHE A 31 1.102 -6.804 0.806 1.00 0.00 C ATOM 0 H PHE A 31 0.969 -8.135 -3.478 1.00 0.00 H new ATOM 0 HA PHE A 31 -1.655 -6.932 -3.581 1.00 0.00 H new ATOM 0 HB2 PHE A 31 1.056 -5.580 -3.784 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -0.454 -4.873 -3.245 1.00 0.00 H new ATOM 0 HD1 PHE A 31 2.170 -7.334 -2.344 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -1.147 -5.040 -0.976 1.00 0.00 H new ATOM 0 HE1 PHE A 31 2.728 -7.915 -0.024 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -0.592 -5.616 1.344 1.00 0.00 H new ATOM 0 HZ PHE A 31 1.345 -7.060 1.827 1.00 0.00 H new ATOM 432 N ARG A 32 0.416 -6.696 -6.151 1.00 0.00 N ATOM 433 CA ARG A 32 0.480 -6.414 -7.580 1.00 0.00 C ATOM 434 C ARG A 32 -0.694 -7.056 -8.314 1.00 0.00 C ATOM 435 O ARG A 32 -1.321 -6.432 -9.171 1.00 0.00 O ATOM 436 CB ARG A 32 1.800 -6.922 -8.163 1.00 0.00 C ATOM 437 CG ARG A 32 2.429 -5.970 -9.167 1.00 0.00 C ATOM 438 CD ARG A 32 1.825 -6.140 -10.551 1.00 0.00 C ATOM 439 NE ARG A 32 2.603 -5.451 -11.577 1.00 0.00 N ATOM 440 CZ ARG A 32 3.736 -5.925 -12.083 1.00 0.00 C ATOM 441 NH1 ARG A 32 4.220 -7.085 -11.660 1.00 0.00 N ATOM 442 NH2 ARG A 32 4.387 -5.239 -13.013 1.00 0.00 N ATOM 0 H ARG A 32 1.299 -7.000 -5.741 1.00 0.00 H new ATOM 0 HA ARG A 32 0.423 -5.334 -7.715 1.00 0.00 H new ATOM 0 HB2 ARG A 32 2.504 -7.095 -7.349 1.00 0.00 H new ATOM 0 HB3 ARG A 32 1.628 -7.884 -8.646 1.00 0.00 H new ATOM 0 HG2 ARG A 32 2.289 -4.942 -8.832 1.00 0.00 H new ATOM 0 HG3 ARG A 32 3.504 -6.147 -9.214 1.00 0.00 H new ATOM 0 HD2 ARG A 32 1.766 -7.201 -10.793 1.00 0.00 H new ATOM 0 HD3 ARG A 32 0.805 -5.756 -10.551 1.00 0.00 H new ATOM 0 HE ARG A 32 2.257 -4.556 -11.924 1.00 0.00 H new ATOM 0 HH11 ARG A 32 3.722 -7.615 -10.945 1.00 0.00 H new ATOM 0 HH12 ARG A 32 5.090 -7.447 -12.050 1.00 0.00 H new ATOM 0 HH21 ARG A 32 4.018 -4.346 -13.340 1.00 0.00 H new ATOM 0 HH22 ARG A 32 5.257 -5.604 -13.401 1.00 0.00 H new ATOM 456 N THR A 33 -0.985 -8.308 -7.973 1.00 0.00 N ATOM 457 CA THR A 33 -2.081 -9.035 -8.600 1.00 0.00 C ATOM 458 C THR A 33 -3.303 -8.141 -8.780 1.00 0.00 C ATOM 459 O THR A 33 -3.983 -8.203 -9.804 1.00 0.00 O ATOM 460 CB THR A 33 -2.481 -10.271 -7.773 1.00 0.00 C ATOM 461 OG1 THR A 33 -1.426 -11.239 -7.797 1.00 0.00 O ATOM 462 CG2 THR A 33 -3.760 -10.893 -8.313 1.00 0.00 C ATOM 0 H THR A 33 -0.476 -8.839 -7.266 1.00 0.00 H new ATOM 0 HA THR A 33 -1.725 -9.360 -9.578 1.00 0.00 H new ATOM 0 HB THR A 33 -2.657 -9.952 -6.746 1.00 0.00 H new ATOM 0 HG1 THR A 33 -0.590 -10.819 -7.504 1.00 0.00 H new ATOM 0 HG21 THR A 33 -4.022 -11.764 -7.713 1.00 0.00 H new ATOM 0 HG22 THR A 33 -4.568 -10.163 -8.265 1.00 0.00 H new ATOM 0 HG23 THR A 33 -3.607 -11.198 -9.348 1.00 0.00 H new ATOM 470 N TYR A 34 -3.574 -7.310 -7.780 1.00 0.00 N ATOM 471 CA TYR A 34 -4.716 -6.405 -7.828 1.00 0.00 C ATOM 472 C TYR A 34 -4.447 -5.238 -8.774 1.00 0.00 C ATOM 473 O TYR A 34 -5.038 -5.148 -9.850 1.00 0.00 O ATOM 474 CB TYR A 34 -5.033 -5.876 -6.428 1.00 0.00 C ATOM 475 CG TYR A 34 -4.925 -6.928 -5.346 1.00 0.00 C ATOM 476 CD1 TYR A 34 -5.723 -8.065 -5.371 1.00 0.00 C ATOM 477 CD2 TYR A 34 -4.024 -6.783 -4.298 1.00 0.00 C ATOM 478 CE1 TYR A 34 -5.627 -9.027 -4.384 1.00 0.00 C ATOM 479 CE2 TYR A 34 -3.920 -7.741 -3.308 1.00 0.00 C ATOM 480 CZ TYR A 34 -4.724 -8.861 -3.355 1.00 0.00 C ATOM 481 OH TYR A 34 -4.626 -9.817 -2.371 1.00 0.00 O ATOM 0 H TYR A 34 -3.019 -7.244 -6.927 1.00 0.00 H new ATOM 0 HA TYR A 34 -5.574 -6.963 -8.202 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -4.353 -5.056 -6.196 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -6.042 -5.464 -6.424 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -6.431 -8.199 -6.176 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -3.394 -5.907 -4.257 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -6.256 -9.904 -4.418 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -3.213 -7.614 -2.502 1.00 0.00 H new ATOM 0 HH TYR A 34 -3.943 -9.549 -1.722 1.00 0.00 H new ATOM 491 N ASP A 35 -3.549 -4.349 -8.365 1.00 0.00 N ATOM 492 CA ASP A 35 -3.198 -3.188 -9.176 1.00 0.00 C ATOM 493 C ASP A 35 -1.804 -3.345 -9.774 1.00 0.00 C ATOM 494 O ASP A 35 -0.915 -3.933 -9.159 1.00 0.00 O ATOM 495 CB ASP A 35 -3.265 -1.912 -8.334 1.00 0.00 C ATOM 496 CG ASP A 35 -4.250 -0.903 -8.889 1.00 0.00 C ATOM 497 OD1 ASP A 35 -4.445 -0.881 -10.122 1.00 0.00 O ATOM 498 OD2 ASP A 35 -4.826 -0.134 -8.090 1.00 0.00 O ATOM 0 H ASP A 35 -3.051 -4.409 -7.477 1.00 0.00 H new ATOM 0 HA ASP A 35 -3.917 -3.114 -9.992 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -3.548 -2.168 -7.313 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -2.274 -1.460 -8.286 1.00 0.00 H new ATOM 503 N LYS A 36 -1.620 -2.815 -10.979 1.00 0.00 N ATOM 504 CA LYS A 36 -0.335 -2.895 -11.662 1.00 0.00 C ATOM 505 C LYS A 36 0.516 -1.664 -11.368 1.00 0.00 C ATOM 506 O LYS A 36 1.745 -1.728 -11.388 1.00 0.00 O ATOM 507 CB LYS A 36 -0.545 -3.034 -13.172 1.00 0.00 C ATOM 508 CG LYS A 36 -1.308 -4.286 -13.568 1.00 0.00 C ATOM 509 CD LYS A 36 -0.942 -4.742 -14.969 1.00 0.00 C ATOM 510 CE LYS A 36 -1.411 -6.164 -15.233 1.00 0.00 C ATOM 511 NZ LYS A 36 -0.346 -7.164 -14.939 1.00 0.00 N ATOM 0 H LYS A 36 -2.346 -2.325 -11.502 1.00 0.00 H new ATOM 0 HA LYS A 36 0.191 -3.775 -11.291 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -1.084 -2.160 -13.537 1.00 0.00 H new ATOM 0 HB3 LYS A 36 0.426 -3.039 -13.666 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -1.094 -5.084 -12.857 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -2.379 -4.092 -13.516 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -1.389 -4.069 -15.700 1.00 0.00 H new ATOM 0 HD3 LYS A 36 0.138 -4.684 -15.101 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -2.288 -6.377 -14.621 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -1.719 -6.257 -16.274 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -0.705 -8.121 -15.132 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 0.481 -6.977 -15.541 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -0.070 -7.093 -13.939 1.00 0.00 H new ATOM 525 N ASP A 37 -0.146 -0.545 -11.094 1.00 0.00 N ATOM 526 CA ASP A 37 0.550 0.701 -10.792 1.00 0.00 C ATOM 527 C ASP A 37 0.826 0.821 -9.297 1.00 0.00 C ATOM 528 O ASP A 37 0.944 1.924 -8.762 1.00 0.00 O ATOM 529 CB ASP A 37 -0.274 1.899 -11.269 1.00 0.00 C ATOM 530 CG ASP A 37 0.515 2.818 -12.179 1.00 0.00 C ATOM 531 OD1 ASP A 37 1.727 2.998 -11.936 1.00 0.00 O ATOM 532 OD2 ASP A 37 -0.079 3.358 -13.136 1.00 0.00 O ATOM 0 H ASP A 37 -1.163 -0.475 -11.075 1.00 0.00 H new ATOM 0 HA ASP A 37 1.504 0.692 -11.320 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -1.158 1.541 -11.797 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -0.625 2.462 -10.404 1.00 0.00 H new ATOM 537 N THR A 38 0.926 -0.322 -8.625 1.00 0.00 N ATOM 538 CA THR A 38 1.186 -0.346 -7.191 1.00 0.00 C ATOM 539 C THR A 38 2.672 -0.174 -6.899 1.00 0.00 C ATOM 540 O THR A 38 3.518 -0.802 -7.536 1.00 0.00 O ATOM 541 CB THR A 38 0.698 -1.661 -6.553 1.00 0.00 C ATOM 542 OG1 THR A 38 0.893 -2.748 -7.464 1.00 0.00 O ATOM 543 CG2 THR A 38 -0.772 -1.566 -6.175 1.00 0.00 C ATOM 0 H THR A 38 0.831 -1.244 -9.052 1.00 0.00 H new ATOM 0 HA THR A 38 0.634 0.487 -6.756 1.00 0.00 H new ATOM 0 HB THR A 38 1.278 -1.838 -5.647 1.00 0.00 H new ATOM 0 HG1 THR A 38 0.056 -2.931 -7.940 1.00 0.00 H new ATOM 0 HG21 THR A 38 -1.094 -2.506 -5.727 1.00 0.00 H new ATOM 0 HG22 THR A 38 -0.912 -0.756 -5.459 1.00 0.00 H new ATOM 0 HG23 THR A 38 -1.365 -1.368 -7.068 1.00 0.00 H new ATOM 551 N THR A 39 2.985 0.683 -5.930 1.00 0.00 N ATOM 552 CA THR A 39 4.369 0.938 -5.554 1.00 0.00 C ATOM 553 C THR A 39 4.718 0.248 -4.240 1.00 0.00 C ATOM 554 O THR A 39 4.014 0.402 -3.241 1.00 0.00 O ATOM 555 CB THR A 39 4.645 2.447 -5.417 1.00 0.00 C ATOM 556 OG1 THR A 39 3.824 3.004 -4.383 1.00 0.00 O ATOM 557 CG2 THR A 39 4.374 3.168 -6.730 1.00 0.00 C ATOM 0 H THR A 39 2.298 1.211 -5.392 1.00 0.00 H new ATOM 0 HA THR A 39 4.993 0.533 -6.351 1.00 0.00 H new ATOM 0 HB THR A 39 5.695 2.580 -5.157 1.00 0.00 H new ATOM 0 HG1 THR A 39 3.668 2.329 -3.690 1.00 0.00 H new ATOM 0 HG21 THR A 39 4.576 4.232 -6.609 1.00 0.00 H new ATOM 0 HG22 THR A 39 5.021 2.762 -7.508 1.00 0.00 H new ATOM 0 HG23 THR A 39 3.331 3.026 -7.014 1.00 0.00 H new ATOM 565 N PHE A 40 5.808 -0.512 -4.246 1.00 0.00 N ATOM 566 CA PHE A 40 6.249 -1.225 -3.053 1.00 0.00 C ATOM 567 C PHE A 40 7.482 -0.560 -2.446 1.00 0.00 C ATOM 568 O PHE A 40 8.493 -0.371 -3.122 1.00 0.00 O ATOM 569 CB PHE A 40 6.559 -2.685 -3.393 1.00 0.00 C ATOM 570 CG PHE A 40 5.392 -3.423 -3.984 1.00 0.00 C ATOM 571 CD1 PHE A 40 5.007 -3.200 -5.296 1.00 0.00 C ATOM 572 CD2 PHE A 40 4.682 -4.341 -3.228 1.00 0.00 C ATOM 573 CE1 PHE A 40 3.934 -3.878 -5.842 1.00 0.00 C ATOM 574 CE2 PHE A 40 3.608 -5.023 -3.769 1.00 0.00 C ATOM 575 CZ PHE A 40 3.234 -4.791 -5.078 1.00 0.00 C ATOM 0 H PHE A 40 6.402 -0.650 -5.064 1.00 0.00 H new ATOM 0 HA PHE A 40 5.442 -1.192 -2.321 1.00 0.00 H new ATOM 0 HB2 PHE A 40 7.392 -2.717 -4.095 1.00 0.00 H new ATOM 0 HB3 PHE A 40 6.884 -3.199 -2.489 1.00 0.00 H new ATOM 0 HD1 PHE A 40 5.552 -2.488 -5.899 1.00 0.00 H new ATOM 0 HD2 PHE A 40 4.971 -4.526 -2.204 1.00 0.00 H new ATOM 0 HE1 PHE A 40 3.643 -3.694 -6.866 1.00 0.00 H new ATOM 0 HE2 PHE A 40 3.062 -5.736 -3.169 1.00 0.00 H new ATOM 0 HZ PHE A 40 2.396 -5.323 -5.503 1.00 0.00 H new ATOM 585 N GLN A 41 7.387 -0.207 -1.169 1.00 0.00 N ATOM 586 CA GLN A 41 8.493 0.438 -0.471 1.00 0.00 C ATOM 587 C GLN A 41 8.908 -0.369 0.755 1.00 0.00 C ATOM 588 O GLN A 41 8.187 -0.421 1.750 1.00 0.00 O ATOM 589 CB GLN A 41 8.101 1.857 -0.054 1.00 0.00 C ATOM 590 CG GLN A 41 9.156 2.901 -0.384 1.00 0.00 C ATOM 591 CD GLN A 41 9.206 3.232 -1.862 1.00 0.00 C ATOM 592 OE1 GLN A 41 10.124 2.819 -2.571 1.00 0.00 O ATOM 593 NE2 GLN A 41 8.217 3.980 -2.336 1.00 0.00 N ATOM 0 H GLN A 41 6.556 -0.356 -0.596 1.00 0.00 H new ATOM 0 HA GLN A 41 9.341 0.488 -1.154 1.00 0.00 H new ATOM 0 HB2 GLN A 41 7.167 2.127 -0.548 1.00 0.00 H new ATOM 0 HB3 GLN A 41 7.910 1.872 1.019 1.00 0.00 H new ATOM 0 HG2 GLN A 41 8.951 3.810 0.181 1.00 0.00 H new ATOM 0 HG3 GLN A 41 10.133 2.539 -0.063 1.00 0.00 H new ATOM 0 HE21 GLN A 41 7.476 4.301 -1.713 1.00 0.00 H new ATOM 0 HE22 GLN A 41 8.198 4.234 -3.324 1.00 0.00 H new ATOM 602 N TYR A 42 10.076 -0.998 0.675 1.00 0.00 N ATOM 603 CA TYR A 42 10.587 -1.804 1.776 1.00 0.00 C ATOM 604 C TYR A 42 11.415 -0.956 2.734 1.00 0.00 C ATOM 605 O TYR A 42 12.321 -0.233 2.318 1.00 0.00 O ATOM 606 CB TYR A 42 11.432 -2.960 1.239 1.00 0.00 C ATOM 607 CG TYR A 42 10.617 -4.062 0.599 1.00 0.00 C ATOM 608 CD1 TYR A 42 10.128 -3.928 -0.695 1.00 0.00 C ATOM 609 CD2 TYR A 42 10.334 -5.234 1.288 1.00 0.00 C ATOM 610 CE1 TYR A 42 9.382 -4.930 -1.284 1.00 0.00 C ATOM 611 CE2 TYR A 42 9.590 -6.243 0.706 1.00 0.00 C ATOM 612 CZ TYR A 42 9.116 -6.086 -0.579 1.00 0.00 C ATOM 613 OH TYR A 42 8.373 -7.087 -1.161 1.00 0.00 O ATOM 0 H TYR A 42 10.686 -0.965 -0.142 1.00 0.00 H new ATOM 0 HA TYR A 42 9.735 -2.208 2.323 1.00 0.00 H new ATOM 0 HB2 TYR A 42 12.140 -2.572 0.507 1.00 0.00 H new ATOM 0 HB3 TYR A 42 12.018 -3.381 2.056 1.00 0.00 H new ATOM 0 HD1 TYR A 42 10.335 -3.025 -1.250 1.00 0.00 H new ATOM 0 HD2 TYR A 42 10.702 -5.359 2.296 1.00 0.00 H new ATOM 0 HE1 TYR A 42 9.009 -4.810 -2.290 1.00 0.00 H new ATOM 0 HE2 TYR A 42 9.381 -7.149 1.255 1.00 0.00 H new ATOM 0 HH TYR A 42 7.490 -7.126 -0.739 1.00 0.00 H new ATOM 623 N PHE A 43 11.100 -1.050 4.022 1.00 0.00 N ATOM 624 CA PHE A 43 11.815 -0.291 5.042 1.00 0.00 C ATOM 625 C PHE A 43 12.612 -1.221 5.952 1.00 0.00 C ATOM 626 O PHE A 43 12.075 -1.792 6.900 1.00 0.00 O ATOM 627 CB PHE A 43 10.832 0.535 5.874 1.00 0.00 C ATOM 628 CG PHE A 43 9.938 1.416 5.047 1.00 0.00 C ATOM 629 CD1 PHE A 43 10.464 2.204 4.037 1.00 0.00 C ATOM 630 CD2 PHE A 43 8.573 1.454 5.282 1.00 0.00 C ATOM 631 CE1 PHE A 43 9.644 3.015 3.274 1.00 0.00 C ATOM 632 CE2 PHE A 43 7.749 2.263 4.522 1.00 0.00 C ATOM 633 CZ PHE A 43 8.285 3.044 3.518 1.00 0.00 C ATOM 0 H PHE A 43 10.354 -1.644 4.384 1.00 0.00 H new ATOM 0 HA PHE A 43 12.510 0.381 4.540 1.00 0.00 H new ATOM 0 HB2 PHE A 43 10.215 -0.139 6.468 1.00 0.00 H new ATOM 0 HB3 PHE A 43 11.392 1.155 6.574 1.00 0.00 H new ATOM 0 HD1 PHE A 43 11.526 2.185 3.843 1.00 0.00 H new ATOM 0 HD2 PHE A 43 8.149 0.845 6.067 1.00 0.00 H new ATOM 0 HE1 PHE A 43 10.066 3.625 2.489 1.00 0.00 H new ATOM 0 HE2 PHE A 43 6.686 2.284 4.714 1.00 0.00 H new ATOM 0 HZ PHE A 43 7.642 3.677 2.924 1.00 0.00 H new ATOM 643 N LYS A 44 13.900 -1.366 5.655 1.00 0.00 N ATOM 644 CA LYS A 44 14.775 -2.225 6.445 1.00 0.00 C ATOM 645 C LYS A 44 14.931 -1.684 7.863 1.00 0.00 C ATOM 646 O LYS A 44 15.243 -2.431 8.791 1.00 0.00 O ATOM 647 CB LYS A 44 16.147 -2.342 5.777 1.00 0.00 C ATOM 648 CG LYS A 44 16.899 -3.606 6.151 1.00 0.00 C ATOM 649 CD LYS A 44 17.630 -4.195 4.956 1.00 0.00 C ATOM 650 CE LYS A 44 18.525 -5.355 5.365 1.00 0.00 C ATOM 651 NZ LYS A 44 18.524 -6.441 4.346 1.00 0.00 N ATOM 0 H LYS A 44 14.360 -0.900 4.873 1.00 0.00 H new ATOM 0 HA LYS A 44 14.320 -3.214 6.501 1.00 0.00 H new ATOM 0 HB2 LYS A 44 16.019 -2.312 4.695 1.00 0.00 H new ATOM 0 HB3 LYS A 44 16.750 -1.476 6.050 1.00 0.00 H new ATOM 0 HG2 LYS A 44 17.614 -3.384 6.943 1.00 0.00 H new ATOM 0 HG3 LYS A 44 16.200 -4.341 6.550 1.00 0.00 H new ATOM 0 HD2 LYS A 44 16.905 -4.537 4.217 1.00 0.00 H new ATOM 0 HD3 LYS A 44 18.231 -3.421 4.479 1.00 0.00 H new ATOM 0 HE2 LYS A 44 19.543 -4.994 5.511 1.00 0.00 H new ATOM 0 HE3 LYS A 44 18.188 -5.754 6.322 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 19.145 -7.213 4.661 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 17.556 -6.803 4.225 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 18.870 -6.067 3.439 1.00 0.00 H new ATOM 665 N SER A 45 14.713 -0.383 8.024 1.00 0.00 N ATOM 666 CA SER A 45 14.834 0.257 9.328 1.00 0.00 C ATOM 667 C SER A 45 13.708 -0.190 10.257 1.00 0.00 C ATOM 668 O SER A 45 13.929 -0.438 11.443 1.00 0.00 O ATOM 669 CB SER A 45 14.811 1.779 9.177 1.00 0.00 C ATOM 670 OG SER A 45 15.989 2.246 8.542 1.00 0.00 O ATOM 0 H SER A 45 14.452 0.249 7.267 1.00 0.00 H new ATOM 0 HA SER A 45 15.786 -0.043 9.766 1.00 0.00 H new ATOM 0 HB2 SER A 45 13.938 2.077 8.596 1.00 0.00 H new ATOM 0 HB3 SER A 45 14.714 2.244 10.158 1.00 0.00 H new ATOM 0 HG SER A 45 15.949 3.221 8.456 1.00 0.00 H new ATOM 676 N PHE A 46 12.501 -0.289 9.710 1.00 0.00 N ATOM 677 CA PHE A 46 11.340 -0.704 10.489 1.00 0.00 C ATOM 678 C PHE A 46 10.742 -1.991 9.929 1.00 0.00 C ATOM 679 O PHE A 46 9.578 -2.309 10.179 1.00 0.00 O ATOM 680 CB PHE A 46 10.283 0.402 10.498 1.00 0.00 C ATOM 681 CG PHE A 46 10.782 1.702 11.062 1.00 0.00 C ATOM 682 CD1 PHE A 46 10.776 1.927 12.429 1.00 0.00 C ATOM 683 CD2 PHE A 46 11.256 2.699 10.225 1.00 0.00 C ATOM 684 CE1 PHE A 46 11.233 3.123 12.951 1.00 0.00 C ATOM 685 CE2 PHE A 46 11.714 3.897 10.740 1.00 0.00 C ATOM 686 CZ PHE A 46 11.704 4.108 12.105 1.00 0.00 C ATOM 0 H PHE A 46 12.301 -0.088 8.730 1.00 0.00 H new ATOM 0 HA PHE A 46 11.668 -0.891 11.512 1.00 0.00 H new ATOM 0 HB2 PHE A 46 9.933 0.567 9.479 1.00 0.00 H new ATOM 0 HB3 PHE A 46 9.424 0.068 11.080 1.00 0.00 H new ATOM 0 HD1 PHE A 46 10.410 1.159 13.095 1.00 0.00 H new ATOM 0 HD2 PHE A 46 11.268 2.538 9.157 1.00 0.00 H new ATOM 0 HE1 PHE A 46 11.222 3.287 14.018 1.00 0.00 H new ATOM 0 HE2 PHE A 46 12.079 4.667 10.076 1.00 0.00 H new ATOM 0 HZ PHE A 46 12.064 5.042 12.510 1.00 0.00 H new ATOM 696 N LYS A 47 11.543 -2.727 9.167 1.00 0.00 N ATOM 697 CA LYS A 47 11.096 -3.979 8.570 1.00 0.00 C ATOM 698 C LYS A 47 9.628 -3.894 8.164 1.00 0.00 C ATOM 699 O LYS A 47 8.852 -4.818 8.409 1.00 0.00 O ATOM 700 CB LYS A 47 11.299 -5.138 9.550 1.00 0.00 C ATOM 701 CG LYS A 47 12.741 -5.601 9.653 1.00 0.00 C ATOM 702 CD LYS A 47 13.166 -6.378 8.418 1.00 0.00 C ATOM 703 CE LYS A 47 14.387 -5.752 7.760 1.00 0.00 C ATOM 704 NZ LYS A 47 15.364 -6.783 7.311 1.00 0.00 N ATOM 0 H LYS A 47 12.507 -2.477 8.948 1.00 0.00 H new ATOM 0 HA LYS A 47 11.693 -4.159 7.676 1.00 0.00 H new ATOM 0 HB2 LYS A 47 10.953 -4.833 10.537 1.00 0.00 H new ATOM 0 HB3 LYS A 47 10.678 -5.978 9.240 1.00 0.00 H new ATOM 0 HG2 LYS A 47 13.393 -4.737 9.783 1.00 0.00 H new ATOM 0 HG3 LYS A 47 12.861 -6.227 10.537 1.00 0.00 H new ATOM 0 HD2 LYS A 47 13.388 -7.409 8.694 1.00 0.00 H new ATOM 0 HD3 LYS A 47 12.342 -6.409 7.705 1.00 0.00 H new ATOM 0 HE2 LYS A 47 14.072 -5.153 6.905 1.00 0.00 H new ATOM 0 HE3 LYS A 47 14.871 -5.074 8.463 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 15.818 -6.470 6.429 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 16.088 -6.918 8.045 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 14.868 -7.682 7.145 1.00 0.00 H new ATOM 718 N ARG A 48 9.254 -2.782 7.542 1.00 0.00 N ATOM 719 CA ARG A 48 7.879 -2.578 7.102 1.00 0.00 C ATOM 720 C ARG A 48 7.790 -2.579 5.579 1.00 0.00 C ATOM 721 O ARG A 48 8.805 -2.654 4.887 1.00 0.00 O ATOM 722 CB ARG A 48 7.336 -1.257 7.653 1.00 0.00 C ATOM 723 CG ARG A 48 6.553 -1.414 8.946 1.00 0.00 C ATOM 724 CD ARG A 48 6.460 -0.099 9.704 1.00 0.00 C ATOM 725 NE ARG A 48 6.674 -0.277 11.138 1.00 0.00 N ATOM 726 CZ ARG A 48 6.872 0.730 11.982 1.00 0.00 C ATOM 727 NH1 ARG A 48 6.881 1.979 11.539 1.00 0.00 N ATOM 728 NH2 ARG A 48 7.059 0.487 13.273 1.00 0.00 N ATOM 0 H ARG A 48 9.884 -2.008 7.331 1.00 0.00 H new ATOM 0 HA ARG A 48 7.275 -3.401 7.485 1.00 0.00 H new ATOM 0 HB2 ARG A 48 8.168 -0.574 7.823 1.00 0.00 H new ATOM 0 HB3 ARG A 48 6.694 -0.796 6.902 1.00 0.00 H new ATOM 0 HG2 ARG A 48 5.550 -1.779 8.723 1.00 0.00 H new ATOM 0 HG3 ARG A 48 7.033 -2.164 9.574 1.00 0.00 H new ATOM 0 HD2 ARG A 48 7.199 0.599 9.311 1.00 0.00 H new ATOM 0 HD3 ARG A 48 5.480 0.347 9.536 1.00 0.00 H new ATOM 0 HE ARG A 48 6.671 -1.226 11.512 1.00 0.00 H new ATOM 0 HH11 ARG A 48 6.736 2.170 10.548 1.00 0.00 H new ATOM 0 HH12 ARG A 48 7.033 2.750 12.190 1.00 0.00 H new ATOM 0 HH21 ARG A 48 7.051 -0.473 13.618 1.00 0.00 H new ATOM 0 HH22 ARG A 48 7.211 1.260 13.921 1.00 0.00 H new ATOM 742 N VAL A 49 6.567 -2.499 5.062 1.00 0.00 N ATOM 743 CA VAL A 49 6.345 -2.491 3.621 1.00 0.00 C ATOM 744 C VAL A 49 5.187 -1.570 3.249 1.00 0.00 C ATOM 745 O VAL A 49 4.030 -1.857 3.555 1.00 0.00 O ATOM 746 CB VAL A 49 6.050 -3.907 3.091 1.00 0.00 C ATOM 747 CG1 VAL A 49 6.065 -3.921 1.571 1.00 0.00 C ATOM 748 CG2 VAL A 49 7.053 -4.904 3.652 1.00 0.00 C ATOM 0 H VAL A 49 5.715 -2.439 5.620 1.00 0.00 H new ATOM 0 HA VAL A 49 7.262 -2.122 3.161 1.00 0.00 H new ATOM 0 HB VAL A 49 5.055 -4.202 3.423 1.00 0.00 H new ATOM 0 HG11 VAL A 49 5.855 -4.929 1.214 1.00 0.00 H new ATOM 0 HG12 VAL A 49 5.305 -3.237 1.193 1.00 0.00 H new ATOM 0 HG13 VAL A 49 7.046 -3.607 1.214 1.00 0.00 H new ATOM 0 HG21 VAL A 49 6.830 -5.899 3.268 1.00 0.00 H new ATOM 0 HG22 VAL A 49 8.060 -4.616 3.351 1.00 0.00 H new ATOM 0 HG23 VAL A 49 6.988 -4.912 4.740 1.00 0.00 H new ATOM 758 N ARG A 50 5.509 -0.464 2.587 1.00 0.00 N ATOM 759 CA ARG A 50 4.496 0.500 2.173 1.00 0.00 C ATOM 760 C ARG A 50 4.023 0.214 0.751 1.00 0.00 C ATOM 761 O ARG A 50 4.782 0.362 -0.208 1.00 0.00 O ATOM 762 CB ARG A 50 5.050 1.924 2.260 1.00 0.00 C ATOM 763 CG ARG A 50 4.067 2.925 2.842 1.00 0.00 C ATOM 764 CD ARG A 50 3.921 4.146 1.946 1.00 0.00 C ATOM 765 NE ARG A 50 3.799 5.380 2.719 1.00 0.00 N ATOM 766 CZ ARG A 50 3.667 6.581 2.168 1.00 0.00 C ATOM 767 NH1 ARG A 50 3.641 6.711 0.849 1.00 0.00 N ATOM 768 NH2 ARG A 50 3.561 7.657 2.938 1.00 0.00 N ATOM 0 H ARG A 50 6.462 -0.213 2.326 1.00 0.00 H new ATOM 0 HA ARG A 50 3.645 0.407 2.847 1.00 0.00 H new ATOM 0 HB2 ARG A 50 5.953 1.917 2.871 1.00 0.00 H new ATOM 0 HB3 ARG A 50 5.343 2.253 1.263 1.00 0.00 H new ATOM 0 HG2 ARG A 50 3.095 2.449 2.972 1.00 0.00 H new ATOM 0 HG3 ARG A 50 4.405 3.236 3.831 1.00 0.00 H new ATOM 0 HD2 ARG A 50 4.785 4.216 1.285 1.00 0.00 H new ATOM 0 HD3 ARG A 50 3.043 4.027 1.311 1.00 0.00 H new ATOM 0 HE ARG A 50 3.816 5.315 3.737 1.00 0.00 H new ATOM 0 HH11 ARG A 50 3.723 5.887 0.254 1.00 0.00 H new ATOM 0 HH12 ARG A 50 3.539 7.635 0.430 1.00 0.00 H new ATOM 0 HH21 ARG A 50 3.581 7.562 3.953 1.00 0.00 H new ATOM 0 HH22 ARG A 50 3.460 8.579 2.514 1.00 0.00 H new ATOM 782 N ILE A 51 2.766 -0.196 0.623 1.00 0.00 N ATOM 783 CA ILE A 51 2.192 -0.501 -0.682 1.00 0.00 C ATOM 784 C ILE A 51 1.182 0.562 -1.100 1.00 0.00 C ATOM 785 O ILE A 51 0.090 0.650 -0.541 1.00 0.00 O ATOM 786 CB ILE A 51 1.500 -1.879 -0.683 1.00 0.00 C ATOM 787 CG1 ILE A 51 2.506 -2.978 -0.338 1.00 0.00 C ATOM 788 CG2 ILE A 51 0.858 -2.147 -2.036 1.00 0.00 C ATOM 789 CD1 ILE A 51 2.165 -3.734 0.928 1.00 0.00 C ATOM 0 H ILE A 51 2.126 -0.325 1.406 1.00 0.00 H new ATOM 0 HA ILE A 51 3.016 -0.516 -1.395 1.00 0.00 H new ATOM 0 HB ILE A 51 0.717 -1.878 0.075 1.00 0.00 H new ATOM 0 HG12 ILE A 51 2.562 -3.682 -1.168 1.00 0.00 H new ATOM 0 HG13 ILE A 51 3.495 -2.533 -0.231 1.00 0.00 H new ATOM 0 HG21 ILE A 51 0.373 -3.123 -2.022 1.00 0.00 H new ATOM 0 HG22 ILE A 51 0.116 -1.377 -2.246 1.00 0.00 H new ATOM 0 HG23 ILE A 51 1.624 -2.133 -2.811 1.00 0.00 H new ATOM 0 HD11 ILE A 51 2.921 -4.498 1.111 1.00 0.00 H new ATOM 0 HD12 ILE A 51 2.138 -3.041 1.769 1.00 0.00 H new ATOM 0 HD13 ILE A 51 1.190 -4.208 0.817 1.00 0.00 H new ATOM 801 N ASN A 52 1.555 1.366 -2.091 1.00 0.00 N ATOM 802 CA ASN A 52 0.682 2.424 -2.587 1.00 0.00 C ATOM 803 C ASN A 52 -0.079 1.964 -3.828 1.00 0.00 C ATOM 804 O ASN A 52 0.521 1.546 -4.818 1.00 0.00 O ATOM 805 CB ASN A 52 1.497 3.677 -2.912 1.00 0.00 C ATOM 806 CG ASN A 52 0.840 4.943 -2.396 1.00 0.00 C ATOM 807 OD1 ASN A 52 0.389 5.783 -3.175 1.00 0.00 O ATOM 808 ND2 ASN A 52 0.784 5.085 -1.077 1.00 0.00 N ATOM 0 H ASN A 52 2.456 1.305 -2.566 1.00 0.00 H new ATOM 0 HA ASN A 52 -0.040 2.661 -1.805 1.00 0.00 H new ATOM 0 HB2 ASN A 52 2.492 3.583 -2.476 1.00 0.00 H new ATOM 0 HB3 ASN A 52 1.628 3.753 -3.992 1.00 0.00 H new ATOM 0 HD21 ASN A 52 0.354 5.916 -0.671 1.00 0.00 H new ATOM 0 HD22 ASN A 52 1.171 4.363 -0.469 1.00 0.00 H new ATOM 815 N PHE A 53 -1.404 2.044 -3.765 1.00 0.00 N ATOM 816 CA PHE A 53 -2.248 1.636 -4.882 1.00 0.00 C ATOM 817 C PHE A 53 -2.682 2.845 -5.706 1.00 0.00 C ATOM 818 O PHE A 53 -2.375 3.986 -5.362 1.00 0.00 O ATOM 819 CB PHE A 53 -3.479 0.883 -4.371 1.00 0.00 C ATOM 820 CG PHE A 53 -3.143 -0.332 -3.554 1.00 0.00 C ATOM 821 CD1 PHE A 53 -2.477 -0.206 -2.345 1.00 0.00 C ATOM 822 CD2 PHE A 53 -3.492 -1.597 -3.994 1.00 0.00 C ATOM 823 CE1 PHE A 53 -2.166 -1.323 -1.590 1.00 0.00 C ATOM 824 CE2 PHE A 53 -3.185 -2.716 -3.243 1.00 0.00 C ATOM 825 CZ PHE A 53 -2.520 -2.579 -2.041 1.00 0.00 C ATOM 0 H PHE A 53 -1.916 2.387 -2.953 1.00 0.00 H new ATOM 0 HA PHE A 53 -1.665 0.973 -5.522 1.00 0.00 H new ATOM 0 HB2 PHE A 53 -4.085 1.560 -3.768 1.00 0.00 H new ATOM 0 HB3 PHE A 53 -4.089 0.581 -5.222 1.00 0.00 H new ATOM 0 HD1 PHE A 53 -2.198 0.774 -1.988 1.00 0.00 H new ATOM 0 HD2 PHE A 53 -4.010 -1.711 -4.935 1.00 0.00 H new ATOM 0 HE1 PHE A 53 -1.647 -1.213 -0.649 1.00 0.00 H new ATOM 0 HE2 PHE A 53 -3.465 -3.697 -3.596 1.00 0.00 H new ATOM 0 HZ PHE A 53 -2.277 -3.453 -1.454 1.00 0.00 H new ATOM 835 N SER A 54 -3.398 2.584 -6.796 1.00 0.00 N ATOM 836 CA SER A 54 -3.871 3.650 -7.671 1.00 0.00 C ATOM 837 C SER A 54 -5.308 4.033 -7.332 1.00 0.00 C ATOM 838 O SER A 54 -5.835 5.023 -7.840 1.00 0.00 O ATOM 839 CB SER A 54 -3.780 3.214 -9.135 1.00 0.00 C ATOM 840 OG SER A 54 -4.008 4.308 -10.007 1.00 0.00 O ATOM 0 H SER A 54 -3.663 1.645 -7.093 1.00 0.00 H new ATOM 0 HA SER A 54 -3.235 4.522 -7.518 1.00 0.00 H new ATOM 0 HB2 SER A 54 -2.796 2.788 -9.330 1.00 0.00 H new ATOM 0 HB3 SER A 54 -4.512 2.430 -9.331 1.00 0.00 H new ATOM 0 HG SER A 54 -4.661 4.918 -9.603 1.00 0.00 H new ATOM 846 N ASN A 55 -5.937 3.242 -6.468 1.00 0.00 N ATOM 847 CA ASN A 55 -7.314 3.498 -6.061 1.00 0.00 C ATOM 848 C ASN A 55 -7.565 2.991 -4.644 1.00 0.00 C ATOM 849 O ASN A 55 -7.034 1.964 -4.223 1.00 0.00 O ATOM 850 CB ASN A 55 -8.288 2.830 -7.034 1.00 0.00 C ATOM 851 CG ASN A 55 -7.852 2.974 -8.479 1.00 0.00 C ATOM 852 OD1 ASN A 55 -8.013 4.034 -9.085 1.00 0.00 O ATOM 853 ND2 ASN A 55 -7.297 1.906 -9.038 1.00 0.00 N ATOM 0 H ASN A 55 -5.515 2.419 -6.037 1.00 0.00 H new ATOM 0 HA ASN A 55 -7.477 4.576 -6.077 1.00 0.00 H new ATOM 0 HB2 ASN A 55 -8.375 1.772 -6.787 1.00 0.00 H new ATOM 0 HB3 ASN A 55 -9.278 3.268 -6.911 1.00 0.00 H new ATOM 0 HD21 ASN A 55 -6.984 1.943 -10.008 1.00 0.00 H new ATOM 0 HD22 ASN A 55 -7.184 1.048 -8.498 1.00 0.00 H new ATOM 860 N PRO A 56 -8.395 3.729 -3.891 1.00 0.00 N ATOM 861 CA PRO A 56 -8.735 3.373 -2.510 1.00 0.00 C ATOM 862 C PRO A 56 -9.613 2.128 -2.432 1.00 0.00 C ATOM 863 O PRO A 56 -10.006 1.700 -1.346 1.00 0.00 O ATOM 864 CB PRO A 56 -9.501 4.600 -2.006 1.00 0.00 C ATOM 865 CG PRO A 56 -10.062 5.226 -3.236 1.00 0.00 C ATOM 866 CD PRO A 56 -9.063 4.966 -4.328 1.00 0.00 C ATOM 0 HA PRO A 56 -7.850 3.134 -1.921 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -10.291 4.316 -1.311 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -8.842 5.288 -1.476 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -11.032 4.796 -3.485 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -10.215 6.296 -3.094 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -9.549 4.840 -5.296 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -8.356 5.790 -4.431 1.00 0.00 H new ATOM 874 N LEU A 57 -9.918 1.552 -3.589 1.00 0.00 N ATOM 875 CA LEU A 57 -10.749 0.355 -3.652 1.00 0.00 C ATOM 876 C LEU A 57 -9.915 -0.901 -3.418 1.00 0.00 C ATOM 877 O LEU A 57 -10.114 -1.617 -2.437 1.00 0.00 O ATOM 878 CB LEU A 57 -11.452 0.269 -5.007 1.00 0.00 C ATOM 879 CG LEU A 57 -12.613 1.241 -5.224 1.00 0.00 C ATOM 880 CD1 LEU A 57 -12.723 1.621 -6.693 1.00 0.00 C ATOM 881 CD2 LEU A 57 -13.917 0.631 -4.729 1.00 0.00 C ATOM 0 H LEU A 57 -9.602 1.894 -4.497 1.00 0.00 H new ATOM 0 HA LEU A 57 -11.499 0.422 -2.864 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -10.712 0.438 -5.789 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -11.826 -0.747 -5.136 1.00 0.00 H new ATOM 0 HG LEU A 57 -12.417 2.147 -4.650 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -13.554 2.313 -6.829 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -11.798 2.098 -7.016 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -12.896 0.725 -7.289 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -14.733 1.336 -4.891 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -14.119 -0.290 -5.276 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -13.834 0.410 -3.665 1.00 0.00 H new ATOM 893 N SER A 58 -8.979 -1.160 -4.325 1.00 0.00 N ATOM 894 CA SER A 58 -8.115 -2.330 -4.219 1.00 0.00 C ATOM 895 C SER A 58 -7.515 -2.438 -2.819 1.00 0.00 C ATOM 896 O SER A 58 -7.539 -3.502 -2.203 1.00 0.00 O ATOM 897 CB SER A 58 -6.997 -2.261 -5.260 1.00 0.00 C ATOM 898 OG SER A 58 -6.975 -3.428 -6.063 1.00 0.00 O ATOM 0 H SER A 58 -8.799 -0.576 -5.141 1.00 0.00 H new ATOM 0 HA SER A 58 -8.722 -3.216 -4.405 1.00 0.00 H new ATOM 0 HB2 SER A 58 -7.138 -1.384 -5.892 1.00 0.00 H new ATOM 0 HB3 SER A 58 -6.036 -2.142 -4.759 1.00 0.00 H new ATOM 0 HG SER A 58 -6.365 -3.294 -6.818 1.00 0.00 H new ATOM 904 N ALA A 59 -6.979 -1.327 -2.326 1.00 0.00 N ATOM 905 CA ALA A 59 -6.375 -1.294 -1.000 1.00 0.00 C ATOM 906 C ALA A 59 -7.164 -2.152 -0.016 1.00 0.00 C ATOM 907 O ALA A 59 -6.588 -2.794 0.862 1.00 0.00 O ATOM 908 CB ALA A 59 -6.283 0.139 -0.496 1.00 0.00 C ATOM 0 H ALA A 59 -6.951 -0.438 -2.825 1.00 0.00 H new ATOM 0 HA ALA A 59 -5.369 -1.706 -1.077 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -5.830 0.148 0.495 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -5.671 0.727 -1.180 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -7.282 0.571 -0.442 1.00 0.00 H new ATOM 914 N ALA A 60 -8.483 -2.159 -0.170 1.00 0.00 N ATOM 915 CA ALA A 60 -9.351 -2.939 0.704 1.00 0.00 C ATOM 916 C ALA A 60 -9.182 -4.433 0.452 1.00 0.00 C ATOM 917 O ALA A 60 -8.783 -5.182 1.344 1.00 0.00 O ATOM 918 CB ALA A 60 -10.803 -2.530 0.508 1.00 0.00 C ATOM 0 H ALA A 60 -8.975 -1.633 -0.892 1.00 0.00 H new ATOM 0 HA ALA A 60 -9.064 -2.736 1.736 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -11.439 -3.121 1.167 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -10.918 -1.472 0.745 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -11.093 -2.704 -0.528 1.00 0.00 H new ATOM 924 N ASP A 61 -9.491 -4.862 -0.767 1.00 0.00 N ATOM 925 CA ASP A 61 -9.373 -6.268 -1.137 1.00 0.00 C ATOM 926 C ASP A 61 -7.975 -6.794 -0.831 1.00 0.00 C ATOM 927 O ASP A 61 -7.793 -7.980 -0.557 1.00 0.00 O ATOM 928 CB ASP A 61 -9.689 -6.455 -2.621 1.00 0.00 C ATOM 929 CG ASP A 61 -10.718 -7.542 -2.860 1.00 0.00 C ATOM 930 OD1 ASP A 61 -10.377 -8.730 -2.685 1.00 0.00 O ATOM 931 OD2 ASP A 61 -11.865 -7.204 -3.225 1.00 0.00 O ATOM 0 H ASP A 61 -9.825 -4.256 -1.516 1.00 0.00 H new ATOM 0 HA ASP A 61 -10.092 -6.836 -0.547 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -10.055 -5.515 -3.033 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -8.772 -6.702 -3.157 1.00 0.00 H new ATOM 936 N ALA A 62 -6.989 -5.905 -0.880 1.00 0.00 N ATOM 937 CA ALA A 62 -5.606 -6.280 -0.607 1.00 0.00 C ATOM 938 C ALA A 62 -5.436 -6.734 0.838 1.00 0.00 C ATOM 939 O ALA A 62 -4.517 -7.490 1.157 1.00 0.00 O ATOM 940 CB ALA A 62 -4.674 -5.116 -0.911 1.00 0.00 C ATOM 0 H ALA A 62 -7.122 -4.919 -1.106 1.00 0.00 H new ATOM 0 HA ALA A 62 -5.347 -7.117 -1.256 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -3.645 -5.410 -0.703 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -4.767 -4.840 -1.961 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -4.941 -4.263 -0.287 1.00 0.00 H new ATOM 946 N ARG A 63 -6.326 -6.270 1.709 1.00 0.00 N ATOM 947 CA ARG A 63 -6.272 -6.627 3.121 1.00 0.00 C ATOM 948 C ARG A 63 -6.928 -7.984 3.364 1.00 0.00 C ATOM 949 O ARG A 63 -6.271 -8.936 3.785 1.00 0.00 O ATOM 950 CB ARG A 63 -6.962 -5.556 3.967 1.00 0.00 C ATOM 951 CG ARG A 63 -6.569 -5.591 5.435 1.00 0.00 C ATOM 952 CD ARG A 63 -7.333 -4.554 6.242 1.00 0.00 C ATOM 953 NE ARG A 63 -7.781 -5.082 7.527 1.00 0.00 N ATOM 954 CZ ARG A 63 -8.678 -6.056 7.649 1.00 0.00 C ATOM 955 NH1 ARG A 63 -9.216 -6.605 6.569 1.00 0.00 N ATOM 956 NH2 ARG A 63 -9.035 -6.482 8.853 1.00 0.00 N ATOM 0 H ARG A 63 -7.094 -5.646 1.461 1.00 0.00 H new ATOM 0 HA ARG A 63 -5.224 -6.691 3.414 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -6.723 -4.574 3.559 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -8.042 -5.681 3.886 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -6.763 -6.584 5.841 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -5.498 -5.411 5.530 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -6.697 -3.684 6.409 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -8.196 -4.213 5.670 1.00 0.00 H new ATOM 0 HE ARG A 63 -7.384 -4.682 8.377 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -8.942 -6.280 5.642 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -9.904 -7.352 6.665 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -8.622 -6.063 9.686 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -9.723 -7.229 8.946 1.00 0.00 H new ATOM 970 N LEU A 64 -8.226 -8.063 3.095 1.00 0.00 N ATOM 971 CA LEU A 64 -8.972 -9.302 3.284 1.00 0.00 C ATOM 972 C LEU A 64 -8.189 -10.496 2.747 1.00 0.00 C ATOM 973 O LEU A 64 -8.192 -11.572 3.345 1.00 0.00 O ATOM 974 CB LEU A 64 -10.331 -9.214 2.588 1.00 0.00 C ATOM 975 CG LEU A 64 -10.404 -9.802 1.179 1.00 0.00 C ATOM 976 CD1 LEU A 64 -10.654 -11.301 1.238 1.00 0.00 C ATOM 977 CD2 LEU A 64 -11.489 -9.110 0.367 1.00 0.00 C ATOM 0 H LEU A 64 -8.784 -7.284 2.745 1.00 0.00 H new ATOM 0 HA LEU A 64 -9.127 -9.444 4.353 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -11.069 -9.721 3.210 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -10.623 -8.165 2.538 1.00 0.00 H new ATOM 0 HG LEU A 64 -9.446 -9.633 0.686 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -10.703 -11.702 0.226 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -9.842 -11.784 1.781 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -11.597 -11.493 1.750 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -11.526 -9.542 -0.633 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -12.453 -9.246 0.857 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -11.266 -8.045 0.295 1.00 0.00 H new ATOM 989 N ARG A 65 -7.520 -10.298 1.616 1.00 0.00 N ATOM 990 CA ARG A 65 -6.732 -11.358 0.999 1.00 0.00 C ATOM 991 C ARG A 65 -5.428 -11.581 1.762 1.00 0.00 C ATOM 992 O ARG A 65 -4.902 -12.693 1.800 1.00 0.00 O ATOM 993 CB ARG A 65 -6.430 -11.014 -0.460 1.00 0.00 C ATOM 994 CG ARG A 65 -7.473 -11.529 -1.437 1.00 0.00 C ATOM 995 CD ARG A 65 -6.845 -12.387 -2.523 1.00 0.00 C ATOM 996 NE ARG A 65 -7.701 -13.510 -2.898 1.00 0.00 N ATOM 997 CZ ARG A 65 -8.855 -13.371 -3.542 1.00 0.00 C ATOM 998 NH1 ARG A 65 -9.288 -12.165 -3.882 1.00 0.00 N ATOM 999 NH2 ARG A 65 -9.577 -14.441 -3.848 1.00 0.00 N ATOM 0 H ARG A 65 -7.508 -9.413 1.108 1.00 0.00 H new ATOM 0 HA ARG A 65 -7.315 -12.278 1.035 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -6.354 -9.931 -0.561 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -5.458 -11.428 -0.728 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -8.221 -12.112 -0.899 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -7.993 -10.687 -1.893 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -6.648 -11.773 -3.401 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -5.883 -12.765 -2.176 1.00 0.00 H new ATOM 0 HE ARG A 65 -7.396 -14.452 -2.652 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -8.735 -11.340 -3.649 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -10.174 -12.062 -4.376 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -9.246 -15.370 -3.589 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -10.463 -14.334 -4.342 1.00 0.00 H new ATOM 1013 N LEU A 66 -4.913 -10.516 2.365 1.00 0.00 N ATOM 1014 CA LEU A 66 -3.671 -10.594 3.126 1.00 0.00 C ATOM 1015 C LEU A 66 -3.929 -10.372 4.613 1.00 0.00 C ATOM 1016 O LEU A 66 -4.999 -10.702 5.126 1.00 0.00 O ATOM 1017 CB LEU A 66 -2.668 -9.560 2.611 1.00 0.00 C ATOM 1018 CG LEU A 66 -2.545 -9.444 1.091 1.00 0.00 C ATOM 1019 CD1 LEU A 66 -1.808 -8.170 0.712 1.00 0.00 C ATOM 1020 CD2 LEU A 66 -1.838 -10.663 0.518 1.00 0.00 C ATOM 0 H LEU A 66 -5.336 -9.588 2.342 1.00 0.00 H new ATOM 0 HA LEU A 66 -3.254 -11.592 2.993 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -2.946 -8.584 3.009 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -1.686 -9.802 3.018 1.00 0.00 H new ATOM 0 HG LEU A 66 -3.548 -9.399 0.667 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -1.730 -8.104 -0.373 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -2.356 -7.307 1.089 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -0.809 -8.184 1.148 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -1.760 -10.563 -0.565 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -0.840 -10.740 0.948 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -2.407 -11.561 0.759 1.00 0.00 H new ATOM 1032 N HIS A 67 -2.941 -9.810 5.302 1.00 0.00 N ATOM 1033 CA HIS A 67 -3.061 -9.541 6.731 1.00 0.00 C ATOM 1034 C HIS A 67 -2.720 -10.783 7.548 1.00 0.00 C ATOM 1035 O HIS A 67 -1.868 -11.582 7.158 1.00 0.00 O ATOM 1036 CB HIS A 67 -4.477 -9.070 7.065 1.00 0.00 C ATOM 1037 CG HIS A 67 -4.537 -8.127 8.227 1.00 0.00 C ATOM 1038 ND1 HIS A 67 -3.414 -7.686 8.896 1.00 0.00 N ATOM 1039 CD2 HIS A 67 -5.592 -7.539 8.837 1.00 0.00 C ATOM 1040 CE1 HIS A 67 -3.777 -6.869 9.869 1.00 0.00 C ATOM 1041 NE2 HIS A 67 -5.093 -6.762 9.854 1.00 0.00 N ATOM 0 H HIS A 67 -2.048 -9.532 4.894 1.00 0.00 H new ATOM 0 HA HIS A 67 -2.353 -8.753 6.988 1.00 0.00 H new ATOM 0 HB2 HIS A 67 -4.904 -8.582 6.189 1.00 0.00 H new ATOM 0 HB3 HIS A 67 -5.099 -9.939 7.281 1.00 0.00 H new ATOM 0 HD2 HIS A 67 -6.633 -7.658 8.573 1.00 0.00 H new ATOM 0 HE1 HIS A 67 -3.111 -6.373 10.559 1.00 0.00 H new ATOM 0 HE2 HIS A 67 -5.649 -6.194 10.494 1.00 0.00 H new ATOM 1049 N LYS A 68 -3.389 -10.940 8.685 1.00 0.00 N ATOM 1050 CA LYS A 68 -3.157 -12.084 9.559 1.00 0.00 C ATOM 1051 C LYS A 68 -2.831 -13.332 8.745 1.00 0.00 C ATOM 1052 O LYS A 68 -2.066 -14.191 9.184 1.00 0.00 O ATOM 1053 CB LYS A 68 -4.386 -12.340 10.435 1.00 0.00 C ATOM 1054 CG LYS A 68 -4.545 -11.341 11.567 1.00 0.00 C ATOM 1055 CD LYS A 68 -6.009 -11.048 11.850 1.00 0.00 C ATOM 1056 CE LYS A 68 -6.464 -9.769 11.164 1.00 0.00 C ATOM 1057 NZ LYS A 68 -7.507 -9.057 11.954 1.00 0.00 N ATOM 0 H LYS A 68 -4.097 -10.289 9.023 1.00 0.00 H new ATOM 0 HA LYS A 68 -2.304 -11.855 10.198 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -5.279 -12.313 9.810 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -4.320 -13.344 10.854 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -4.070 -11.731 12.467 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -4.030 -10.415 11.311 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -6.621 -11.883 11.508 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -6.162 -10.960 12.926 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -5.607 -9.111 11.017 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -6.856 -10.007 10.175 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -7.791 -8.191 11.453 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -8.335 -9.675 12.073 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -7.125 -8.807 12.888 1.00 0.00 H new ATOM 1071 N THR A 69 -3.415 -13.427 7.555 1.00 0.00 N ATOM 1072 CA THR A 69 -3.186 -14.569 6.679 1.00 0.00 C ATOM 1073 C THR A 69 -1.767 -15.105 6.834 1.00 0.00 C ATOM 1074 O THR A 69 -0.797 -14.356 6.727 1.00 0.00 O ATOM 1075 CB THR A 69 -3.426 -14.202 5.202 1.00 0.00 C ATOM 1076 OG1 THR A 69 -2.584 -13.106 4.827 1.00 0.00 O ATOM 1077 CG2 THR A 69 -4.883 -13.835 4.966 1.00 0.00 C ATOM 0 H THR A 69 -4.051 -12.726 7.175 1.00 0.00 H new ATOM 0 HA THR A 69 -3.897 -15.341 6.974 1.00 0.00 H new ATOM 0 HB THR A 69 -3.184 -15.071 4.590 1.00 0.00 H new ATOM 0 HG1 THR A 69 -2.241 -12.666 5.633 1.00 0.00 H new ATOM 0 HG21 THR A 69 -5.028 -13.580 3.916 1.00 0.00 H new ATOM 0 HG22 THR A 69 -5.518 -14.682 5.225 1.00 0.00 H new ATOM 0 HG23 THR A 69 -5.148 -12.980 5.588 1.00 0.00 H new ATOM 1085 N GLU A 70 -1.655 -16.405 7.086 1.00 0.00 N ATOM 1086 CA GLU A 70 -0.352 -17.039 7.256 1.00 0.00 C ATOM 1087 C GLU A 70 0.450 -16.990 5.958 1.00 0.00 C ATOM 1088 O GLU A 70 0.366 -17.896 5.128 1.00 0.00 O ATOM 1089 CB GLU A 70 -0.523 -18.491 7.707 1.00 0.00 C ATOM 1090 CG GLU A 70 -0.136 -18.727 9.158 1.00 0.00 C ATOM 1091 CD GLU A 70 -0.404 -20.150 9.609 1.00 0.00 C ATOM 1092 OE1 GLU A 70 -0.116 -21.084 8.831 1.00 0.00 O ATOM 1093 OE2 GLU A 70 -0.899 -20.330 10.741 1.00 0.00 O ATOM 0 H GLU A 70 -2.449 -17.039 7.177 1.00 0.00 H new ATOM 0 HA GLU A 70 0.195 -16.489 8.022 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -1.562 -18.787 7.564 1.00 0.00 H new ATOM 0 HB3 GLU A 70 0.082 -19.135 7.069 1.00 0.00 H new ATOM 0 HG2 GLU A 70 0.922 -18.501 9.289 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -0.690 -18.037 9.795 1.00 0.00 H new ATOM 1100 N PHE A 71 1.227 -15.925 5.790 1.00 0.00 N ATOM 1101 CA PHE A 71 2.044 -15.755 4.594 1.00 0.00 C ATOM 1102 C PHE A 71 3.284 -16.642 4.653 1.00 0.00 C ATOM 1103 O PHE A 71 4.268 -16.310 5.316 1.00 0.00 O ATOM 1104 CB PHE A 71 2.457 -14.291 4.438 1.00 0.00 C ATOM 1105 CG PHE A 71 3.566 -14.084 3.446 1.00 0.00 C ATOM 1106 CD1 PHE A 71 3.294 -13.993 2.091 1.00 0.00 C ATOM 1107 CD2 PHE A 71 4.882 -13.981 3.870 1.00 0.00 C ATOM 1108 CE1 PHE A 71 4.313 -13.803 1.177 1.00 0.00 C ATOM 1109 CE2 PHE A 71 5.905 -13.790 2.961 1.00 0.00 C ATOM 1110 CZ PHE A 71 5.620 -13.701 1.612 1.00 0.00 C ATOM 0 H PHE A 71 1.308 -15.167 6.467 1.00 0.00 H new ATOM 0 HA PHE A 71 1.448 -16.051 3.731 1.00 0.00 H new ATOM 0 HB2 PHE A 71 1.590 -13.708 4.128 1.00 0.00 H new ATOM 0 HB3 PHE A 71 2.771 -13.905 5.408 1.00 0.00 H new ATOM 0 HD1 PHE A 71 2.274 -14.071 1.745 1.00 0.00 H new ATOM 0 HD2 PHE A 71 5.110 -14.051 4.923 1.00 0.00 H new ATOM 0 HE1 PHE A 71 4.087 -13.734 0.123 1.00 0.00 H new ATOM 0 HE2 PHE A 71 6.926 -13.710 3.304 1.00 0.00 H new ATOM 0 HZ PHE A 71 6.418 -13.552 0.899 1.00 0.00 H new ATOM 1120 N LEU A 72 3.230 -17.770 3.955 1.00 0.00 N ATOM 1121 CA LEU A 72 4.349 -18.707 3.926 1.00 0.00 C ATOM 1122 C LEU A 72 4.649 -19.239 5.324 1.00 0.00 C ATOM 1123 O LEU A 72 5.749 -19.723 5.593 1.00 0.00 O ATOM 1124 CB LEU A 72 5.593 -18.029 3.348 1.00 0.00 C ATOM 1125 CG LEU A 72 5.783 -18.153 1.836 1.00 0.00 C ATOM 1126 CD1 LEU A 72 5.957 -16.780 1.205 1.00 0.00 C ATOM 1127 CD2 LEU A 72 6.976 -19.043 1.520 1.00 0.00 C ATOM 0 H LEU A 72 2.424 -18.059 3.401 1.00 0.00 H new ATOM 0 HA LEU A 72 4.072 -19.547 3.289 1.00 0.00 H new ATOM 0 HB2 LEU A 72 5.557 -16.970 3.604 1.00 0.00 H new ATOM 0 HB3 LEU A 72 6.472 -18.446 3.840 1.00 0.00 H new ATOM 0 HG LEU A 72 4.890 -18.613 1.413 1.00 0.00 H new ATOM 0 HD11 LEU A 72 6.091 -16.889 0.129 1.00 0.00 H new ATOM 0 HD12 LEU A 72 5.072 -16.175 1.401 1.00 0.00 H new ATOM 0 HD13 LEU A 72 6.833 -16.292 1.632 1.00 0.00 H new ATOM 0 HD21 LEU A 72 7.096 -19.120 0.439 1.00 0.00 H new ATOM 0 HD22 LEU A 72 7.877 -18.612 1.956 1.00 0.00 H new ATOM 0 HD23 LEU A 72 6.810 -20.036 1.938 1.00 0.00 H new ATOM 1139 N GLY A 73 3.664 -19.147 6.212 1.00 0.00 N ATOM 1140 CA GLY A 73 3.842 -19.625 7.571 1.00 0.00 C ATOM 1141 C GLY A 73 3.882 -18.496 8.581 1.00 0.00 C ATOM 1142 O GLY A 73 3.524 -18.681 9.745 1.00 0.00 O ATOM 0 H GLY A 73 2.745 -18.750 6.015 1.00 0.00 H new ATOM 0 HA2 GLY A 73 3.029 -20.305 7.823 1.00 0.00 H new ATOM 0 HA3 GLY A 73 4.767 -20.197 7.633 1.00 0.00 H new ATOM 1146 N LYS A 74 4.320 -17.323 8.138 1.00 0.00 N ATOM 1147 CA LYS A 74 4.407 -16.158 9.012 1.00 0.00 C ATOM 1148 C LYS A 74 3.207 -15.238 8.812 1.00 0.00 C ATOM 1149 O LYS A 74 2.756 -15.028 7.688 1.00 0.00 O ATOM 1150 CB LYS A 74 5.703 -15.389 8.744 1.00 0.00 C ATOM 1151 CG LYS A 74 6.951 -16.121 9.204 1.00 0.00 C ATOM 1152 CD LYS A 74 7.267 -15.823 10.661 1.00 0.00 C ATOM 1153 CE LYS A 74 7.835 -17.044 11.369 1.00 0.00 C ATOM 1154 NZ LYS A 74 7.438 -17.086 12.805 1.00 0.00 N ATOM 0 H LYS A 74 4.621 -17.153 7.178 1.00 0.00 H new ATOM 0 HA LYS A 74 4.407 -16.508 10.044 1.00 0.00 H new ATOM 0 HB2 LYS A 74 5.782 -15.189 7.675 1.00 0.00 H new ATOM 0 HB3 LYS A 74 5.653 -14.423 9.246 1.00 0.00 H new ATOM 0 HG2 LYS A 74 6.814 -17.194 9.073 1.00 0.00 H new ATOM 0 HG3 LYS A 74 7.796 -15.829 8.580 1.00 0.00 H new ATOM 0 HD2 LYS A 74 7.982 -15.002 10.719 1.00 0.00 H new ATOM 0 HD3 LYS A 74 6.362 -15.494 11.171 1.00 0.00 H new ATOM 0 HE2 LYS A 74 7.488 -17.948 10.869 1.00 0.00 H new ATOM 0 HE3 LYS A 74 8.922 -17.035 11.293 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 7.844 -17.932 13.253 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 7.791 -16.235 13.288 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 6.401 -17.120 12.878 1.00 0.00 H new ATOM 1168 N GLU A 75 2.696 -14.693 9.912 1.00 0.00 N ATOM 1169 CA GLU A 75 1.550 -13.794 9.856 1.00 0.00 C ATOM 1170 C GLU A 75 1.997 -12.354 9.620 1.00 0.00 C ATOM 1171 O GLU A 75 2.844 -11.830 10.341 1.00 0.00 O ATOM 1172 CB GLU A 75 0.742 -13.882 11.153 1.00 0.00 C ATOM 1173 CG GLU A 75 -0.301 -12.786 11.296 1.00 0.00 C ATOM 1174 CD GLU A 75 -0.164 -12.016 12.596 1.00 0.00 C ATOM 1175 OE1 GLU A 75 -0.670 -12.502 13.629 1.00 0.00 O ATOM 1176 OE2 GLU A 75 0.451 -10.929 12.580 1.00 0.00 O ATOM 0 H GLU A 75 3.057 -14.858 10.851 1.00 0.00 H new ATOM 0 HA GLU A 75 0.920 -14.102 9.021 1.00 0.00 H new ATOM 0 HB2 GLU A 75 0.246 -14.852 11.197 1.00 0.00 H new ATOM 0 HB3 GLU A 75 1.425 -13.834 12.001 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -0.214 -12.095 10.458 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -1.296 -13.227 11.243 1.00 0.00 H new ATOM 1183 N MET A 76 1.420 -11.721 8.603 1.00 0.00 N ATOM 1184 CA MET A 76 1.759 -10.343 8.271 1.00 0.00 C ATOM 1185 C MET A 76 0.632 -9.395 8.672 1.00 0.00 C ATOM 1186 O MET A 76 -0.548 -9.726 8.543 1.00 0.00 O ATOM 1187 CB MET A 76 2.043 -10.211 6.774 1.00 0.00 C ATOM 1188 CG MET A 76 2.035 -8.774 6.277 1.00 0.00 C ATOM 1189 SD MET A 76 0.619 -8.412 5.221 1.00 0.00 S ATOM 1190 CE MET A 76 0.755 -9.725 4.011 1.00 0.00 C ATOM 0 H MET A 76 0.716 -12.141 7.996 1.00 0.00 H new ATOM 0 HA MET A 76 2.655 -10.071 8.828 1.00 0.00 H new ATOM 0 HB2 MET A 76 3.014 -10.656 6.556 1.00 0.00 H new ATOM 0 HB3 MET A 76 1.298 -10.782 6.220 1.00 0.00 H new ATOM 0 HG2 MET A 76 2.028 -8.098 7.132 1.00 0.00 H new ATOM 0 HG3 MET A 76 2.954 -8.580 5.725 1.00 0.00 H new ATOM 0 HE1 MET A 76 0.505 -9.337 3.024 1.00 0.00 H new ATOM 0 HE2 MET A 76 1.776 -10.108 4.002 1.00 0.00 H new ATOM 0 HE3 MET A 76 0.068 -10.531 4.269 1.00 0.00 H new ATOM 1200 N LYS A 77 1.003 -8.216 9.160 1.00 0.00 N ATOM 1201 CA LYS A 77 0.024 -7.219 9.578 1.00 0.00 C ATOM 1202 C LYS A 77 -0.161 -6.153 8.503 1.00 0.00 C ATOM 1203 O LYS A 77 0.654 -6.031 7.588 1.00 0.00 O ATOM 1204 CB LYS A 77 0.463 -6.565 10.890 1.00 0.00 C ATOM 1205 CG LYS A 77 -0.125 -7.224 12.125 1.00 0.00 C ATOM 1206 CD LYS A 77 -1.474 -6.627 12.489 1.00 0.00 C ATOM 1207 CE LYS A 77 -1.622 -6.458 13.994 1.00 0.00 C ATOM 1208 NZ LYS A 77 -2.872 -5.733 14.350 1.00 0.00 N ATOM 0 H LYS A 77 1.974 -7.927 9.276 1.00 0.00 H new ATOM 0 HA LYS A 77 -0.930 -7.724 9.731 1.00 0.00 H new ATOM 0 HB2 LYS A 77 1.551 -6.596 10.955 1.00 0.00 H new ATOM 0 HB3 LYS A 77 0.174 -5.514 10.877 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -0.236 -8.294 11.949 1.00 0.00 H new ATOM 0 HG3 LYS A 77 0.563 -7.108 12.963 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -1.589 -5.659 12.000 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -2.270 -7.270 12.114 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -1.622 -7.438 14.471 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -0.762 -5.913 14.385 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -2.936 -5.638 15.384 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -2.861 -4.788 13.916 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -3.694 -6.265 14.000 1.00 0.00 H new ATOM 1222 N LEU A 78 -1.237 -5.382 8.620 1.00 0.00 N ATOM 1223 CA LEU A 78 -1.528 -4.325 7.659 1.00 0.00 C ATOM 1224 C LEU A 78 -2.276 -3.175 8.325 1.00 0.00 C ATOM 1225 O LEU A 78 -3.309 -3.378 8.963 1.00 0.00 O ATOM 1226 CB LEU A 78 -2.354 -4.879 6.496 1.00 0.00 C ATOM 1227 CG LEU A 78 -1.567 -5.578 5.387 1.00 0.00 C ATOM 1228 CD1 LEU A 78 -2.310 -6.813 4.901 1.00 0.00 C ATOM 1229 CD2 LEU A 78 -1.307 -4.621 4.233 1.00 0.00 C ATOM 0 H LEU A 78 -1.922 -5.470 9.371 1.00 0.00 H new ATOM 0 HA LEU A 78 -0.581 -3.945 7.276 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -3.082 -5.584 6.897 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -2.917 -4.058 6.052 1.00 0.00 H new ATOM 0 HG LEU A 78 -0.607 -5.894 5.794 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -1.734 -7.297 4.112 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -2.444 -7.507 5.731 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -3.285 -6.521 4.512 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -0.746 -5.136 3.453 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -2.257 -4.274 3.827 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -0.731 -3.767 4.591 1.00 0.00 H new ATOM 1241 N TYR A 79 -1.748 -1.965 8.172 1.00 0.00 N ATOM 1242 CA TYR A 79 -2.365 -0.782 8.759 1.00 0.00 C ATOM 1243 C TYR A 79 -2.722 0.238 7.682 1.00 0.00 C ATOM 1244 O TYR A 79 -1.900 0.570 6.827 1.00 0.00 O ATOM 1245 CB TYR A 79 -1.426 -0.147 9.786 1.00 0.00 C ATOM 1246 CG TYR A 79 -0.815 -1.144 10.745 1.00 0.00 C ATOM 1247 CD1 TYR A 79 -1.587 -1.759 11.722 1.00 0.00 C ATOM 1248 CD2 TYR A 79 0.534 -1.467 10.675 1.00 0.00 C ATOM 1249 CE1 TYR A 79 -1.033 -2.670 12.601 1.00 0.00 C ATOM 1250 CE2 TYR A 79 1.096 -2.378 11.549 1.00 0.00 C ATOM 1251 CZ TYR A 79 0.309 -2.976 12.510 1.00 0.00 C ATOM 1252 OH TYR A 79 0.865 -3.883 13.384 1.00 0.00 O ATOM 0 H TYR A 79 -0.894 -1.778 7.646 1.00 0.00 H new ATOM 0 HA TYR A 79 -3.283 -1.093 9.258 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -0.627 0.376 9.261 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -1.977 0.602 10.355 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -2.638 -1.521 11.796 1.00 0.00 H new ATOM 0 HD2 TYR A 79 1.154 -0.998 9.925 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -1.647 -3.140 13.355 1.00 0.00 H new ATOM 0 HE2 TYR A 79 2.146 -2.620 11.480 1.00 0.00 H new ATOM 0 HH TYR A 79 1.819 -3.987 13.185 1.00 0.00 H new ATOM 1262 N PHE A 80 -3.955 0.731 7.729 1.00 0.00 N ATOM 1263 CA PHE A 80 -4.424 1.713 6.757 1.00 0.00 C ATOM 1264 C PHE A 80 -3.562 2.973 6.798 1.00 0.00 C ATOM 1265 O PHE A 80 -3.668 3.780 7.721 1.00 0.00 O ATOM 1266 CB PHE A 80 -5.886 2.072 7.028 1.00 0.00 C ATOM 1267 CG PHE A 80 -6.859 1.297 6.187 1.00 0.00 C ATOM 1268 CD1 PHE A 80 -6.736 1.271 4.807 1.00 0.00 C ATOM 1269 CD2 PHE A 80 -7.898 0.594 6.777 1.00 0.00 C ATOM 1270 CE1 PHE A 80 -7.629 0.557 4.031 1.00 0.00 C ATOM 1271 CE2 PHE A 80 -8.794 -0.121 6.005 1.00 0.00 C ATOM 1272 CZ PHE A 80 -8.660 -0.138 4.630 1.00 0.00 C ATOM 0 H PHE A 80 -4.648 0.467 8.430 1.00 0.00 H new ATOM 0 HA PHE A 80 -4.344 1.272 5.764 1.00 0.00 H new ATOM 0 HB2 PHE A 80 -6.106 1.895 8.081 1.00 0.00 H new ATOM 0 HB3 PHE A 80 -6.030 3.137 6.847 1.00 0.00 H new ATOM 0 HD1 PHE A 80 -5.933 1.815 4.332 1.00 0.00 H new ATOM 0 HD2 PHE A 80 -8.008 0.605 7.851 1.00 0.00 H new ATOM 0 HE1 PHE A 80 -7.520 0.543 2.957 1.00 0.00 H new ATOM 0 HE2 PHE A 80 -9.598 -0.666 6.476 1.00 0.00 H new ATOM 0 HZ PHE A 80 -9.361 -0.694 4.025 1.00 0.00 H new ATOM 1282 N ALA A 81 -2.710 3.132 5.792 1.00 0.00 N ATOM 1283 CA ALA A 81 -1.831 4.293 5.711 1.00 0.00 C ATOM 1284 C ALA A 81 -2.633 5.590 5.728 1.00 0.00 C ATOM 1285 O ALA A 81 -3.863 5.570 5.721 1.00 0.00 O ATOM 1286 CB ALA A 81 -0.971 4.218 4.458 1.00 0.00 C ATOM 0 H ALA A 81 -2.609 2.472 5.021 1.00 0.00 H new ATOM 0 HA ALA A 81 -1.180 4.287 6.585 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -0.320 5.091 4.411 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -0.363 3.313 4.487 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -1.613 4.196 3.577 1.00 0.00 H new ATOM 1292 N GLN A 82 -1.927 6.715 5.754 1.00 0.00 N ATOM 1293 CA GLN A 82 -2.575 8.022 5.774 1.00 0.00 C ATOM 1294 C GLN A 82 -1.554 9.138 5.579 1.00 0.00 C ATOM 1295 O GLN A 82 -1.661 9.938 4.648 1.00 0.00 O ATOM 1296 CB GLN A 82 -3.323 8.224 7.092 1.00 0.00 C ATOM 1297 CG GLN A 82 -4.835 8.184 6.946 1.00 0.00 C ATOM 1298 CD GLN A 82 -5.554 8.293 8.276 1.00 0.00 C ATOM 1299 OE1 GLN A 82 -4.934 8.537 9.312 1.00 0.00 O ATOM 1300 NE2 GLN A 82 -6.869 8.112 8.256 1.00 0.00 N ATOM 0 H GLN A 82 -0.908 6.749 5.762 1.00 0.00 H new ATOM 0 HA GLN A 82 -3.288 8.059 4.951 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -3.014 7.453 7.797 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -3.033 9.183 7.521 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -5.155 8.999 6.297 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -5.124 7.254 6.456 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -7.343 7.912 7.375 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -7.405 8.173 9.121 1.00 0.00 H new ATOM 1309 N THR A 83 -0.563 9.189 6.464 1.00 0.00 N ATOM 1310 CA THR A 83 0.476 10.208 6.390 1.00 0.00 C ATOM 1311 C THR A 83 1.736 9.762 7.122 1.00 0.00 C ATOM 1312 O THR A 83 2.825 9.732 6.546 1.00 0.00 O ATOM 1313 CB THR A 83 -0.005 11.545 6.987 1.00 0.00 C ATOM 1314 OG1 THR A 83 -0.564 11.328 8.287 1.00 0.00 O ATOM 1315 CG2 THR A 83 -1.041 12.197 6.085 1.00 0.00 C ATOM 0 H THR A 83 -0.459 8.536 7.241 1.00 0.00 H new ATOM 0 HA THR A 83 0.704 10.351 5.334 1.00 0.00 H new ATOM 0 HB THR A 83 0.853 12.212 7.069 1.00 0.00 H new ATOM 0 HG1 THR A 83 -0.866 12.182 8.660 1.00 0.00 H new ATOM 0 HG21 THR A 83 -1.366 13.139 6.526 1.00 0.00 H new ATOM 0 HG22 THR A 83 -0.602 12.387 5.105 1.00 0.00 H new ATOM 0 HG23 THR A 83 -1.898 11.533 5.976 1.00 0.00 H new ATOM 1323 N LEU A 84 1.584 9.415 8.396 1.00 0.00 N ATOM 1324 CA LEU A 84 2.711 8.969 9.208 1.00 0.00 C ATOM 1325 C LEU A 84 2.242 8.513 10.585 1.00 0.00 C ATOM 1326 O LEU A 84 1.313 9.083 11.158 1.00 0.00 O ATOM 1327 CB LEU A 84 3.737 10.094 9.352 1.00 0.00 C ATOM 1328 CG LEU A 84 5.144 9.790 8.838 1.00 0.00 C ATOM 1329 CD1 LEU A 84 5.897 11.079 8.545 1.00 0.00 C ATOM 1330 CD2 LEU A 84 5.908 8.941 9.844 1.00 0.00 C ATOM 0 H LEU A 84 0.691 9.434 8.889 1.00 0.00 H new ATOM 0 HA LEU A 84 3.178 8.122 8.705 1.00 0.00 H new ATOM 0 HB2 LEU A 84 3.361 10.971 8.825 1.00 0.00 H new ATOM 0 HB3 LEU A 84 3.807 10.362 10.406 1.00 0.00 H new ATOM 0 HG LEU A 84 5.056 9.226 7.909 1.00 0.00 H new ATOM 0 HD11 LEU A 84 6.896 10.842 8.180 1.00 0.00 H new ATOM 0 HD12 LEU A 84 5.360 11.650 7.787 1.00 0.00 H new ATOM 0 HD13 LEU A 84 5.975 11.670 9.457 1.00 0.00 H new ATOM 0 HD21 LEU A 84 6.907 8.734 9.461 1.00 0.00 H new ATOM 0 HD22 LEU A 84 5.985 9.478 10.789 1.00 0.00 H new ATOM 0 HD23 LEU A 84 5.379 8.001 10.003 1.00 0.00 H new ATOM 1342 N HIS A 85 2.893 7.481 11.114 1.00 0.00 N ATOM 1343 CA HIS A 85 2.544 6.949 12.427 1.00 0.00 C ATOM 1344 C HIS A 85 3.119 7.823 13.537 1.00 0.00 C ATOM 1345 O HIS A 85 4.059 8.587 13.315 1.00 0.00 O ATOM 1346 CB HIS A 85 3.058 5.516 12.572 1.00 0.00 C ATOM 1347 CG HIS A 85 2.074 4.589 13.217 1.00 0.00 C ATOM 1348 ND1 HIS A 85 0.856 4.275 12.652 1.00 0.00 N ATOM 1349 CD2 HIS A 85 2.133 3.906 14.384 1.00 0.00 C ATOM 1350 CE1 HIS A 85 0.208 3.440 13.444 1.00 0.00 C ATOM 1351 NE2 HIS A 85 0.961 3.200 14.502 1.00 0.00 N ATOM 0 H HIS A 85 3.664 6.997 10.654 1.00 0.00 H new ATOM 0 HA HIS A 85 1.458 6.948 12.515 1.00 0.00 H new ATOM 0 HB2 HIS A 85 3.316 5.130 11.586 1.00 0.00 H new ATOM 0 HB3 HIS A 85 3.975 5.526 13.161 1.00 0.00 H new ATOM 0 HD2 HIS A 85 2.950 3.915 15.091 1.00 0.00 H new ATOM 0 HE1 HIS A 85 -0.771 3.024 13.258 1.00 0.00 H new ATOM 0 HE2 HIS A 85 0.712 2.589 15.280 1.00 0.00 H new ATOM 1359 N ILE A 86 2.547 7.707 14.731 1.00 0.00 N ATOM 1360 CA ILE A 86 3.003 8.487 15.875 1.00 0.00 C ATOM 1361 C ILE A 86 3.933 7.668 16.762 1.00 0.00 C ATOM 1362 O ILE A 86 3.582 6.577 17.210 1.00 0.00 O ATOM 1363 CB ILE A 86 1.819 8.991 16.720 1.00 0.00 C ATOM 1364 CG1 ILE A 86 0.896 9.870 15.873 1.00 0.00 C ATOM 1365 CG2 ILE A 86 2.322 9.759 17.933 1.00 0.00 C ATOM 1366 CD1 ILE A 86 -0.555 9.446 15.919 1.00 0.00 C ATOM 0 H ILE A 86 1.767 7.081 14.931 1.00 0.00 H new ATOM 0 HA ILE A 86 3.546 9.344 15.477 1.00 0.00 H new ATOM 0 HB ILE A 86 1.250 8.130 17.069 1.00 0.00 H new ATOM 0 HG12 ILE A 86 0.975 10.902 16.216 1.00 0.00 H new ATOM 0 HG13 ILE A 86 1.239 9.851 14.838 1.00 0.00 H new ATOM 0 HG21 ILE A 86 1.473 10.109 18.520 1.00 0.00 H new ATOM 0 HG22 ILE A 86 2.942 9.105 18.546 1.00 0.00 H new ATOM 0 HG23 ILE A 86 2.912 10.614 17.603 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -1.149 10.114 15.296 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -0.648 8.425 15.548 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -0.915 9.492 16.947 1.00 0.00 H new ATOM 1378 N GLY A 87 5.124 8.204 17.016 1.00 0.00 N ATOM 1379 CA GLY A 87 6.087 7.510 17.851 1.00 0.00 C ATOM 1380 C GLY A 87 5.848 7.745 19.330 1.00 0.00 C ATOM 1381 O GLY A 87 4.918 8.455 19.709 1.00 0.00 O ATOM 0 H GLY A 87 5.438 9.106 16.658 1.00 0.00 H new ATOM 0 HA2 GLY A 87 6.039 6.441 17.644 1.00 0.00 H new ATOM 0 HA3 GLY A 87 7.093 7.840 17.592 1.00 0.00 H new ATOM 1385 N SER A 88 6.690 7.146 20.165 1.00 0.00 N ATOM 1386 CA SER A 88 6.563 7.289 21.611 1.00 0.00 C ATOM 1387 C SER A 88 5.219 6.752 22.094 1.00 0.00 C ATOM 1388 O SER A 88 4.257 6.678 21.330 1.00 0.00 O ATOM 1389 CB SER A 88 6.713 8.757 22.014 1.00 0.00 C ATOM 1390 OG SER A 88 6.766 8.896 23.423 1.00 0.00 O ATOM 0 H SER A 88 7.467 6.557 19.866 1.00 0.00 H new ATOM 0 HA SER A 88 7.357 6.708 22.080 1.00 0.00 H new ATOM 0 HB2 SER A 88 7.620 9.168 21.570 1.00 0.00 H new ATOM 0 HB3 SER A 88 5.876 9.333 21.620 1.00 0.00 H new ATOM 0 HG SER A 88 6.864 9.843 23.655 1.00 0.00 H new ATOM 1396 N SER A 89 5.162 6.378 23.369 1.00 0.00 N ATOM 1397 CA SER A 89 3.939 5.843 23.954 1.00 0.00 C ATOM 1398 C SER A 89 3.128 6.949 24.623 1.00 0.00 C ATOM 1399 O SER A 89 1.936 7.109 24.358 1.00 0.00 O ATOM 1400 CB SER A 89 4.270 4.751 24.972 1.00 0.00 C ATOM 1401 OG SER A 89 4.898 3.645 24.348 1.00 0.00 O ATOM 0 H SER A 89 5.949 6.436 24.016 1.00 0.00 H new ATOM 0 HA SER A 89 3.341 5.412 23.152 1.00 0.00 H new ATOM 0 HB2 SER A 89 4.924 5.156 25.745 1.00 0.00 H new ATOM 0 HB3 SER A 89 3.356 4.422 25.467 1.00 0.00 H new ATOM 0 HG SER A 89 5.101 2.962 25.021 1.00 0.00 H new ATOM 1407 N HIS A 90 3.784 7.711 25.493 1.00 0.00 N ATOM 1408 CA HIS A 90 3.126 8.804 26.200 1.00 0.00 C ATOM 1409 C HIS A 90 1.971 8.282 27.050 1.00 0.00 C ATOM 1410 O HIS A 90 0.882 8.016 26.540 1.00 0.00 O ATOM 1411 CB HIS A 90 2.614 9.847 25.209 1.00 0.00 C ATOM 1412 CG HIS A 90 1.799 10.930 25.845 1.00 0.00 C ATOM 1413 ND1 HIS A 90 0.565 10.899 26.401 1.00 0.00 N flip ATOM 1414 CD2 HIS A 90 2.237 12.232 25.961 1.00 0.00 C flip ATOM 1415 CE1 HIS A 90 0.283 12.170 26.839 1.00 0.00 C flip ATOM 1416 NE2 HIS A 90 1.309 12.955 26.562 1.00 0.00 N flip ATOM 0 H HIS A 90 4.770 7.592 25.725 1.00 0.00 H new ATOM 0 HA HIS A 90 3.858 9.271 26.859 1.00 0.00 H new ATOM 0 HB2 HIS A 90 3.464 10.297 24.697 1.00 0.00 H new ATOM 0 HB3 HIS A 90 2.011 9.349 24.449 1.00 0.00 H new ATOM 0 HD1 HIS A 90 -0.042 10.083 26.480 1.00 0.00 H new ATOM 0 HD2 HIS A 90 3.190 12.603 25.615 1.00 0.00 H new ATOM 0 HE1 HIS A 90 -0.629 12.477 27.330 1.00 0.00 H new ATOM 1424 N LEU A 91 2.216 8.139 28.349 1.00 0.00 N ATOM 1425 CA LEU A 91 1.196 7.649 29.270 1.00 0.00 C ATOM 1426 C LEU A 91 1.572 7.962 30.715 1.00 0.00 C ATOM 1427 O LEU A 91 0.719 8.330 31.522 1.00 0.00 O ATOM 1428 CB LEU A 91 1.006 6.141 29.096 1.00 0.00 C ATOM 1429 CG LEU A 91 2.233 5.274 29.375 1.00 0.00 C ATOM 1430 CD1 LEU A 91 1.816 3.845 29.689 1.00 0.00 C ATOM 1431 CD2 LEU A 91 3.188 5.303 28.190 1.00 0.00 C ATOM 0 H LEU A 91 3.111 8.355 28.787 1.00 0.00 H new ATOM 0 HA LEU A 91 0.259 8.156 29.039 1.00 0.00 H new ATOM 0 HB2 LEU A 91 0.200 5.818 29.755 1.00 0.00 H new ATOM 0 HB3 LEU A 91 0.677 5.952 28.074 1.00 0.00 H new ATOM 0 HG LEU A 91 2.751 5.680 30.244 1.00 0.00 H new ATOM 0 HD11 LEU A 91 2.703 3.242 29.885 1.00 0.00 H new ATOM 0 HD12 LEU A 91 1.171 3.839 30.568 1.00 0.00 H new ATOM 0 HD13 LEU A 91 1.275 3.429 28.839 1.00 0.00 H new ATOM 0 HD21 LEU A 91 4.056 4.680 28.407 1.00 0.00 H new ATOM 0 HD22 LEU A 91 2.680 4.922 27.304 1.00 0.00 H new ATOM 0 HD23 LEU A 91 3.513 6.328 28.010 1.00 0.00 H new ATOM 1443 N ALA A 92 2.854 7.816 31.033 1.00 0.00 N ATOM 1444 CA ALA A 92 3.344 8.087 32.378 1.00 0.00 C ATOM 1445 C ALA A 92 2.813 7.060 33.373 1.00 0.00 C ATOM 1446 O ALA A 92 1.849 7.305 34.100 1.00 0.00 O ATOM 1447 CB ALA A 92 2.953 9.493 32.809 1.00 0.00 C ATOM 0 H ALA A 92 3.572 7.511 30.376 1.00 0.00 H new ATOM 0 HA ALA A 92 4.431 8.012 32.364 1.00 0.00 H new ATOM 0 HB1 ALA A 92 3.326 9.682 33.816 1.00 0.00 H new ATOM 0 HB2 ALA A 92 3.386 10.218 32.120 1.00 0.00 H new ATOM 0 HB3 ALA A 92 1.867 9.587 32.800 1.00 0.00 H new ATOM 1453 N PRO A 93 3.453 5.882 33.408 1.00 0.00 N ATOM 1454 CA PRO A 93 3.061 4.794 34.308 1.00 0.00 C ATOM 1455 C PRO A 93 3.366 5.114 35.768 1.00 0.00 C ATOM 1456 O PRO A 93 4.092 6.056 36.085 1.00 0.00 O ATOM 1457 CB PRO A 93 3.911 3.615 33.831 1.00 0.00 C ATOM 1458 CG PRO A 93 5.099 4.240 33.185 1.00 0.00 C ATOM 1459 CD PRO A 93 4.608 5.521 32.569 1.00 0.00 C ATOM 0 HA PRO A 93 1.988 4.604 34.275 1.00 0.00 H new ATOM 0 HB2 PRO A 93 4.204 2.976 34.664 1.00 0.00 H new ATOM 0 HB3 PRO A 93 3.361 2.990 33.128 1.00 0.00 H new ATOM 0 HG2 PRO A 93 5.884 4.434 33.916 1.00 0.00 H new ATOM 0 HG3 PRO A 93 5.524 3.581 32.428 1.00 0.00 H new ATOM 0 HD2 PRO A 93 5.375 6.295 32.587 1.00 0.00 H new ATOM 0 HD3 PRO A 93 4.320 5.381 31.527 1.00 0.00 H new ATOM 1467 N PRO A 94 2.799 4.311 36.680 1.00 0.00 N ATOM 1468 CA PRO A 94 2.996 4.487 38.123 1.00 0.00 C ATOM 1469 C PRO A 94 4.417 4.145 38.559 1.00 0.00 C ATOM 1470 O PRO A 94 4.725 2.991 38.854 1.00 0.00 O ATOM 1471 CB PRO A 94 1.997 3.507 38.741 1.00 0.00 C ATOM 1472 CG PRO A 94 1.797 2.462 37.698 1.00 0.00 C ATOM 1473 CD PRO A 94 1.923 3.167 36.375 1.00 0.00 C ATOM 0 HA PRO A 94 2.844 5.521 38.432 1.00 0.00 H new ATOM 0 HB2 PRO A 94 2.385 3.076 39.664 1.00 0.00 H new ATOM 0 HB3 PRO A 94 1.059 4.003 38.990 1.00 0.00 H new ATOM 0 HG2 PRO A 94 2.541 1.671 37.791 1.00 0.00 H new ATOM 0 HG3 PRO A 94 0.818 1.993 37.798 1.00 0.00 H new ATOM 0 HD2 PRO A 94 2.358 2.519 35.614 1.00 0.00 H new ATOM 0 HD3 PRO A 94 0.953 3.493 35.999 1.00 0.00 H new ATOM 1481 N ASN A 95 5.279 5.156 38.600 1.00 0.00 N ATOM 1482 CA ASN A 95 6.667 4.961 39.001 1.00 0.00 C ATOM 1483 C ASN A 95 6.751 4.402 40.418 1.00 0.00 C ATOM 1484 O ASN A 95 5.970 4.759 41.300 1.00 0.00 O ATOM 1485 CB ASN A 95 7.434 6.283 38.917 1.00 0.00 C ATOM 1486 CG ASN A 95 6.621 7.457 39.425 1.00 0.00 C ATOM 1487 OD1 ASN A 95 5.932 8.128 38.657 1.00 0.00 O ATOM 1488 ND2 ASN A 95 6.699 7.712 40.726 1.00 0.00 N ATOM 0 H ASN A 95 5.040 6.118 38.360 1.00 0.00 H new ATOM 0 HA ASN A 95 7.119 4.241 38.318 1.00 0.00 H new ATOM 0 HB2 ASN A 95 8.354 6.204 39.497 1.00 0.00 H new ATOM 0 HB3 ASN A 95 7.724 6.466 37.882 1.00 0.00 H new ATOM 0 HD21 ASN A 95 6.175 8.491 41.125 1.00 0.00 H new ATOM 0 HD22 ASN A 95 7.283 7.129 41.326 1.00 0.00 H new ATOM 1495 N PRO A 96 7.722 3.504 40.643 1.00 0.00 N ATOM 1496 CA PRO A 96 7.932 2.877 41.951 1.00 0.00 C ATOM 1497 C PRO A 96 8.466 3.859 42.986 1.00 0.00 C ATOM 1498 O PRO A 96 8.924 4.950 42.643 1.00 0.00 O ATOM 1499 CB PRO A 96 8.968 1.789 41.660 1.00 0.00 C ATOM 1500 CG PRO A 96 9.697 2.273 40.455 1.00 0.00 C ATOM 1501 CD PRO A 96 8.689 3.032 39.638 1.00 0.00 C ATOM 0 HA PRO A 96 7.002 2.497 42.375 1.00 0.00 H new ATOM 0 HB2 PRO A 96 9.645 1.651 42.503 1.00 0.00 H new ATOM 0 HB3 PRO A 96 8.490 0.827 41.474 1.00 0.00 H new ATOM 0 HG2 PRO A 96 10.533 2.913 40.736 1.00 0.00 H new ATOM 0 HG3 PRO A 96 10.110 1.439 39.888 1.00 0.00 H new ATOM 0 HD2 PRO A 96 9.149 3.862 39.102 1.00 0.00 H new ATOM 0 HD3 PRO A 96 8.214 2.395 38.892 1.00 0.00 H new ATOM 1509 N ASP A 97 8.406 3.468 44.254 1.00 0.00 N ATOM 1510 CA ASP A 97 8.886 4.315 45.340 1.00 0.00 C ATOM 1511 C ASP A 97 8.100 5.621 45.398 1.00 0.00 C ATOM 1512 O ASP A 97 7.812 6.231 44.368 1.00 0.00 O ATOM 1513 CB ASP A 97 10.377 4.608 45.165 1.00 0.00 C ATOM 1514 CG ASP A 97 11.152 4.460 46.460 1.00 0.00 C ATOM 1515 OD1 ASP A 97 11.130 3.354 47.041 1.00 0.00 O ATOM 1516 OD2 ASP A 97 11.781 5.447 46.890 1.00 0.00 O ATOM 0 H ASP A 97 8.029 2.569 44.556 1.00 0.00 H new ATOM 0 HA ASP A 97 8.737 3.781 46.279 1.00 0.00 H new ATOM 0 HB2 ASP A 97 10.792 3.932 44.417 1.00 0.00 H new ATOM 0 HB3 ASP A 97 10.503 5.621 44.783 1.00 0.00 H new ATOM 1521 N LYS A 98 7.757 6.046 46.610 1.00 0.00 N ATOM 1522 CA LYS A 98 7.005 7.280 46.803 1.00 0.00 C ATOM 1523 C LYS A 98 7.348 7.920 48.145 1.00 0.00 C ATOM 1524 O LYS A 98 8.063 7.335 48.958 1.00 0.00 O ATOM 1525 CB LYS A 98 5.502 7.002 46.727 1.00 0.00 C ATOM 1526 CG LYS A 98 4.828 7.635 45.522 1.00 0.00 C ATOM 1527 CD LYS A 98 3.360 7.252 45.440 1.00 0.00 C ATOM 1528 CE LYS A 98 2.457 8.439 45.734 1.00 0.00 C ATOM 1529 NZ LYS A 98 1.284 8.051 46.567 1.00 0.00 N ATOM 0 H LYS A 98 7.988 5.554 47.473 1.00 0.00 H new ATOM 0 HA LYS A 98 7.280 7.973 46.008 1.00 0.00 H new ATOM 0 HB2 LYS A 98 5.341 5.924 46.699 1.00 0.00 H new ATOM 0 HB3 LYS A 98 5.026 7.372 47.635 1.00 0.00 H new ATOM 0 HG2 LYS A 98 4.919 8.720 45.581 1.00 0.00 H new ATOM 0 HG3 LYS A 98 5.338 7.321 44.612 1.00 0.00 H new ATOM 0 HD2 LYS A 98 3.139 6.863 44.446 1.00 0.00 H new ATOM 0 HD3 LYS A 98 3.152 6.451 46.149 1.00 0.00 H new ATOM 0 HE2 LYS A 98 3.028 9.211 46.249 1.00 0.00 H new ATOM 0 HE3 LYS A 98 2.109 8.872 44.796 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 0.693 8.888 46.745 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 0.724 7.332 46.065 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 1.615 7.662 47.473 1.00 0.00 H new ATOM 1543 N SER A 99 6.830 9.124 48.370 1.00 0.00 N ATOM 1544 CA SER A 99 7.083 9.843 49.613 1.00 0.00 C ATOM 1545 C SER A 99 6.555 9.061 50.811 1.00 0.00 C ATOM 1546 O SER A 99 7.254 8.885 51.809 1.00 0.00 O ATOM 1547 CB SER A 99 6.433 11.227 49.566 1.00 0.00 C ATOM 1548 OG SER A 99 7.414 12.250 49.505 1.00 0.00 O ATOM 0 H SER A 99 6.234 9.621 47.709 1.00 0.00 H new ATOM 0 HA SER A 99 8.161 9.958 49.724 1.00 0.00 H new ATOM 0 HB2 SER A 99 5.778 11.295 48.698 1.00 0.00 H new ATOM 0 HB3 SER A 99 5.809 11.369 50.448 1.00 0.00 H new ATOM 0 HG SER A 99 6.973 13.125 49.474 1.00 0.00 H new ATOM 1554 N GLY A 100 5.314 8.596 50.706 1.00 0.00 N ATOM 1555 CA GLY A 100 4.711 7.837 51.787 1.00 0.00 C ATOM 1556 C GLY A 100 4.564 8.655 53.055 1.00 0.00 C ATOM 1557 O GLY A 100 5.396 8.593 53.959 1.00 0.00 O ATOM 0 H GLY A 100 4.715 8.731 49.892 1.00 0.00 H new ATOM 0 HA2 GLY A 100 3.731 7.479 51.473 1.00 0.00 H new ATOM 0 HA3 GLY A 100 5.320 6.957 51.994 1.00 0.00 H new ATOM 1561 N PRO A 101 3.481 9.443 53.133 1.00 0.00 N ATOM 1562 CA PRO A 101 3.202 10.292 54.294 1.00 0.00 C ATOM 1563 C PRO A 101 2.819 9.481 55.527 1.00 0.00 C ATOM 1564 O PRO A 101 1.703 8.972 55.625 1.00 0.00 O ATOM 1565 CB PRO A 101 2.021 11.150 53.831 1.00 0.00 C ATOM 1566 CG PRO A 101 1.352 10.337 52.779 1.00 0.00 C ATOM 1567 CD PRO A 101 2.447 9.566 52.093 1.00 0.00 C ATOM 0 HA PRO A 101 4.076 10.871 54.594 1.00 0.00 H new ATOM 0 HB2 PRO A 101 1.342 11.367 54.656 1.00 0.00 H new ATOM 0 HB3 PRO A 101 2.359 12.108 53.436 1.00 0.00 H new ATOM 0 HG2 PRO A 101 0.615 9.663 53.216 1.00 0.00 H new ATOM 0 HG3 PRO A 101 0.821 10.974 52.072 1.00 0.00 H new ATOM 0 HD2 PRO A 101 2.100 8.590 51.754 1.00 0.00 H new ATOM 0 HD3 PRO A 101 2.821 10.093 51.215 1.00 0.00 H new ATOM 1575 N SER A 102 3.753 9.364 56.467 1.00 0.00 N ATOM 1576 CA SER A 102 3.514 8.611 57.692 1.00 0.00 C ATOM 1577 C SER A 102 4.105 9.334 58.899 1.00 0.00 C ATOM 1578 O SER A 102 4.615 10.449 58.779 1.00 0.00 O ATOM 1579 CB SER A 102 4.114 7.209 57.579 1.00 0.00 C ATOM 1580 OG SER A 102 3.424 6.290 58.409 1.00 0.00 O ATOM 0 H SER A 102 4.682 9.781 56.403 1.00 0.00 H new ATOM 0 HA SER A 102 2.436 8.527 57.833 1.00 0.00 H new ATOM 0 HB2 SER A 102 4.069 6.873 56.543 1.00 0.00 H new ATOM 0 HB3 SER A 102 5.167 7.237 57.859 1.00 0.00 H new ATOM 0 HG SER A 102 3.826 5.401 58.317 1.00 0.00 H new ATOM 1586 N SER A 103 4.034 8.691 60.060 1.00 0.00 N ATOM 1587 CA SER A 103 4.559 9.273 61.289 1.00 0.00 C ATOM 1588 C SER A 103 4.310 8.349 62.477 1.00 0.00 C ATOM 1589 O SER A 103 3.395 7.528 62.458 1.00 0.00 O ATOM 1590 CB SER A 103 3.917 10.638 61.547 1.00 0.00 C ATOM 1591 OG SER A 103 4.900 11.619 61.827 1.00 0.00 O ATOM 0 H SER A 103 3.618 7.767 60.175 1.00 0.00 H new ATOM 0 HA SER A 103 5.635 9.402 61.170 1.00 0.00 H new ATOM 0 HB2 SER A 103 3.335 10.940 60.676 1.00 0.00 H new ATOM 0 HB3 SER A 103 3.223 10.565 62.384 1.00 0.00 H new ATOM 0 HG SER A 103 4.464 12.482 61.986 1.00 0.00 H new ATOM 1597 N GLY A 104 5.133 8.490 63.512 1.00 0.00 N ATOM 1598 CA GLY A 104 4.988 7.663 64.695 1.00 0.00 C ATOM 1599 C GLY A 104 6.056 6.591 64.787 1.00 0.00 C ATOM 1600 O GLY A 104 7.217 6.833 64.459 1.00 0.00 O ATOM 0 H GLY A 104 5.898 9.163 63.552 1.00 0.00 H new ATOM 0 HA2 GLY A 104 5.033 8.293 65.583 1.00 0.00 H new ATOM 0 HA3 GLY A 104 4.005 7.192 64.687 1.00 0.00 H new TER 1604 GLY A 104