USER MOD reduce.3.24.130724 H: found=0, std=0, add=494, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 495 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: C 118 LYS NZ :NH3+ 155:sc= 0.923 (180deg=-1.8!) USER MOD Set 1.2: C 122 GLN : amide:sc= 1.4 K(o=2.9,f=-11!) USER MOD Set 1.3: C 127 THR OG1 : rot 180:sc= 0.574 USER MOD Set 2.1: C 98 SER OG : rot -20:sc= 1.65 USER MOD Set 2.2: C 150 TYR OH : rot 180:sc= -0.0748! USER MOD Single : C 103 MET CE :methyl -124:sc=-0.00352 (180deg=-0.16) USER MOD Single : C 106 LYS NZ :NH3+ -105:sc= 0.964 (180deg=-5.83!) USER MOD Single : C 107 ASN : amide:sc=-0.00147 X(o=-0.0015,f=0) USER MOD Single : C 111 TYR OH : rot 180:sc= 0 USER MOD Single : C 120 MET CE :methyl 157:sc= -0.112 (180deg=-0.827) USER MOD Single : C 124 THR OG1 : rot -72:sc= 1.14 USER MOD Single : C 129 THR OG1 : rot 123:sc= 1.37 USER MOD Single : C 137 MET CE :methyl 146:sc= -0.643 (180deg=-1.47) USER MOD Single : C 138 LYS NZ :NH3+ 160:sc= 2.11 (180deg=1.03) USER MOD Single : C 142 LYS NZ :NH3+ 136:sc= 1.29 (180deg=-2.5!) USER MOD Single : C 143 ASN : amide:sc= -0.136 X(o=-0.14,f=-0.097) USER MOD Single : C 144 ASN : amide:sc= 1.08 K(o=1.1,f=-0.11) USER MOD Single : C 157 MET CE :methyl -171:sc= -4.62! (180deg=-5.2!) USER MOD Single : C 158 LYS NZ :NH3+ 162:sc= 1.22 (180deg=1.11) USER MOD ----------------------------------------------------------------- ATOM 60 N GLU C 94 8.763 -4.950 -8.970 1.00 0.00 N ATOM 61 CA GLU C 94 8.705 -4.452 -10.385 1.00 0.00 C ATOM 62 C GLU C 94 8.275 -2.975 -10.438 1.00 0.00 C ATOM 63 O GLU C 94 8.744 -2.235 -11.283 1.00 0.00 O ATOM 64 CB GLU C 94 7.721 -5.369 -11.151 1.00 0.00 C ATOM 65 CG GLU C 94 8.384 -6.758 -11.452 1.00 0.00 C ATOM 66 CD GLU C 94 8.426 -7.676 -10.234 1.00 0.00 C ATOM 67 OE1 GLU C 94 7.623 -7.523 -9.349 1.00 0.00 O ATOM 68 OE2 GLU C 94 9.269 -8.537 -10.211 1.00 0.00 O1- ATOM 0 HA GLU C 94 9.690 -4.492 -10.850 1.00 0.00 H new ATOM 0 HB2 GLU C 94 6.815 -5.512 -10.562 1.00 0.00 H new ATOM 0 HB3 GLU C 94 7.422 -4.892 -12.085 1.00 0.00 H new ATOM 0 HG2 GLU C 94 7.833 -7.251 -12.253 1.00 0.00 H new ATOM 0 HG3 GLU C 94 9.399 -6.599 -11.815 1.00 0.00 H new ATOM 75 N GLU C 95 7.449 -2.514 -9.517 1.00 0.00 N ATOM 76 CA GLU C 95 7.072 -1.045 -9.533 1.00 0.00 C ATOM 77 C GLU C 95 8.374 -0.215 -9.422 1.00 0.00 C ATOM 78 O GLU C 95 8.571 0.749 -10.148 1.00 0.00 O ATOM 79 CB GLU C 95 6.242 -0.817 -8.247 1.00 0.00 C ATOM 80 CG GLU C 95 4.945 -1.670 -8.232 1.00 0.00 C ATOM 81 CD GLU C 95 3.929 -1.230 -9.295 1.00 0.00 C ATOM 82 OE1 GLU C 95 4.128 -0.210 -9.938 1.00 0.00 O ATOM 83 OE2 GLU C 95 2.935 -1.917 -9.418 1.00 0.00 O1- ATOM 0 H GLU C 95 7.027 -3.070 -8.773 1.00 0.00 H new ATOM 0 HA GLU C 95 6.526 -0.764 -10.434 1.00 0.00 H new ATOM 0 HB2 GLU C 95 6.848 -1.064 -7.376 1.00 0.00 H new ATOM 0 HB3 GLU C 95 5.983 0.239 -8.166 1.00 0.00 H new ATOM 0 HG2 GLU C 95 5.203 -2.717 -8.394 1.00 0.00 H new ATOM 0 HG3 GLU C 95 4.484 -1.604 -7.247 1.00 0.00 H new ATOM 90 N GLU C 96 9.308 -0.649 -8.572 1.00 0.00 N ATOM 91 CA GLU C 96 10.627 0.058 -8.472 1.00 0.00 C ATOM 92 C GLU C 96 11.416 -0.121 -9.780 1.00 0.00 C ATOM 93 O GLU C 96 12.075 0.793 -10.240 1.00 0.00 O ATOM 94 CB GLU C 96 11.383 -0.592 -7.305 1.00 0.00 C ATOM 95 CG GLU C 96 10.675 -0.305 -5.972 1.00 0.00 C ATOM 96 CD GLU C 96 11.545 -0.812 -4.856 1.00 0.00 C ATOM 97 OE1 GLU C 96 12.376 -0.057 -4.402 1.00 0.00 O ATOM 98 OE2 GLU C 96 11.412 -1.944 -4.491 1.00 0.00 O1- ATOM 0 H GLU C 96 9.202 -1.455 -7.956 1.00 0.00 H new ATOM 0 HA GLU C 96 10.494 1.127 -8.306 1.00 0.00 H new ATOM 0 HB2 GLU C 96 11.449 -1.668 -7.463 1.00 0.00 H new ATOM 0 HB3 GLU C 96 12.404 -0.212 -7.270 1.00 0.00 H new ATOM 0 HG2 GLU C 96 10.498 0.765 -5.859 1.00 0.00 H new ATOM 0 HG3 GLU C 96 9.701 -0.794 -5.946 1.00 0.00 H new ATOM 105 N LEU C 97 11.332 -1.284 -10.396 1.00 0.00 N ATOM 106 CA LEU C 97 12.058 -1.502 -11.705 1.00 0.00 C ATOM 107 C LEU C 97 11.528 -0.493 -12.732 1.00 0.00 C ATOM 108 O LEU C 97 12.294 0.091 -13.501 1.00 0.00 O ATOM 109 CB LEU C 97 11.723 -2.952 -12.149 1.00 0.00 C ATOM 110 CG LEU C 97 12.092 -3.979 -11.042 1.00 0.00 C ATOM 111 CD1 LEU C 97 11.951 -5.401 -11.578 1.00 0.00 C ATOM 112 CD2 LEU C 97 13.528 -3.769 -10.543 1.00 0.00 C ATOM 0 H LEU C 97 10.800 -2.085 -10.057 1.00 0.00 H new ATOM 0 HA LEU C 97 13.135 -1.366 -11.612 1.00 0.00 H new ATOM 0 HB2 LEU C 97 10.660 -3.028 -12.380 1.00 0.00 H new ATOM 0 HB3 LEU C 97 12.265 -3.189 -13.064 1.00 0.00 H new ATOM 0 HG LEU C 97 11.407 -3.827 -10.208 1.00 0.00 H new ATOM 0 HD11 LEU C 97 12.212 -6.113 -10.795 1.00 0.00 H new ATOM 0 HD12 LEU C 97 10.922 -5.570 -11.894 1.00 0.00 H new ATOM 0 HD13 LEU C 97 12.619 -5.537 -12.429 1.00 0.00 H new ATOM 0 HD21 LEU C 97 13.755 -4.503 -9.770 1.00 0.00 H new ATOM 0 HD22 LEU C 97 14.223 -3.890 -11.374 1.00 0.00 H new ATOM 0 HD23 LEU C 97 13.627 -2.765 -10.131 1.00 0.00 H new ATOM 124 N SER C 98 10.234 -0.231 -12.710 1.00 0.00 N ATOM 125 CA SER C 98 9.652 0.804 -13.632 1.00 0.00 C ATOM 126 C SER C 98 10.300 2.176 -13.337 1.00 0.00 C ATOM 127 O SER C 98 10.656 2.924 -14.252 1.00 0.00 O ATOM 128 CB SER C 98 8.153 0.831 -13.291 1.00 0.00 C ATOM 129 OG SER C 98 7.627 -0.512 -13.336 1.00 0.00 O ATOM 0 H SER C 98 9.561 -0.688 -12.095 1.00 0.00 H new ATOM 0 HA SER C 98 9.825 0.582 -14.685 1.00 0.00 H new ATOM 0 HB2 SER C 98 8.002 1.260 -12.300 1.00 0.00 H new ATOM 0 HB3 SER C 98 7.619 1.466 -13.998 1.00 0.00 H new ATOM 0 HG SER C 98 8.227 -1.081 -13.863 1.00 0.00 H new ATOM 135 N ASP C 99 10.507 2.500 -12.069 1.00 0.00 N ATOM 136 CA ASP C 99 11.180 3.797 -11.723 1.00 0.00 C ATOM 137 C ASP C 99 12.608 3.813 -12.264 1.00 0.00 C ATOM 138 O ASP C 99 13.042 4.797 -12.866 1.00 0.00 O ATOM 139 CB ASP C 99 11.170 3.888 -10.186 1.00 0.00 C ATOM 140 CG ASP C 99 11.658 5.260 -9.746 1.00 0.00 C ATOM 141 OD1 ASP C 99 10.908 6.218 -9.886 1.00 0.00 O ATOM 142 OD2 ASP C 99 12.749 5.330 -9.235 1.00 0.00 O1- ATOM 0 H ASP C 99 10.239 1.924 -11.271 1.00 0.00 H new ATOM 0 HA ASP C 99 10.665 4.649 -12.167 1.00 0.00 H new ATOM 0 HB2 ASP C 99 10.162 3.713 -9.809 1.00 0.00 H new ATOM 0 HB3 ASP C 99 11.808 3.112 -9.763 1.00 0.00 H new ATOM 147 N LEU C 100 13.326 2.716 -12.106 1.00 0.00 N ATOM 148 CA LEU C 100 14.736 2.637 -12.640 1.00 0.00 C ATOM 149 C LEU C 100 14.758 2.734 -14.181 1.00 0.00 C ATOM 150 O LEU C 100 15.656 3.340 -14.752 1.00 0.00 O ATOM 151 CB LEU C 100 15.300 1.280 -12.170 1.00 0.00 C ATOM 152 CG LEU C 100 15.322 1.214 -10.622 1.00 0.00 C ATOM 153 CD1 LEU C 100 15.936 -0.109 -10.171 1.00 0.00 C ATOM 154 CD2 LEU C 100 16.162 2.368 -10.056 1.00 0.00 C ATOM 0 H LEU C 100 12.998 1.874 -11.632 1.00 0.00 H new ATOM 0 HA LEU C 100 15.338 3.467 -12.271 1.00 0.00 H new ATOM 0 HB2 LEU C 100 14.691 0.468 -12.567 1.00 0.00 H new ATOM 0 HB3 LEU C 100 16.308 1.142 -12.561 1.00 0.00 H new ATOM 0 HG LEU C 100 14.299 1.293 -10.255 1.00 0.00 H new ATOM 0 HD11 LEU C 100 15.950 -0.151 -9.082 1.00 0.00 H new ATOM 0 HD12 LEU C 100 15.342 -0.937 -10.559 1.00 0.00 H new ATOM 0 HD13 LEU C 100 16.955 -0.185 -10.550 1.00 0.00 H new ATOM 0 HD21 LEU C 100 16.171 2.312 -8.967 1.00 0.00 H new ATOM 0 HD22 LEU C 100 17.183 2.293 -10.431 1.00 0.00 H new ATOM 0 HD23 LEU C 100 15.730 3.319 -10.367 1.00 0.00 H new ATOM 166 N PHE C 101 13.792 2.138 -14.861 1.00 0.00 N ATOM 167 CA PHE C 101 13.775 2.183 -16.383 1.00 0.00 C ATOM 168 C PHE C 101 13.772 3.634 -16.866 1.00 0.00 C ATOM 169 O PHE C 101 14.551 4.011 -17.731 1.00 0.00 O ATOM 170 CB PHE C 101 12.455 1.488 -16.778 1.00 0.00 C ATOM 171 CG PHE C 101 12.346 1.384 -18.290 1.00 0.00 C ATOM 172 CD1 PHE C 101 13.052 0.392 -18.977 1.00 0.00 C ATOM 173 CD2 PHE C 101 11.518 2.263 -18.998 1.00 0.00 C ATOM 174 CE1 PHE C 101 12.943 0.284 -20.362 1.00 0.00 C ATOM 175 CE2 PHE C 101 11.415 2.154 -20.386 1.00 0.00 C ATOM 176 CZ PHE C 101 12.122 1.159 -21.064 1.00 0.00 C ATOM 0 H PHE C 101 13.019 1.625 -14.437 1.00 0.00 H new ATOM 0 HA PHE C 101 14.647 1.700 -16.824 1.00 0.00 H new ATOM 0 HB2 PHE C 101 12.413 0.493 -16.334 1.00 0.00 H new ATOM 0 HB3 PHE C 101 11.608 2.049 -16.383 1.00 0.00 H new ATOM 0 HD1 PHE C 101 13.684 -0.293 -18.432 1.00 0.00 H new ATOM 0 HD2 PHE C 101 10.960 3.024 -18.472 1.00 0.00 H new ATOM 0 HE1 PHE C 101 13.496 -0.479 -20.890 1.00 0.00 H new ATOM 0 HE2 PHE C 101 10.788 2.840 -20.936 1.00 0.00 H new ATOM 0 HZ PHE C 101 12.031 1.069 -22.136 1.00 0.00 H new ATOM 186 N ARG C 102 12.939 4.462 -16.277 1.00 0.00 N ATOM 187 CA ARG C 102 12.910 5.918 -16.662 1.00 0.00 C ATOM 188 C ARG C 102 14.299 6.564 -16.479 1.00 0.00 C ATOM 189 O ARG C 102 14.698 7.373 -17.275 1.00 0.00 O ATOM 190 CB ARG C 102 11.883 6.555 -15.740 1.00 0.00 C ATOM 191 CG ARG C 102 10.463 6.153 -16.180 1.00 0.00 C ATOM 192 CD ARG C 102 9.441 6.689 -15.168 1.00 0.00 C ATOM 193 NE ARG C 102 9.746 5.906 -13.933 1.00 0.00 N ATOM 194 CZ ARG C 102 9.939 6.486 -12.777 1.00 0.00 C ATOM 195 NH1 ARG C 102 11.129 6.956 -12.466 1.00 0.00 N ATOM 196 NH2 ARG C 102 8.945 6.570 -11.930 1.00 0.00 N1+ ATOM 0 H ARG C 102 12.278 4.196 -15.547 1.00 0.00 H new ATOM 0 HA ARG C 102 12.649 6.056 -17.711 1.00 0.00 H new ATOM 0 HB2 ARG C 102 12.058 6.238 -14.712 1.00 0.00 H new ATOM 0 HB3 ARG C 102 11.986 7.640 -15.761 1.00 0.00 H new ATOM 0 HG2 ARG C 102 10.252 6.552 -17.172 1.00 0.00 H new ATOM 0 HG3 ARG C 102 10.386 5.068 -16.250 1.00 0.00 H new ATOM 0 HD2 ARG C 102 9.558 7.760 -15.005 1.00 0.00 H new ATOM 0 HD3 ARG C 102 8.417 6.528 -15.505 1.00 0.00 H new ATOM 0 HE ARG C 102 9.805 4.890 -13.993 1.00 0.00 H new ATOM 0 HH11 ARG C 102 11.901 6.868 -13.127 1.00 0.00 H new ATOM 0 HH12 ARG C 102 11.279 7.408 -11.564 1.00 0.00 H new ATOM 0 HH21 ARG C 102 8.033 6.185 -12.175 1.00 0.00 H new ATOM 0 HH22 ARG C 102 9.083 7.020 -11.025 1.00 0.00 H new ATOM 210 N MET C 103 15.055 6.192 -15.456 1.00 0.00 N ATOM 211 CA MET C 103 16.449 6.789 -15.316 1.00 0.00 C ATOM 212 C MET C 103 17.295 6.360 -16.537 1.00 0.00 C ATOM 213 O MET C 103 18.043 7.154 -17.111 1.00 0.00 O ATOM 214 CB MET C 103 17.042 6.184 -14.024 1.00 0.00 C ATOM 215 CG MET C 103 16.226 6.642 -12.801 1.00 0.00 C ATOM 216 SD MET C 103 17.034 6.059 -11.293 1.00 0.00 S ATOM 217 CE MET C 103 15.682 6.437 -10.152 1.00 0.00 C ATOM 0 H MET C 103 14.784 5.525 -14.733 1.00 0.00 H new ATOM 0 HA MET C 103 16.433 7.878 -15.269 1.00 0.00 H new ATOM 0 HB2 MET C 103 17.037 5.096 -14.087 1.00 0.00 H new ATOM 0 HB3 MET C 103 18.082 6.492 -13.913 1.00 0.00 H new ATOM 0 HG2 MET C 103 16.147 7.729 -12.788 1.00 0.00 H new ATOM 0 HG3 MET C 103 15.211 6.249 -12.859 1.00 0.00 H new ATOM 0 HE1 MET C 103 16.047 7.089 -9.358 1.00 0.00 H new ATOM 0 HE2 MET C 103 14.879 6.938 -10.693 1.00 0.00 H new ATOM 0 HE3 MET C 103 15.304 5.512 -9.717 1.00 0.00 H new ATOM 227 N PHE C 104 17.139 5.125 -16.966 1.00 0.00 N ATOM 228 CA PHE C 104 17.863 4.647 -18.182 1.00 0.00 C ATOM 229 C PHE C 104 17.316 5.313 -19.444 1.00 0.00 C ATOM 230 O PHE C 104 18.094 5.692 -20.331 1.00 0.00 O ATOM 231 CB PHE C 104 17.679 3.126 -18.241 1.00 0.00 C ATOM 232 CG PHE C 104 18.720 2.464 -17.368 1.00 0.00 C ATOM 233 CD1 PHE C 104 18.518 2.337 -15.990 1.00 0.00 C ATOM 234 CD2 PHE C 104 19.902 1.977 -17.946 1.00 0.00 C ATOM 235 CE1 PHE C 104 19.488 1.724 -15.193 1.00 0.00 C ATOM 236 CE2 PHE C 104 20.871 1.367 -17.148 1.00 0.00 C ATOM 237 CZ PHE C 104 20.665 1.241 -15.768 1.00 0.00 C ATOM 0 H PHE C 104 16.539 4.430 -16.522 1.00 0.00 H new ATOM 0 HA PHE C 104 18.920 4.906 -18.127 1.00 0.00 H new ATOM 0 HB2 PHE C 104 16.679 2.856 -17.903 1.00 0.00 H new ATOM 0 HB3 PHE C 104 17.774 2.776 -19.269 1.00 0.00 H new ATOM 0 HD1 PHE C 104 17.611 2.713 -15.541 1.00 0.00 H new ATOM 0 HD2 PHE C 104 20.062 2.074 -19.010 1.00 0.00 H new ATOM 0 HE1 PHE C 104 19.327 1.624 -14.130 1.00 0.00 H new ATOM 0 HE2 PHE C 104 21.780 0.992 -17.595 1.00 0.00 H new ATOM 0 HZ PHE C 104 21.416 0.771 -15.150 1.00 0.00 H new ATOM 247 N ASP C 105 16.019 5.482 -19.564 1.00 0.00 N ATOM 248 CA ASP C 105 15.467 6.107 -20.820 1.00 0.00 C ATOM 249 C ASP C 105 15.523 7.633 -20.734 1.00 0.00 C ATOM 250 O ASP C 105 15.014 8.230 -19.810 1.00 0.00 O ATOM 251 CB ASP C 105 14.013 5.650 -20.921 1.00 0.00 C ATOM 252 CG ASP C 105 13.630 5.723 -22.352 1.00 0.00 C ATOM 253 OD1 ASP C 105 14.076 4.906 -23.079 1.00 0.00 O1- ATOM 254 OD2 ASP C 105 12.961 6.608 -22.748 1.00 0.00 O ATOM 0 H ASP C 105 15.326 5.221 -18.863 1.00 0.00 H new ATOM 0 HA ASP C 105 16.048 5.806 -21.692 1.00 0.00 H new ATOM 0 HB2 ASP C 105 13.902 4.633 -20.544 1.00 0.00 H new ATOM 0 HB3 ASP C 105 13.367 6.286 -20.317 1.00 0.00 H new ATOM 259 N LYS C 106 16.142 8.271 -21.679 1.00 0.00 N ATOM 260 CA LYS C 106 16.221 9.777 -21.646 1.00 0.00 C ATOM 261 C LYS C 106 14.975 10.408 -22.286 1.00 0.00 C ATOM 262 O LYS C 106 14.599 11.508 -21.933 1.00 0.00 O ATOM 263 CB LYS C 106 17.493 10.153 -22.437 1.00 0.00 C ATOM 264 CG LYS C 106 18.727 9.442 -21.831 1.00 0.00 C ATOM 265 CD LYS C 106 18.968 9.915 -20.379 1.00 0.00 C ATOM 266 CE LYS C 106 18.686 8.766 -19.377 1.00 0.00 C ATOM 267 NZ LYS C 106 19.576 7.619 -19.785 1.00 0.00 N1+ ATOM 0 H LYS C 106 16.600 7.830 -22.476 1.00 0.00 H new ATOM 0 HA LYS C 106 16.264 10.148 -20.622 1.00 0.00 H new ATOM 0 HB2 LYS C 106 17.377 9.869 -23.483 1.00 0.00 H new ATOM 0 HB3 LYS C 106 17.639 11.233 -22.414 1.00 0.00 H new ATOM 0 HG2 LYS C 106 18.576 8.363 -21.847 1.00 0.00 H new ATOM 0 HG3 LYS C 106 19.608 9.650 -22.438 1.00 0.00 H new ATOM 0 HD2 LYS C 106 19.997 10.257 -20.268 1.00 0.00 H new ATOM 0 HD3 LYS C 106 18.324 10.765 -20.156 1.00 0.00 H new ATOM 0 HE2 LYS C 106 18.900 9.080 -18.355 1.00 0.00 H new ATOM 0 HE3 LYS C 106 17.636 8.473 -19.407 1.00 0.00 H new ATOM 0 HZ1 LYS C 106 19.006 6.888 -20.256 1.00 0.00 H new ATOM 0 HZ2 LYS C 106 20.307 7.963 -20.440 1.00 0.00 H new ATOM 0 HZ3 LYS C 106 20.029 7.214 -18.941 1.00 0.00 H new ATOM 281 N ASN C 107 14.376 9.764 -23.273 1.00 0.00 N ATOM 282 CA ASN C 107 13.184 10.394 -23.965 1.00 0.00 C ATOM 283 C ASN C 107 11.851 9.959 -23.337 1.00 0.00 C ATOM 284 O ASN C 107 10.808 10.324 -23.846 1.00 0.00 O ATOM 285 CB ASN C 107 13.225 9.904 -25.433 1.00 0.00 C ATOM 286 CG ASN C 107 14.536 10.302 -26.118 1.00 0.00 C ATOM 287 OD1 ASN C 107 15.157 9.488 -26.752 1.00 0.00 O ATOM 288 ND2 ASN C 107 14.979 11.520 -26.033 1.00 0.00 N ATOM 0 H ASN C 107 14.652 8.848 -23.626 1.00 0.00 H new ATOM 0 HA ASN C 107 13.242 11.479 -23.876 1.00 0.00 H new ATOM 0 HB2 ASN C 107 13.113 8.820 -25.460 1.00 0.00 H new ATOM 0 HB3 ASN C 107 12.383 10.325 -25.982 1.00 0.00 H new ATOM 0 HD21 ASN C 107 15.847 11.781 -26.501 1.00 0.00 H new ATOM 0 HD22 ASN C 107 14.459 12.216 -25.498 1.00 0.00 H new ATOM 295 N ALA C 108 11.860 9.100 -22.309 1.00 0.00 N ATOM 296 CA ALA C 108 10.561 8.535 -21.739 1.00 0.00 C ATOM 297 C ALA C 108 9.758 7.892 -22.904 1.00 0.00 C ATOM 298 O ALA C 108 8.539 7.959 -22.952 1.00 0.00 O ATOM 299 CB ALA C 108 9.803 9.741 -21.138 1.00 0.00 C ATOM 0 H ALA C 108 12.707 8.770 -21.845 1.00 0.00 H new ATOM 0 HA ALA C 108 10.723 7.772 -20.978 1.00 0.00 H new ATOM 0 HB1 ALA C 108 8.859 9.402 -20.711 1.00 0.00 H new ATOM 0 HB2 ALA C 108 10.410 10.200 -20.357 1.00 0.00 H new ATOM 0 HB3 ALA C 108 9.605 10.473 -21.921 1.00 0.00 H new ATOM 305 N ASP C 109 10.465 7.311 -23.859 1.00 0.00 N ATOM 306 CA ASP C 109 9.825 6.716 -25.103 1.00 0.00 C ATOM 307 C ASP C 109 9.422 5.226 -24.929 1.00 0.00 C ATOM 308 O ASP C 109 8.934 4.612 -25.864 1.00 0.00 O ATOM 309 CB ASP C 109 10.925 6.866 -26.223 1.00 0.00 C ATOM 310 CG ASP C 109 12.212 6.107 -25.879 1.00 0.00 C ATOM 311 OD1 ASP C 109 12.197 5.250 -25.110 1.00 0.00 O ATOM 312 OD2 ASP C 109 13.238 6.435 -26.334 1.00 0.00 O1- ATOM 0 H ASP C 109 11.481 7.220 -23.831 1.00 0.00 H new ATOM 0 HA ASP C 109 8.893 7.229 -25.342 1.00 0.00 H new ATOM 0 HB2 ASP C 109 10.530 6.497 -27.169 1.00 0.00 H new ATOM 0 HB3 ASP C 109 11.155 7.922 -26.364 1.00 0.00 H new ATOM 317 N GLY C 110 9.650 4.631 -23.779 1.00 0.00 N ATOM 318 CA GLY C 110 9.265 3.188 -23.590 1.00 0.00 C ATOM 319 C GLY C 110 10.418 2.234 -23.985 1.00 0.00 C ATOM 320 O GLY C 110 10.418 1.080 -23.587 1.00 0.00 O ATOM 0 H GLY C 110 10.082 5.075 -22.969 1.00 0.00 H new ATOM 0 HA2 GLY C 110 8.991 3.017 -22.549 1.00 0.00 H new ATOM 0 HA3 GLY C 110 8.384 2.964 -24.192 1.00 0.00 H new ATOM 324 N TYR C 111 11.399 2.692 -24.749 1.00 0.00 N ATOM 325 CA TYR C 111 12.558 1.808 -25.149 1.00 0.00 C ATOM 326 C TYR C 111 13.860 2.492 -24.800 1.00 0.00 C ATOM 327 O TYR C 111 14.130 3.609 -25.290 1.00 0.00 O ATOM 328 CB TYR C 111 12.463 1.674 -26.677 1.00 0.00 C ATOM 329 CG TYR C 111 11.371 0.705 -27.034 1.00 0.00 C ATOM 330 CD1 TYR C 111 11.668 -0.654 -27.146 1.00 0.00 C ATOM 331 CD2 TYR C 111 10.066 1.159 -27.251 1.00 0.00 C ATOM 332 CE1 TYR C 111 10.666 -1.560 -27.470 1.00 0.00 C ATOM 333 CE2 TYR C 111 9.063 0.248 -27.574 1.00 0.00 C ATOM 334 CZ TYR C 111 9.361 -1.112 -27.685 1.00 0.00 C ATOM 335 OH TYR C 111 8.361 -2.012 -27.990 1.00 0.00 O ATOM 0 H TYR C 111 11.445 3.644 -25.113 1.00 0.00 H new ATOM 0 HA TYR C 111 12.525 0.843 -24.643 1.00 0.00 H new ATOM 0 HB2 TYR C 111 12.260 2.647 -27.125 1.00 0.00 H new ATOM 0 HB3 TYR C 111 13.415 1.329 -27.081 1.00 0.00 H new ATOM 0 HD1 TYR C 111 12.677 -1.001 -26.981 1.00 0.00 H new ATOM 0 HD2 TYR C 111 9.837 2.211 -27.168 1.00 0.00 H new ATOM 0 HE1 TYR C 111 10.896 -2.612 -27.556 1.00 0.00 H new ATOM 0 HE2 TYR C 111 8.053 0.594 -27.739 1.00 0.00 H new ATOM 0 HH TYR C 111 7.514 -1.533 -28.107 1.00 0.00 H new ATOM 345 N ILE C 112 14.731 1.839 -24.084 1.00 0.00 N ATOM 346 CA ILE C 112 16.054 2.466 -23.789 1.00 0.00 C ATOM 347 C ILE C 112 16.943 2.261 -25.016 1.00 0.00 C ATOM 348 O ILE C 112 17.105 1.137 -25.513 1.00 0.00 O ATOM 349 CB ILE C 112 16.630 1.709 -22.564 1.00 0.00 C ATOM 350 CG1 ILE C 112 15.669 1.812 -21.373 1.00 0.00 C ATOM 351 CG2 ILE C 112 17.986 2.304 -22.153 1.00 0.00 C ATOM 352 CD1 ILE C 112 16.186 0.946 -20.221 1.00 0.00 C ATOM 0 H ILE C 112 14.589 0.908 -23.693 1.00 0.00 H new ATOM 0 HA ILE C 112 15.985 3.532 -23.574 1.00 0.00 H new ATOM 0 HB ILE C 112 16.758 0.664 -22.846 1.00 0.00 H new ATOM 0 HG12 ILE C 112 15.582 2.850 -21.051 1.00 0.00 H new ATOM 0 HG13 ILE C 112 14.672 1.486 -21.668 1.00 0.00 H new ATOM 0 HG21 ILE C 112 18.376 1.761 -21.292 1.00 0.00 H new ATOM 0 HG22 ILE C 112 18.687 2.219 -22.983 1.00 0.00 H new ATOM 0 HG23 ILE C 112 17.858 3.355 -21.892 1.00 0.00 H new ATOM 0 HD11 ILE C 112 15.502 1.020 -19.375 1.00 0.00 H new ATOM 0 HD12 ILE C 112 16.250 -0.092 -20.547 1.00 0.00 H new ATOM 0 HD13 ILE C 112 17.174 1.293 -19.920 1.00 0.00 H new ATOM 364 N ASP C 113 17.473 3.324 -25.523 1.00 0.00 N ATOM 365 CA ASP C 113 18.344 3.274 -26.722 1.00 0.00 C ATOM 366 C ASP C 113 19.788 3.417 -26.280 1.00 0.00 C ATOM 367 O ASP C 113 20.073 4.008 -25.229 1.00 0.00 O ATOM 368 CB ASP C 113 17.949 4.493 -27.547 1.00 0.00 C ATOM 369 CG ASP C 113 18.646 4.438 -28.879 1.00 0.00 C ATOM 370 OD1 ASP C 113 18.094 3.847 -29.770 1.00 0.00 O ATOM 371 OD2 ASP C 113 19.708 4.980 -28.991 1.00 0.00 O1- ATOM 0 H ASP C 113 17.336 4.261 -25.145 1.00 0.00 H new ATOM 0 HA ASP C 113 18.238 2.345 -27.282 1.00 0.00 H new ATOM 0 HB2 ASP C 113 16.869 4.516 -27.689 1.00 0.00 H new ATOM 0 HB3 ASP C 113 18.220 5.407 -27.019 1.00 0.00 H new ATOM 376 N LEU C 114 20.703 2.938 -27.075 1.00 0.00 N ATOM 377 CA LEU C 114 22.161 3.101 -26.739 1.00 0.00 C ATOM 378 C LEU C 114 22.487 4.594 -26.541 1.00 0.00 C ATOM 379 O LEU C 114 23.241 4.948 -25.640 1.00 0.00 O ATOM 380 CB LEU C 114 22.979 2.521 -27.929 1.00 0.00 C ATOM 381 CG LEU C 114 22.436 3.016 -29.298 1.00 0.00 C ATOM 382 CD1 LEU C 114 23.521 3.788 -30.051 1.00 0.00 C ATOM 383 CD2 LEU C 114 22.005 1.815 -30.140 1.00 0.00 C ATOM 0 H LEU C 114 20.513 2.440 -27.944 1.00 0.00 H new ATOM 0 HA LEU C 114 22.410 2.577 -25.816 1.00 0.00 H new ATOM 0 HB2 LEU C 114 24.025 2.811 -27.827 1.00 0.00 H new ATOM 0 HB3 LEU C 114 22.945 1.432 -27.897 1.00 0.00 H new ATOM 0 HG LEU C 114 21.585 3.673 -29.121 1.00 0.00 H new ATOM 0 HD11 LEU C 114 23.127 4.129 -31.008 1.00 0.00 H new ATOM 0 HD12 LEU C 114 23.832 4.649 -29.459 1.00 0.00 H new ATOM 0 HD13 LEU C 114 24.378 3.137 -30.223 1.00 0.00 H new ATOM 0 HD21 LEU C 114 21.624 2.162 -31.100 1.00 0.00 H new ATOM 0 HD22 LEU C 114 22.861 1.160 -30.304 1.00 0.00 H new ATOM 0 HD23 LEU C 114 21.223 1.266 -29.616 1.00 0.00 H new ATOM 395 N ASP C 115 21.895 5.482 -27.340 1.00 0.00 N ATOM 396 CA ASP C 115 22.149 6.947 -27.134 1.00 0.00 C ATOM 397 C ASP C 115 21.577 7.375 -25.773 1.00 0.00 C ATOM 398 O ASP C 115 22.265 7.982 -24.967 1.00 0.00 O ATOM 399 CB ASP C 115 21.410 7.685 -28.269 1.00 0.00 C ATOM 400 CG ASP C 115 21.980 9.093 -28.463 1.00 0.00 C ATOM 401 OD1 ASP C 115 22.464 9.683 -27.518 1.00 0.00 O ATOM 402 OD2 ASP C 115 21.936 9.560 -29.572 1.00 0.00 O1- ATOM 0 H ASP C 115 21.263 5.251 -28.106 1.00 0.00 H new ATOM 0 HA ASP C 115 23.215 7.176 -27.147 1.00 0.00 H new ATOM 0 HB2 ASP C 115 21.501 7.120 -29.196 1.00 0.00 H new ATOM 0 HB3 ASP C 115 20.347 7.747 -28.037 1.00 0.00 H new ATOM 407 N GLU C 116 20.354 6.963 -25.457 1.00 0.00 N ATOM 408 CA GLU C 116 19.780 7.306 -24.104 1.00 0.00 C ATOM 409 C GLU C 116 20.697 6.739 -23.009 1.00 0.00 C ATOM 410 O GLU C 116 20.908 7.370 -21.955 1.00 0.00 O ATOM 411 CB GLU C 116 18.395 6.615 -24.030 1.00 0.00 C ATOM 412 CG GLU C 116 17.411 7.253 -25.042 1.00 0.00 C ATOM 413 CD GLU C 116 16.044 6.629 -24.891 1.00 0.00 C ATOM 414 OE1 GLU C 116 15.860 5.532 -25.264 1.00 0.00 O1- ATOM 415 OE2 GLU C 116 15.172 7.230 -24.389 1.00 0.00 O ATOM 0 H GLU C 116 19.744 6.417 -26.066 1.00 0.00 H new ATOM 0 HA GLU C 116 19.694 8.383 -23.963 1.00 0.00 H new ATOM 0 HB2 GLU C 116 18.502 5.551 -24.241 1.00 0.00 H new ATOM 0 HB3 GLU C 116 17.993 6.701 -23.020 1.00 0.00 H new ATOM 0 HG2 GLU C 116 17.350 8.328 -24.875 1.00 0.00 H new ATOM 0 HG3 GLU C 116 17.776 7.108 -26.059 1.00 0.00 H new ATOM 422 N LEU C 117 21.248 5.571 -23.238 1.00 0.00 N ATOM 423 CA LEU C 117 22.181 4.968 -22.244 1.00 0.00 C ATOM 424 C LEU C 117 23.485 5.789 -22.221 1.00 0.00 C ATOM 425 O LEU C 117 23.986 6.129 -21.153 1.00 0.00 O ATOM 426 CB LEU C 117 22.452 3.552 -22.791 1.00 0.00 C ATOM 427 CG LEU C 117 23.183 2.695 -21.748 1.00 0.00 C ATOM 428 CD1 LEU C 117 22.180 2.187 -20.707 1.00 0.00 C ATOM 429 CD2 LEU C 117 23.840 1.505 -22.449 1.00 0.00 C ATOM 0 H LEU C 117 21.089 5.010 -24.075 1.00 0.00 H new ATOM 0 HA LEU C 117 21.782 4.949 -21.230 1.00 0.00 H new ATOM 0 HB2 LEU C 117 21.510 3.076 -23.064 1.00 0.00 H new ATOM 0 HB3 LEU C 117 23.051 3.617 -23.699 1.00 0.00 H new ATOM 0 HG LEU C 117 23.945 3.294 -21.250 1.00 0.00 H new ATOM 0 HD11 LEU C 117 22.700 1.579 -19.967 1.00 0.00 H new ATOM 0 HD12 LEU C 117 21.708 3.036 -20.212 1.00 0.00 H new ATOM 0 HD13 LEU C 117 21.417 1.585 -21.200 1.00 0.00 H new ATOM 0 HD21 LEU C 117 24.361 0.892 -21.714 1.00 0.00 H new ATOM 0 HD22 LEU C 117 23.075 0.907 -22.944 1.00 0.00 H new ATOM 0 HD23 LEU C 117 24.553 1.867 -23.190 1.00 0.00 H new ATOM 441 N LYS C 118 24.042 6.131 -23.391 1.00 0.00 N ATOM 442 CA LYS C 118 25.315 6.923 -23.379 1.00 0.00 C ATOM 443 C LYS C 118 25.088 8.329 -22.830 1.00 0.00 C ATOM 444 O LYS C 118 25.925 8.836 -22.157 1.00 0.00 O ATOM 445 CB LYS C 118 25.931 6.956 -24.797 1.00 0.00 C ATOM 446 CG LYS C 118 25.159 7.896 -25.724 1.00 0.00 C ATOM 447 CD LYS C 118 25.860 7.942 -27.101 1.00 0.00 C ATOM 448 CE LYS C 118 25.371 9.150 -27.966 1.00 0.00 C ATOM 449 NZ LYS C 118 25.112 10.294 -27.031 1.00 0.00 N1+ ATOM 0 H LYS C 118 23.673 5.898 -24.313 1.00 0.00 H new ATOM 0 HA LYS C 118 26.023 6.433 -22.711 1.00 0.00 H new ATOM 0 HB2 LYS C 118 26.971 7.278 -24.735 1.00 0.00 H new ATOM 0 HB3 LYS C 118 25.933 5.950 -25.217 1.00 0.00 H new ATOM 0 HG2 LYS C 118 24.131 7.551 -25.837 1.00 0.00 H new ATOM 0 HG3 LYS C 118 25.114 8.896 -25.292 1.00 0.00 H new ATOM 0 HD2 LYS C 118 26.938 8.012 -26.957 1.00 0.00 H new ATOM 0 HD3 LYS C 118 25.669 7.012 -27.636 1.00 0.00 H new ATOM 0 HE2 LYS C 118 26.124 9.422 -28.706 1.00 0.00 H new ATOM 0 HE3 LYS C 118 24.465 8.889 -28.513 1.00 0.00 H new ATOM 0 HZ1 LYS C 118 25.201 11.192 -27.548 1.00 0.00 H new ATOM 0 HZ2 LYS C 118 24.151 10.213 -26.641 1.00 0.00 H new ATOM 0 HZ3 LYS C 118 25.804 10.271 -26.255 1.00 0.00 H new ATOM 463 N ILE C 119 23.949 8.959 -23.091 1.00 0.00 N ATOM 464 CA ILE C 119 23.709 10.349 -22.515 1.00 0.00 C ATOM 465 C ILE C 119 23.893 10.314 -20.982 1.00 0.00 C ATOM 466 O ILE C 119 24.506 11.199 -20.404 1.00 0.00 O ATOM 467 CB ILE C 119 22.246 10.730 -22.893 1.00 0.00 C ATOM 468 CG1 ILE C 119 22.119 10.886 -24.415 1.00 0.00 C ATOM 469 CG2 ILE C 119 21.857 12.062 -22.236 1.00 0.00 C ATOM 470 CD1 ILE C 119 20.649 11.061 -24.800 1.00 0.00 C ATOM 0 H ILE C 119 23.191 8.585 -23.662 1.00 0.00 H new ATOM 0 HA ILE C 119 24.412 11.082 -22.910 1.00 0.00 H new ATOM 0 HB ILE C 119 21.586 9.937 -22.542 1.00 0.00 H new ATOM 0 HG12 ILE C 119 22.697 11.747 -24.750 1.00 0.00 H new ATOM 0 HG13 ILE C 119 22.533 10.010 -24.915 1.00 0.00 H new ATOM 0 HG21 ILE C 119 20.833 12.317 -22.508 1.00 0.00 H new ATOM 0 HG22 ILE C 119 21.932 11.969 -21.153 1.00 0.00 H new ATOM 0 HG23 ILE C 119 22.530 12.848 -22.580 1.00 0.00 H new ATOM 0 HD11 ILE C 119 20.567 11.171 -25.881 1.00 0.00 H new ATOM 0 HD12 ILE C 119 20.083 10.186 -24.480 1.00 0.00 H new ATOM 0 HD13 ILE C 119 20.249 11.950 -24.313 1.00 0.00 H new ATOM 482 N MET C 120 23.433 9.261 -20.333 1.00 0.00 N ATOM 483 CA MET C 120 23.672 9.129 -18.851 1.00 0.00 C ATOM 484 C MET C 120 25.203 9.045 -18.620 1.00 0.00 C ATOM 485 O MET C 120 25.740 9.719 -17.767 1.00 0.00 O ATOM 486 CB MET C 120 22.961 7.815 -18.465 1.00 0.00 C ATOM 487 CG MET C 120 22.935 7.636 -16.945 1.00 0.00 C ATOM 488 SD MET C 120 21.959 6.159 -16.546 1.00 0.00 S ATOM 489 CE MET C 120 23.092 4.911 -17.213 1.00 0.00 C ATOM 0 H MET C 120 22.909 8.497 -20.759 1.00 0.00 H new ATOM 0 HA MET C 120 23.297 9.962 -18.256 1.00 0.00 H new ATOM 0 HB2 MET C 120 21.942 7.820 -18.852 1.00 0.00 H new ATOM 0 HB3 MET C 120 23.473 6.970 -18.926 1.00 0.00 H new ATOM 0 HG2 MET C 120 23.949 7.533 -16.560 1.00 0.00 H new ATOM 0 HG3 MET C 120 22.501 8.515 -16.469 1.00 0.00 H new ATOM 0 HE1 MET C 120 22.903 3.952 -16.730 1.00 0.00 H new ATOM 0 HE2 MET C 120 22.934 4.813 -18.287 1.00 0.00 H new ATOM 0 HE3 MET C 120 24.121 5.216 -17.024 1.00 0.00 H new ATOM 499 N LEU C 121 25.910 8.301 -19.457 1.00 0.00 N ATOM 500 CA LEU C 121 27.423 8.268 -19.372 1.00 0.00 C ATOM 501 C LEU C 121 27.989 9.638 -19.780 1.00 0.00 C ATOM 502 O LEU C 121 28.927 10.129 -19.188 1.00 0.00 O ATOM 503 CB LEU C 121 27.877 7.202 -20.374 1.00 0.00 C ATOM 504 CG LEU C 121 27.261 5.833 -20.023 1.00 0.00 C ATOM 505 CD1 LEU C 121 27.729 4.812 -21.044 1.00 0.00 C ATOM 506 CD2 LEU C 121 27.730 5.388 -18.628 1.00 0.00 C ATOM 0 H LEU C 121 25.508 7.718 -20.191 1.00 0.00 H new ATOM 0 HA LEU C 121 27.768 8.044 -18.363 1.00 0.00 H new ATOM 0 HB2 LEU C 121 27.581 7.493 -21.382 1.00 0.00 H new ATOM 0 HB3 LEU C 121 28.965 7.130 -20.369 1.00 0.00 H new ATOM 0 HG LEU C 121 26.174 5.913 -20.030 1.00 0.00 H new ATOM 0 HD11 LEU C 121 27.300 3.838 -20.808 1.00 0.00 H new ATOM 0 HD12 LEU C 121 27.407 5.118 -22.039 1.00 0.00 H new ATOM 0 HD13 LEU C 121 28.817 4.745 -21.020 1.00 0.00 H new ATOM 0 HD21 LEU C 121 27.290 4.420 -18.388 1.00 0.00 H new ATOM 0 HD22 LEU C 121 28.817 5.305 -18.619 1.00 0.00 H new ATOM 0 HD23 LEU C 121 27.416 6.123 -17.887 1.00 0.00 H new ATOM 518 N GLN C 122 27.405 10.268 -20.772 1.00 0.00 N ATOM 519 CA GLN C 122 27.875 11.620 -21.229 1.00 0.00 C ATOM 520 C GLN C 122 27.842 12.569 -20.025 1.00 0.00 C ATOM 521 O GLN C 122 28.744 13.361 -19.838 1.00 0.00 O ATOM 522 CB GLN C 122 26.832 12.069 -22.291 1.00 0.00 C ATOM 523 CG GLN C 122 27.507 12.343 -23.644 1.00 0.00 C ATOM 524 CD GLN C 122 27.716 11.021 -24.395 1.00 0.00 C ATOM 525 OE1 GLN C 122 26.792 10.495 -25.020 1.00 0.00 O ATOM 526 NE2 GLN C 122 28.876 10.451 -24.359 1.00 0.00 N ATOM 0 H GLN C 122 26.610 9.898 -21.294 1.00 0.00 H new ATOM 0 HA GLN C 122 28.886 11.612 -21.637 1.00 0.00 H new ATOM 0 HB2 GLN C 122 26.072 11.296 -22.409 1.00 0.00 H new ATOM 0 HB3 GLN C 122 26.321 12.968 -21.947 1.00 0.00 H new ATOM 0 HG2 GLN C 122 26.891 13.017 -24.239 1.00 0.00 H new ATOM 0 HG3 GLN C 122 28.465 12.840 -23.489 1.00 0.00 H new ATOM 0 HE21 GLN C 122 29.641 10.884 -23.843 1.00 0.00 H new ATOM 0 HE22 GLN C 122 29.026 9.568 -24.847 1.00 0.00 H new ATOM 535 N ALA C 123 26.842 12.438 -19.166 1.00 0.00 N ATOM 536 CA ALA C 123 26.791 13.290 -17.933 1.00 0.00 C ATOM 537 C ALA C 123 28.041 13.035 -17.067 1.00 0.00 C ATOM 538 O ALA C 123 28.494 13.926 -16.380 1.00 0.00 O ATOM 539 CB ALA C 123 25.529 12.863 -17.177 1.00 0.00 C ATOM 0 H ALA C 123 26.069 11.781 -19.271 1.00 0.00 H new ATOM 0 HA ALA C 123 26.769 14.352 -18.177 1.00 0.00 H new ATOM 0 HB1 ALA C 123 25.435 13.451 -16.264 1.00 0.00 H new ATOM 0 HB2 ALA C 123 24.654 13.028 -17.806 1.00 0.00 H new ATOM 0 HB3 ALA C 123 25.598 11.805 -16.922 1.00 0.00 H new ATOM 545 N THR C 124 28.605 11.825 -17.079 1.00 0.00 N ATOM 546 CA THR C 124 29.838 11.592 -16.231 1.00 0.00 C ATOM 547 C THR C 124 31.093 12.294 -16.843 1.00 0.00 C ATOM 548 O THR C 124 32.049 12.588 -16.132 1.00 0.00 O ATOM 549 CB THR C 124 30.024 10.046 -16.088 1.00 0.00 C ATOM 550 OG1 THR C 124 30.355 9.416 -17.339 1.00 0.00 O ATOM 551 CG2 THR C 124 28.748 9.408 -15.508 1.00 0.00 C ATOM 0 H THR C 124 28.277 11.023 -17.618 1.00 0.00 H new ATOM 0 HA THR C 124 29.714 12.035 -15.243 1.00 0.00 H new ATOM 0 HB THR C 124 30.860 9.887 -15.407 1.00 0.00 H new ATOM 0 HG1 THR C 124 29.565 9.406 -17.919 1.00 0.00 H new ATOM 0 HG21 THR C 124 28.890 8.331 -15.413 1.00 0.00 H new ATOM 0 HG22 THR C 124 28.542 9.835 -14.526 1.00 0.00 H new ATOM 0 HG23 THR C 124 27.908 9.606 -16.173 1.00 0.00 H new ATOM 559 N GLY C 125 31.093 12.590 -18.134 1.00 0.00 N ATOM 560 CA GLY C 125 32.272 13.287 -18.750 1.00 0.00 C ATOM 561 C GLY C 125 32.626 12.626 -20.076 1.00 0.00 C ATOM 562 O GLY C 125 31.862 12.706 -21.034 1.00 0.00 O ATOM 0 H GLY C 125 30.331 12.378 -18.778 1.00 0.00 H new ATOM 0 HA2 GLY C 125 32.042 14.341 -18.908 1.00 0.00 H new ATOM 0 HA3 GLY C 125 33.125 13.246 -18.073 1.00 0.00 H new ATOM 566 N GLU C 126 33.771 11.977 -20.154 1.00 0.00 N ATOM 567 CA GLU C 126 34.178 11.296 -21.441 1.00 0.00 C ATOM 568 C GLU C 126 33.143 10.239 -21.795 1.00 0.00 C ATOM 569 O GLU C 126 32.590 9.586 -20.906 1.00 0.00 O ATOM 570 CB GLU C 126 35.531 10.597 -21.181 1.00 0.00 C ATOM 571 CG GLU C 126 36.619 11.618 -20.759 1.00 0.00 C ATOM 572 CD GLU C 126 36.877 12.657 -21.853 1.00 0.00 C ATOM 573 OE1 GLU C 126 36.543 12.415 -22.993 1.00 0.00 O1- ATOM 574 OE2 GLU C 126 37.418 13.686 -21.526 1.00 0.00 O ATOM 0 H GLU C 126 34.440 11.888 -19.389 1.00 0.00 H new ATOM 0 HA GLU C 126 34.254 12.017 -22.255 1.00 0.00 H new ATOM 0 HB2 GLU C 126 35.411 9.846 -20.400 1.00 0.00 H new ATOM 0 HB3 GLU C 126 35.851 10.072 -22.081 1.00 0.00 H new ATOM 0 HG2 GLU C 126 36.309 12.123 -19.844 1.00 0.00 H new ATOM 0 HG3 GLU C 126 37.545 11.090 -20.533 1.00 0.00 H new ATOM 581 N THR C 127 32.929 9.999 -23.061 1.00 0.00 N ATOM 582 CA THR C 127 31.989 8.920 -23.450 1.00 0.00 C ATOM 583 C THR C 127 32.627 7.557 -23.071 1.00 0.00 C ATOM 584 O THR C 127 33.809 7.481 -22.731 1.00 0.00 O ATOM 585 CB THR C 127 31.774 9.081 -24.981 1.00 0.00 C ATOM 586 OG1 THR C 127 30.481 8.567 -25.338 1.00 0.00 O ATOM 587 CG2 THR C 127 32.881 8.358 -25.778 1.00 0.00 C ATOM 0 H THR C 127 33.363 10.502 -23.835 1.00 0.00 H new ATOM 0 HA THR C 127 31.026 8.970 -22.942 1.00 0.00 H new ATOM 0 HB THR C 127 31.825 10.140 -25.232 1.00 0.00 H new ATOM 0 HG1 THR C 127 30.343 8.669 -26.303 1.00 0.00 H new ATOM 0 HG21 THR C 127 32.704 8.488 -26.846 1.00 0.00 H new ATOM 0 HG22 THR C 127 33.852 8.779 -25.517 1.00 0.00 H new ATOM 0 HG23 THR C 127 32.869 7.296 -25.535 1.00 0.00 H new ATOM 595 N ILE C 128 31.870 6.510 -23.110 1.00 0.00 N ATOM 596 CA ILE C 128 32.400 5.166 -22.720 1.00 0.00 C ATOM 597 C ILE C 128 32.738 4.357 -23.962 1.00 0.00 C ATOM 598 O ILE C 128 32.175 4.574 -25.036 1.00 0.00 O ATOM 599 CB ILE C 128 31.271 4.503 -21.890 1.00 0.00 C ATOM 600 CG1 ILE C 128 30.932 5.381 -20.676 1.00 0.00 C ATOM 601 CG2 ILE C 128 31.733 3.138 -21.386 1.00 0.00 C ATOM 602 CD1 ILE C 128 32.213 5.671 -19.885 1.00 0.00 C ATOM 0 H ILE C 128 30.892 6.517 -23.398 1.00 0.00 H new ATOM 0 HA ILE C 128 33.320 5.232 -22.140 1.00 0.00 H new ATOM 0 HB ILE C 128 30.392 4.389 -22.525 1.00 0.00 H new ATOM 0 HG12 ILE C 128 30.475 6.314 -21.004 1.00 0.00 H new ATOM 0 HG13 ILE C 128 30.205 4.876 -20.040 1.00 0.00 H new ATOM 0 HG21 ILE C 128 30.936 2.676 -20.803 1.00 0.00 H new ATOM 0 HG22 ILE C 128 31.978 2.500 -22.235 1.00 0.00 H new ATOM 0 HG23 ILE C 128 32.616 3.261 -20.759 1.00 0.00 H new ATOM 0 HD11 ILE C 128 31.975 6.294 -19.023 1.00 0.00 H new ATOM 0 HD12 ILE C 128 32.651 4.733 -19.545 1.00 0.00 H new ATOM 0 HD13 ILE C 128 32.925 6.193 -20.524 1.00 0.00 H new ATOM 614 N THR C 129 33.662 3.452 -23.835 1.00 0.00 N ATOM 615 CA THR C 129 34.060 2.620 -24.993 1.00 0.00 C ATOM 616 C THR C 129 32.867 1.746 -25.420 1.00 0.00 C ATOM 617 O THR C 129 31.965 1.451 -24.622 1.00 0.00 O ATOM 618 CB THR C 129 35.247 1.769 -24.489 1.00 0.00 C ATOM 619 OG1 THR C 129 34.991 1.315 -23.152 1.00 0.00 O ATOM 620 CG2 THR C 129 36.524 2.617 -24.491 1.00 0.00 C ATOM 0 H THR C 129 34.162 3.253 -22.969 1.00 0.00 H new ATOM 0 HA THR C 129 34.350 3.205 -25.866 1.00 0.00 H new ATOM 0 HB THR C 129 35.371 0.910 -25.148 1.00 0.00 H new ATOM 0 HG1 THR C 129 35.030 0.336 -23.126 1.00 0.00 H new ATOM 0 HG21 THR C 129 37.361 2.016 -24.135 1.00 0.00 H new ATOM 0 HG22 THR C 129 36.730 2.962 -25.504 1.00 0.00 H new ATOM 0 HG23 THR C 129 36.391 3.477 -23.835 1.00 0.00 H new ATOM 628 N GLU C 130 32.823 1.382 -26.671 1.00 0.00 N ATOM 629 CA GLU C 130 31.664 0.594 -27.191 1.00 0.00 C ATOM 630 C GLU C 130 31.550 -0.729 -26.426 1.00 0.00 C ATOM 631 O GLU C 130 30.460 -1.172 -26.124 1.00 0.00 O ATOM 632 CB GLU C 130 31.967 0.328 -28.689 1.00 0.00 C ATOM 633 CG GLU C 130 31.927 1.655 -29.513 1.00 0.00 C ATOM 634 CD GLU C 130 33.238 2.454 -29.401 1.00 0.00 C ATOM 635 OE1 GLU C 130 34.262 1.873 -29.067 1.00 0.00 O1- ATOM 636 OE2 GLU C 130 33.192 3.629 -29.626 1.00 0.00 O ATOM 0 H GLU C 130 33.543 1.596 -27.362 1.00 0.00 H new ATOM 0 HA GLU C 130 30.722 1.128 -27.066 1.00 0.00 H new ATOM 0 HB2 GLU C 130 32.948 -0.136 -28.788 1.00 0.00 H new ATOM 0 HB3 GLU C 130 31.239 -0.376 -29.091 1.00 0.00 H new ATOM 0 HG2 GLU C 130 31.734 1.424 -30.560 1.00 0.00 H new ATOM 0 HG3 GLU C 130 31.098 2.271 -29.165 1.00 0.00 H new ATOM 643 N ASP C 131 32.668 -1.331 -26.078 1.00 0.00 N ATOM 644 CA ASP C 131 32.647 -2.632 -25.300 1.00 0.00 C ATOM 645 C ASP C 131 31.899 -2.490 -23.964 1.00 0.00 C ATOM 646 O ASP C 131 31.005 -3.283 -23.673 1.00 0.00 O ATOM 647 CB ASP C 131 34.146 -3.017 -25.030 1.00 0.00 C ATOM 648 CG ASP C 131 34.988 -1.788 -24.677 1.00 0.00 C ATOM 649 OD1 ASP C 131 34.961 -1.358 -23.540 1.00 0.00 O1- ATOM 650 OD2 ASP C 131 35.628 -1.269 -25.567 1.00 0.00 O ATOM 0 H ASP C 131 33.601 -0.981 -26.297 1.00 0.00 H new ATOM 0 HA ASP C 131 32.124 -3.398 -25.873 1.00 0.00 H new ATOM 0 HB2 ASP C 131 34.196 -3.739 -24.215 1.00 0.00 H new ATOM 0 HB3 ASP C 131 34.562 -3.503 -25.912 1.00 0.00 H new ATOM 655 N ASP C 132 32.233 -1.496 -23.150 1.00 0.00 N ATOM 656 CA ASP C 132 31.526 -1.341 -21.825 1.00 0.00 C ATOM 657 C ASP C 132 30.044 -1.092 -22.077 1.00 0.00 C ATOM 658 O ASP C 132 29.177 -1.715 -21.463 1.00 0.00 O ATOM 659 CB ASP C 132 32.140 -0.099 -21.168 1.00 0.00 C ATOM 660 CG ASP C 132 31.641 0.021 -19.737 1.00 0.00 C ATOM 661 OD1 ASP C 132 30.597 0.605 -19.533 1.00 0.00 O1- ATOM 662 OD2 ASP C 132 32.286 -0.497 -18.864 1.00 0.00 O ATOM 0 H ASP C 132 32.952 -0.799 -23.344 1.00 0.00 H new ATOM 0 HA ASP C 132 31.632 -2.227 -21.199 1.00 0.00 H new ATOM 0 HB2 ASP C 132 33.228 -0.169 -21.180 1.00 0.00 H new ATOM 0 HB3 ASP C 132 31.872 0.794 -21.733 1.00 0.00 H new ATOM 667 N ILE C 133 29.740 -0.214 -23.017 1.00 0.00 N ATOM 668 CA ILE C 133 28.308 0.062 -23.351 1.00 0.00 C ATOM 669 C ILE C 133 27.670 -1.218 -23.915 1.00 0.00 C ATOM 670 O ILE C 133 26.581 -1.608 -23.500 1.00 0.00 O ATOM 671 CB ILE C 133 28.328 1.201 -24.414 1.00 0.00 C ATOM 672 CG1 ILE C 133 29.034 2.446 -23.842 1.00 0.00 C ATOM 673 CG2 ILE C 133 26.894 1.592 -24.803 1.00 0.00 C ATOM 674 CD1 ILE C 133 29.120 3.530 -24.916 1.00 0.00 C ATOM 0 H ILE C 133 30.422 0.316 -23.560 1.00 0.00 H new ATOM 0 HA ILE C 133 27.724 0.363 -22.482 1.00 0.00 H new ATOM 0 HB ILE C 133 28.863 0.838 -25.291 1.00 0.00 H new ATOM 0 HG12 ILE C 133 28.487 2.821 -22.977 1.00 0.00 H new ATOM 0 HG13 ILE C 133 30.034 2.182 -23.497 1.00 0.00 H new ATOM 0 HG21 ILE C 133 26.923 2.389 -25.546 1.00 0.00 H new ATOM 0 HG22 ILE C 133 26.381 0.725 -25.220 1.00 0.00 H new ATOM 0 HG23 ILE C 133 26.359 1.940 -23.919 1.00 0.00 H new ATOM 0 HD11 ILE C 133 29.620 4.408 -24.507 1.00 0.00 H new ATOM 0 HD12 ILE C 133 29.686 3.154 -25.768 1.00 0.00 H new ATOM 0 HD13 ILE C 133 28.115 3.802 -25.240 1.00 0.00 H new ATOM 686 N GLU C 134 28.346 -1.894 -24.837 1.00 0.00 N ATOM 687 CA GLU C 134 27.775 -3.152 -25.406 1.00 0.00 C ATOM 688 C GLU C 134 27.555 -4.145 -24.282 1.00 0.00 C ATOM 689 O GLU C 134 26.526 -4.783 -24.226 1.00 0.00 O ATOM 690 CB GLU C 134 28.855 -3.715 -26.360 1.00 0.00 C ATOM 691 CG GLU C 134 28.323 -4.976 -27.059 1.00 0.00 C ATOM 692 CD GLU C 134 29.459 -5.702 -27.745 1.00 0.00 C ATOM 693 OE1 GLU C 134 29.863 -5.275 -28.795 1.00 0.00 O ATOM 694 OE2 GLU C 134 29.899 -6.703 -27.201 1.00 0.00 O1- ATOM 0 H GLU C 134 29.257 -1.623 -25.208 1.00 0.00 H new ATOM 0 HA GLU C 134 26.829 -2.973 -25.917 1.00 0.00 H new ATOM 0 HB2 GLU C 134 29.126 -2.964 -27.102 1.00 0.00 H new ATOM 0 HB3 GLU C 134 29.760 -3.952 -25.801 1.00 0.00 H new ATOM 0 HG2 GLU C 134 27.847 -5.633 -26.331 1.00 0.00 H new ATOM 0 HG3 GLU C 134 27.560 -4.704 -27.789 1.00 0.00 H new ATOM 701 N GLU C 135 28.518 -4.291 -23.378 1.00 0.00 N ATOM 702 CA GLU C 135 28.349 -5.277 -22.265 1.00 0.00 C ATOM 703 C GLU C 135 27.145 -4.859 -21.422 1.00 0.00 C ATOM 704 O GLU C 135 26.291 -5.670 -21.110 1.00 0.00 O ATOM 705 CB GLU C 135 29.652 -5.191 -21.436 1.00 0.00 C ATOM 706 CG GLU C 135 29.841 -6.486 -20.623 1.00 0.00 C ATOM 707 CD GLU C 135 30.294 -7.625 -21.525 1.00 0.00 C ATOM 708 OE1 GLU C 135 31.046 -7.379 -22.459 1.00 0.00 O ATOM 709 OE2 GLU C 135 29.857 -8.709 -21.312 1.00 0.00 O1- ATOM 0 H GLU C 135 29.397 -3.773 -23.372 1.00 0.00 H new ATOM 0 HA GLU C 135 28.177 -6.293 -22.619 1.00 0.00 H new ATOM 0 HB2 GLU C 135 30.505 -5.038 -22.097 1.00 0.00 H new ATOM 0 HB3 GLU C 135 29.611 -4.333 -20.765 1.00 0.00 H new ATOM 0 HG2 GLU C 135 30.578 -6.323 -19.836 1.00 0.00 H new ATOM 0 HG3 GLU C 135 28.905 -6.754 -20.133 1.00 0.00 H new ATOM 716 N LEU C 136 27.030 -3.574 -21.133 1.00 0.00 N ATOM 717 CA LEU C 136 25.846 -3.075 -20.360 1.00 0.00 C ATOM 718 C LEU C 136 24.560 -3.409 -21.131 1.00 0.00 C ATOM 719 O LEU C 136 23.571 -3.782 -20.549 1.00 0.00 O ATOM 720 CB LEU C 136 26.036 -1.538 -20.288 1.00 0.00 C ATOM 721 CG LEU C 136 25.056 -0.932 -19.269 1.00 0.00 C ATOM 722 CD1 LEU C 136 25.593 0.410 -18.771 1.00 0.00 C ATOM 723 CD2 LEU C 136 23.681 -0.724 -19.910 1.00 0.00 C ATOM 0 H LEU C 136 27.705 -2.857 -21.400 1.00 0.00 H new ATOM 0 HA LEU C 136 25.770 -3.525 -19.370 1.00 0.00 H new ATOM 0 HB2 LEU C 136 27.061 -1.303 -20.002 1.00 0.00 H new ATOM 0 HB3 LEU C 136 25.870 -1.097 -21.271 1.00 0.00 H new ATOM 0 HG LEU C 136 24.956 -1.620 -18.430 1.00 0.00 H new ATOM 0 HD11 LEU C 136 24.896 0.836 -18.049 1.00 0.00 H new ATOM 0 HD12 LEU C 136 26.562 0.260 -18.295 1.00 0.00 H new ATOM 0 HD13 LEU C 136 25.705 1.092 -19.614 1.00 0.00 H new ATOM 0 HD21 LEU C 136 22.999 -0.295 -19.176 1.00 0.00 H new ATOM 0 HD22 LEU C 136 23.774 -0.047 -20.759 1.00 0.00 H new ATOM 0 HD23 LEU C 136 23.290 -1.682 -20.252 1.00 0.00 H new ATOM 735 N MET C 137 24.560 -3.231 -22.438 1.00 0.00 N ATOM 736 CA MET C 137 23.314 -3.516 -23.235 1.00 0.00 C ATOM 737 C MET C 137 23.095 -5.024 -23.440 1.00 0.00 C ATOM 738 O MET C 137 22.011 -5.514 -23.225 1.00 0.00 O ATOM 739 CB MET C 137 23.511 -2.821 -24.595 1.00 0.00 C ATOM 740 CG MET C 137 23.523 -1.300 -24.407 1.00 0.00 C ATOM 741 SD MET C 137 23.573 -0.484 -26.027 1.00 0.00 S ATOM 742 CE MET C 137 21.881 -0.874 -26.550 1.00 0.00 C ATOM 0 H MET C 137 25.359 -2.905 -22.982 1.00 0.00 H new ATOM 0 HA MET C 137 22.434 -3.148 -22.707 1.00 0.00 H new ATOM 0 HB2 MET C 137 24.447 -3.148 -25.048 1.00 0.00 H new ATOM 0 HB3 MET C 137 22.710 -3.105 -25.278 1.00 0.00 H new ATOM 0 HG2 MET C 137 22.636 -0.985 -23.857 1.00 0.00 H new ATOM 0 HG3 MET C 137 24.388 -1.004 -23.813 1.00 0.00 H new ATOM 0 HE1 MET C 137 21.487 -0.053 -27.149 1.00 0.00 H new ATOM 0 HE2 MET C 137 21.885 -1.788 -27.145 1.00 0.00 H new ATOM 0 HE3 MET C 137 21.252 -1.016 -25.671 1.00 0.00 H new ATOM 752 N LYS C 138 24.102 -5.758 -23.893 1.00 0.00 N ATOM 753 CA LYS C 138 23.878 -7.228 -24.192 1.00 0.00 C ATOM 754 C LYS C 138 23.586 -8.062 -22.939 1.00 0.00 C ATOM 755 O LYS C 138 23.001 -9.126 -23.044 1.00 0.00 O ATOM 756 CB LYS C 138 25.089 -7.752 -25.004 1.00 0.00 C ATOM 757 CG LYS C 138 26.391 -7.776 -24.180 1.00 0.00 C ATOM 758 CD LYS C 138 27.551 -8.169 -25.111 1.00 0.00 C ATOM 759 CE LYS C 138 28.849 -8.367 -24.313 1.00 0.00 C ATOM 760 NZ LYS C 138 29.689 -7.183 -24.648 1.00 0.00 N1+ ATOM 0 H LYS C 138 25.047 -5.414 -24.065 1.00 0.00 H new ATOM 0 HA LYS C 138 22.974 -7.334 -24.792 1.00 0.00 H new ATOM 0 HB2 LYS C 138 24.873 -8.758 -25.363 1.00 0.00 H new ATOM 0 HB3 LYS C 138 25.231 -7.123 -25.883 1.00 0.00 H new ATOM 0 HG2 LYS C 138 26.576 -6.798 -23.736 1.00 0.00 H new ATOM 0 HG3 LYS C 138 26.307 -8.488 -23.359 1.00 0.00 H new ATOM 0 HD2 LYS C 138 27.302 -9.088 -25.642 1.00 0.00 H new ATOM 0 HD3 LYS C 138 27.697 -7.395 -25.864 1.00 0.00 H new ATOM 0 HE2 LYS C 138 28.650 -8.420 -23.243 1.00 0.00 H new ATOM 0 HE3 LYS C 138 29.346 -9.296 -24.592 1.00 0.00 H new ATOM 0 HZ1 LYS C 138 30.419 -7.057 -23.918 1.00 0.00 H new ATOM 0 HZ2 LYS C 138 30.145 -7.331 -25.571 1.00 0.00 H new ATOM 0 HZ3 LYS C 138 29.091 -6.333 -24.689 1.00 0.00 H new ATOM 774 N ASP C 139 23.967 -7.595 -21.761 1.00 0.00 N ATOM 775 CA ASP C 139 23.651 -8.366 -20.497 1.00 0.00 C ATOM 776 C ASP C 139 22.137 -8.651 -20.416 1.00 0.00 C ATOM 777 O ASP C 139 21.727 -9.715 -19.976 1.00 0.00 O ATOM 778 CB ASP C 139 24.074 -7.443 -19.340 1.00 0.00 C ATOM 779 CG ASP C 139 23.902 -8.160 -18.015 1.00 0.00 C ATOM 780 OD1 ASP C 139 24.732 -8.994 -17.698 1.00 0.00 O1- ATOM 781 OD2 ASP C 139 22.954 -7.868 -17.332 1.00 0.00 O ATOM 0 H ASP C 139 24.477 -6.723 -21.620 1.00 0.00 H new ATOM 0 HA ASP C 139 24.168 -9.325 -20.465 1.00 0.00 H new ATOM 0 HB2 ASP C 139 25.113 -7.140 -19.467 1.00 0.00 H new ATOM 0 HB3 ASP C 139 23.473 -6.533 -19.351 1.00 0.00 H new ATOM 786 N GLY C 140 21.306 -7.732 -20.853 1.00 0.00 N ATOM 787 CA GLY C 140 19.824 -7.968 -20.794 1.00 0.00 C ATOM 788 C GLY C 140 19.117 -7.603 -22.122 1.00 0.00 C ATOM 789 O GLY C 140 17.893 -7.658 -22.193 1.00 0.00 O ATOM 0 H GLY C 140 21.587 -6.834 -21.246 1.00 0.00 H new ATOM 0 HA2 GLY C 140 19.634 -9.016 -20.560 1.00 0.00 H new ATOM 0 HA3 GLY C 140 19.396 -7.378 -19.983 1.00 0.00 H new ATOM 793 N ASP C 141 19.842 -7.250 -23.189 1.00 0.00 N ATOM 794 CA ASP C 141 19.128 -6.932 -24.480 1.00 0.00 C ATOM 795 C ASP C 141 18.786 -8.258 -25.171 1.00 0.00 C ATOM 796 O ASP C 141 19.666 -9.062 -25.468 1.00 0.00 O ATOM 797 CB ASP C 141 20.098 -6.079 -25.340 1.00 0.00 C ATOM 798 CG ASP C 141 19.395 -5.584 -26.600 1.00 0.00 C ATOM 799 OD1 ASP C 141 18.436 -4.836 -26.489 1.00 0.00 O ATOM 800 OD2 ASP C 141 19.802 -5.937 -27.642 1.00 0.00 O1- ATOM 0 H ASP C 141 20.859 -7.173 -23.214 1.00 0.00 H new ATOM 0 HA ASP C 141 18.203 -6.377 -24.322 1.00 0.00 H new ATOM 0 HB2 ASP C 141 20.458 -5.230 -24.759 1.00 0.00 H new ATOM 0 HB3 ASP C 141 20.971 -6.672 -25.612 1.00 0.00 H new ATOM 805 N LYS C 142 17.511 -8.539 -25.329 1.00 0.00 N ATOM 806 CA LYS C 142 17.073 -9.867 -25.879 1.00 0.00 C ATOM 807 C LYS C 142 17.704 -10.172 -27.233 1.00 0.00 C ATOM 808 O LYS C 142 17.363 -9.585 -28.248 1.00 0.00 O ATOM 809 CB LYS C 142 15.540 -9.814 -26.017 1.00 0.00 C ATOM 810 CG LYS C 142 14.876 -9.942 -24.636 1.00 0.00 C ATOM 811 CD LYS C 142 13.349 -10.052 -24.826 1.00 0.00 C ATOM 812 CE LYS C 142 12.654 -10.439 -23.493 1.00 0.00 C ATOM 813 NZ LYS C 142 13.024 -9.389 -22.499 1.00 0.00 N1+ ATOM 0 H LYS C 142 16.749 -7.901 -25.099 1.00 0.00 H new ATOM 0 HA LYS C 142 17.393 -10.660 -25.203 1.00 0.00 H new ATOM 0 HB2 LYS C 142 15.242 -8.876 -26.486 1.00 0.00 H new ATOM 0 HB3 LYS C 142 15.198 -10.618 -26.668 1.00 0.00 H new ATOM 0 HG2 LYS C 142 15.256 -10.821 -24.115 1.00 0.00 H new ATOM 0 HG3 LYS C 142 15.118 -9.076 -24.019 1.00 0.00 H new ATOM 0 HD2 LYS C 142 12.953 -9.102 -25.185 1.00 0.00 H new ATOM 0 HD3 LYS C 142 13.126 -10.799 -25.588 1.00 0.00 H new ATOM 0 HE2 LYS C 142 11.573 -10.488 -23.620 1.00 0.00 H new ATOM 0 HE3 LYS C 142 12.981 -11.423 -23.157 1.00 0.00 H new ATOM 0 HZ1 LYS C 142 12.181 -9.113 -21.956 1.00 0.00 H new ATOM 0 HZ2 LYS C 142 13.746 -9.763 -21.851 1.00 0.00 H new ATOM 0 HZ3 LYS C 142 13.403 -8.558 -22.997 1.00 0.00 H new ATOM 827 N ASN C 143 18.574 -11.151 -27.244 1.00 0.00 N ATOM 828 CA ASN C 143 19.251 -11.633 -28.509 1.00 0.00 C ATOM 829 C ASN C 143 19.884 -10.452 -29.269 1.00 0.00 C ATOM 830 O ASN C 143 19.840 -10.400 -30.495 1.00 0.00 O ATOM 831 CB ASN C 143 18.137 -12.281 -29.358 1.00 0.00 C ATOM 832 CG ASN C 143 18.761 -13.251 -30.363 1.00 0.00 C ATOM 833 OD1 ASN C 143 18.923 -14.413 -30.079 1.00 0.00 O ATOM 834 ND2 ASN C 143 19.155 -12.820 -31.518 1.00 0.00 N ATOM 0 H ASN C 143 18.858 -11.658 -26.406 1.00 0.00 H new ATOM 0 HA ASN C 143 20.054 -12.337 -28.289 1.00 0.00 H new ATOM 0 HB2 ASN C 143 17.435 -12.810 -28.714 1.00 0.00 H new ATOM 0 HB3 ASN C 143 17.571 -11.512 -29.883 1.00 0.00 H new ATOM 0 HD21 ASN C 143 19.597 -13.460 -32.178 1.00 0.00 H new ATOM 0 HD22 ASN C 143 19.023 -11.840 -31.769 1.00 0.00 H new ATOM 841 N ASN C 144 20.471 -9.503 -28.556 1.00 0.00 N ATOM 842 CA ASN C 144 21.119 -8.300 -29.214 1.00 0.00 C ATOM 843 C ASN C 144 20.124 -7.610 -30.182 1.00 0.00 C ATOM 844 O ASN C 144 20.504 -7.187 -31.273 1.00 0.00 O ATOM 845 CB ASN C 144 22.338 -8.848 -29.987 1.00 0.00 C ATOM 846 CG ASN C 144 23.388 -7.738 -30.156 1.00 0.00 C ATOM 847 OD1 ASN C 144 24.466 -7.821 -29.602 1.00 0.00 O ATOM 848 ND2 ASN C 144 23.128 -6.700 -30.888 1.00 0.00 N ATOM 0 H ASN C 144 20.530 -9.509 -27.538 1.00 0.00 H new ATOM 0 HA ASN C 144 21.416 -7.552 -28.479 1.00 0.00 H new ATOM 0 HB2 ASN C 144 22.771 -9.692 -29.451 1.00 0.00 H new ATOM 0 HB3 ASN C 144 22.025 -9.217 -30.964 1.00 0.00 H new ATOM 0 HD21 ASN C 144 23.825 -5.963 -30.994 1.00 0.00 H new ATOM 0 HD22 ASN C 144 22.226 -6.620 -31.358 1.00 0.00 H new ATOM 855 N ASP C 145 18.880 -7.450 -29.777 1.00 0.00 N ATOM 856 CA ASP C 145 17.878 -6.739 -30.649 1.00 0.00 C ATOM 857 C ASP C 145 18.305 -5.262 -30.879 1.00 0.00 C ATOM 858 O ASP C 145 17.966 -4.674 -31.897 1.00 0.00 O ATOM 859 CB ASP C 145 16.489 -6.852 -29.951 1.00 0.00 C ATOM 860 CG ASP C 145 16.473 -6.120 -28.645 1.00 0.00 C ATOM 861 OD1 ASP C 145 16.294 -4.958 -28.627 1.00 0.00 O ATOM 862 OD2 ASP C 145 16.631 -6.712 -27.634 1.00 0.00 O1- ATOM 0 H ASP C 145 18.516 -7.780 -28.883 1.00 0.00 H new ATOM 0 HA ASP C 145 17.823 -7.195 -31.637 1.00 0.00 H new ATOM 0 HB2 ASP C 145 15.717 -6.448 -30.606 1.00 0.00 H new ATOM 0 HB3 ASP C 145 16.248 -7.902 -29.784 1.00 0.00 H new ATOM 867 N GLY C 146 19.040 -4.655 -29.959 1.00 0.00 N ATOM 868 CA GLY C 146 19.525 -3.245 -30.181 1.00 0.00 C ATOM 869 C GLY C 146 19.043 -2.288 -29.091 1.00 0.00 C ATOM 870 O GLY C 146 19.825 -1.540 -28.539 1.00 0.00 O ATOM 0 H GLY C 146 19.321 -5.074 -29.072 1.00 0.00 H new ATOM 0 HA2 GLY C 146 20.615 -3.238 -30.212 1.00 0.00 H new ATOM 0 HA3 GLY C 146 19.177 -2.892 -31.152 1.00 0.00 H new ATOM 874 N ARG C 147 17.770 -2.271 -28.785 1.00 0.00 N ATOM 875 CA ARG C 147 17.261 -1.310 -27.732 1.00 0.00 C ATOM 876 C ARG C 147 16.709 -2.101 -26.558 1.00 0.00 C ATOM 877 O ARG C 147 16.355 -3.278 -26.701 1.00 0.00 O ATOM 878 CB ARG C 147 16.143 -0.497 -28.410 1.00 0.00 C ATOM 879 CG ARG C 147 16.737 0.338 -29.567 1.00 0.00 C ATOM 880 CD ARG C 147 15.659 1.259 -30.172 1.00 0.00 C ATOM 881 NE ARG C 147 15.412 2.321 -29.133 1.00 0.00 N ATOM 882 CZ ARG C 147 14.785 3.418 -29.477 1.00 0.00 C ATOM 883 NH1 ARG C 147 13.470 3.455 -29.431 1.00 0.00 N1+ ATOM 884 NH2 ARG C 147 15.474 4.440 -29.902 1.00 0.00 N ATOM 0 H ARG C 147 17.060 -2.870 -29.208 1.00 0.00 H new ATOM 0 HA ARG C 147 18.046 -0.656 -27.353 1.00 0.00 H new ATOM 0 HB2 ARG C 147 15.372 -1.167 -28.790 1.00 0.00 H new ATOM 0 HB3 ARG C 147 15.665 0.159 -27.683 1.00 0.00 H new ATOM 0 HG2 ARG C 147 17.572 0.936 -29.201 1.00 0.00 H new ATOM 0 HG3 ARG C 147 17.132 -0.325 -30.337 1.00 0.00 H new ATOM 0 HD2 ARG C 147 15.999 1.698 -31.110 1.00 0.00 H new ATOM 0 HD3 ARG C 147 14.747 0.705 -30.392 1.00 0.00 H new ATOM 0 HE ARG C 147 15.729 2.187 -28.173 1.00 0.00 H new ATOM 0 HH11 ARG C 147 12.947 2.633 -29.129 1.00 0.00 H new ATOM 0 HH12 ARG C 147 12.974 4.306 -29.697 1.00 0.00 H new ATOM 0 HH21 ARG C 147 16.490 4.380 -29.964 1.00 0.00 H new ATOM 0 HH22 ARG C 147 14.997 5.300 -30.173 1.00 0.00 H new ATOM 898 N ILE C 148 16.629 -1.524 -25.402 1.00 0.00 N ATOM 899 CA ILE C 148 16.098 -2.303 -24.255 1.00 0.00 C ATOM 900 C ILE C 148 14.687 -1.826 -23.933 1.00 0.00 C ATOM 901 O ILE C 148 14.473 -0.682 -23.552 1.00 0.00 O ATOM 902 CB ILE C 148 17.083 -2.046 -23.079 1.00 0.00 C ATOM 903 CG1 ILE C 148 18.506 -2.460 -23.505 1.00 0.00 C ATOM 904 CG2 ILE C 148 16.675 -2.879 -21.857 1.00 0.00 C ATOM 905 CD1 ILE C 148 19.503 -2.123 -22.399 1.00 0.00 C ATOM 0 H ILE C 148 16.902 -0.563 -25.199 1.00 0.00 H new ATOM 0 HA ILE C 148 16.029 -3.371 -24.462 1.00 0.00 H new ATOM 0 HB ILE C 148 17.057 -0.987 -22.823 1.00 0.00 H new ATOM 0 HG12 ILE C 148 18.534 -3.529 -23.717 1.00 0.00 H new ATOM 0 HG13 ILE C 148 18.783 -1.945 -24.425 1.00 0.00 H new ATOM 0 HG21 ILE C 148 17.371 -2.691 -21.040 1.00 0.00 H new ATOM 0 HG22 ILE C 148 15.668 -2.601 -21.547 1.00 0.00 H new ATOM 0 HG23 ILE C 148 16.695 -3.938 -22.115 1.00 0.00 H new ATOM 0 HD11 ILE C 148 20.505 -2.419 -22.710 1.00 0.00 H new ATOM 0 HD12 ILE C 148 19.485 -1.050 -22.207 1.00 0.00 H new ATOM 0 HD13 ILE C 148 19.232 -2.659 -21.489 1.00 0.00 H new ATOM 917 N ASP C 149 13.741 -2.722 -24.024 1.00 0.00 N ATOM 918 CA ASP C 149 12.331 -2.416 -23.637 1.00 0.00 C ATOM 919 C ASP C 149 12.230 -2.605 -22.141 1.00 0.00 C ATOM 920 O ASP C 149 13.123 -3.208 -21.525 1.00 0.00 O ATOM 921 CB ASP C 149 11.462 -3.474 -24.349 1.00 0.00 C ATOM 922 CG ASP C 149 9.992 -3.185 -24.085 1.00 0.00 C ATOM 923 OD1 ASP C 149 9.443 -2.358 -24.759 1.00 0.00 O ATOM 924 OD2 ASP C 149 9.439 -3.781 -23.187 1.00 0.00 O1- ATOM 0 H ASP C 149 13.889 -3.674 -24.358 1.00 0.00 H new ATOM 0 HA ASP C 149 12.019 -1.407 -23.905 1.00 0.00 H new ATOM 0 HB2 ASP C 149 11.659 -3.460 -25.421 1.00 0.00 H new ATOM 0 HB3 ASP C 149 11.718 -4.471 -23.990 1.00 0.00 H new ATOM 929 N TYR C 150 11.181 -2.136 -21.534 1.00 0.00 N ATOM 930 CA TYR C 150 11.039 -2.344 -20.065 1.00 0.00 C ATOM 931 C TYR C 150 11.127 -3.855 -19.739 1.00 0.00 C ATOM 932 O TYR C 150 11.801 -4.237 -18.793 1.00 0.00 O ATOM 933 CB TYR C 150 9.668 -1.760 -19.672 1.00 0.00 C ATOM 934 CG TYR C 150 9.473 -1.920 -18.183 1.00 0.00 C ATOM 935 CD1 TYR C 150 10.360 -1.312 -17.291 1.00 0.00 C ATOM 936 CD2 TYR C 150 8.429 -2.708 -17.702 1.00 0.00 C ATOM 937 CE1 TYR C 150 10.193 -1.485 -15.921 1.00 0.00 C ATOM 938 CE2 TYR C 150 8.267 -2.883 -16.330 1.00 0.00 C ATOM 939 CZ TYR C 150 9.149 -2.273 -15.441 1.00 0.00 C ATOM 940 OH TYR C 150 8.995 -2.456 -14.096 1.00 0.00 O ATOM 0 H TYR C 150 10.422 -1.623 -21.982 1.00 0.00 H new ATOM 0 HA TYR C 150 11.834 -1.851 -19.505 1.00 0.00 H new ATOM 0 HB2 TYR C 150 9.615 -0.707 -19.947 1.00 0.00 H new ATOM 0 HB3 TYR C 150 8.872 -2.272 -20.213 1.00 0.00 H new ATOM 0 HD1 TYR C 150 11.174 -0.709 -17.665 1.00 0.00 H new ATOM 0 HD2 TYR C 150 7.747 -3.182 -18.392 1.00 0.00 H new ATOM 0 HE1 TYR C 150 10.872 -1.009 -15.230 1.00 0.00 H new ATOM 0 HE2 TYR C 150 7.457 -3.492 -15.955 1.00 0.00 H new ATOM 0 HH TYR C 150 8.219 -3.031 -13.931 1.00 0.00 H new ATOM 950 N ASP C 151 10.516 -4.721 -20.546 1.00 0.00 N ATOM 951 CA ASP C 151 10.642 -6.216 -20.282 1.00 0.00 C ATOM 952 C ASP C 151 12.115 -6.641 -20.339 1.00 0.00 C ATOM 953 O ASP C 151 12.577 -7.383 -19.484 1.00 0.00 O ATOM 954 CB ASP C 151 9.867 -6.925 -21.406 1.00 0.00 C ATOM 955 CG ASP C 151 9.795 -8.419 -21.108 1.00 0.00 C ATOM 956 OD1 ASP C 151 10.706 -9.127 -21.485 1.00 0.00 O1- ATOM 957 OD2 ASP C 151 8.844 -8.839 -20.517 1.00 0.00 O ATOM 0 H ASP C 151 9.950 -4.467 -21.355 1.00 0.00 H new ATOM 0 HA ASP C 151 10.251 -6.471 -19.297 1.00 0.00 H new ATOM 0 HB2 ASP C 151 8.862 -6.510 -21.487 1.00 0.00 H new ATOM 0 HB3 ASP C 151 10.359 -6.757 -22.364 1.00 0.00 H new ATOM 962 N GLU C 152 12.889 -6.119 -21.295 1.00 0.00 N ATOM 963 CA GLU C 152 14.357 -6.469 -21.323 1.00 0.00 C ATOM 964 C GLU C 152 15.001 -5.905 -20.050 1.00 0.00 C ATOM 965 O GLU C 152 15.777 -6.564 -19.389 1.00 0.00 O ATOM 966 CB GLU C 152 14.971 -5.743 -22.552 1.00 0.00 C ATOM 967 CG GLU C 152 14.364 -6.214 -23.911 1.00 0.00 C ATOM 968 CD GLU C 152 15.202 -5.654 -25.063 1.00 0.00 C ATOM 969 OE1 GLU C 152 16.358 -5.588 -24.955 1.00 0.00 O1- ATOM 970 OE2 GLU C 152 14.698 -5.305 -26.056 1.00 0.00 O ATOM 0 H GLU C 152 12.572 -5.487 -22.030 1.00 0.00 H new ATOM 0 HA GLU C 152 14.516 -7.546 -21.381 1.00 0.00 H new ATOM 0 HB2 GLU C 152 14.817 -4.669 -22.446 1.00 0.00 H new ATOM 0 HB3 GLU C 152 16.048 -5.911 -22.565 1.00 0.00 H new ATOM 0 HG2 GLU C 152 14.346 -7.303 -23.956 1.00 0.00 H new ATOM 0 HG3 GLU C 152 13.332 -5.874 -23.998 1.00 0.00 H new ATOM 977 N PHE C 153 14.634 -4.692 -19.694 1.00 0.00 N ATOM 978 CA PHE C 153 15.182 -4.030 -18.469 1.00 0.00 C ATOM 979 C PHE C 153 14.857 -4.858 -17.219 1.00 0.00 C ATOM 980 O PHE C 153 15.720 -5.057 -16.367 1.00 0.00 O ATOM 981 CB PHE C 153 14.487 -2.665 -18.427 1.00 0.00 C ATOM 982 CG PHE C 153 15.097 -1.801 -17.364 1.00 0.00 C ATOM 983 CD1 PHE C 153 16.365 -1.252 -17.561 1.00 0.00 C ATOM 984 CD2 PHE C 153 14.395 -1.541 -16.189 1.00 0.00 C ATOM 985 CE1 PHE C 153 16.932 -0.442 -16.579 1.00 0.00 C ATOM 986 CE2 PHE C 153 14.960 -0.727 -15.205 1.00 0.00 C ATOM 987 CZ PHE C 153 16.230 -0.177 -15.398 1.00 0.00 C ATOM 0 H PHE C 153 13.964 -4.125 -20.214 1.00 0.00 H new ATOM 0 HA PHE C 153 16.267 -3.934 -18.494 1.00 0.00 H new ATOM 0 HB2 PHE C 153 14.574 -2.175 -19.397 1.00 0.00 H new ATOM 0 HB3 PHE C 153 13.423 -2.797 -18.231 1.00 0.00 H new ATOM 0 HD1 PHE C 153 16.906 -1.455 -18.473 1.00 0.00 H new ATOM 0 HD2 PHE C 153 13.415 -1.969 -16.039 1.00 0.00 H new ATOM 0 HE1 PHE C 153 17.914 -0.018 -16.730 1.00 0.00 H new ATOM 0 HE2 PHE C 153 14.416 -0.523 -14.295 1.00 0.00 H new ATOM 0 HZ PHE C 153 16.669 0.451 -14.637 1.00 0.00 H new ATOM 997 N LEU C 154 13.637 -5.373 -17.106 1.00 0.00 N ATOM 998 CA LEU C 154 13.300 -6.223 -15.903 1.00 0.00 C ATOM 999 C LEU C 154 14.252 -7.414 -15.821 1.00 0.00 C ATOM 1000 O LEU C 154 14.655 -7.804 -14.735 1.00 0.00 O ATOM 1001 CB LEU C 154 11.858 -6.742 -16.113 1.00 0.00 C ATOM 1002 CG LEU C 154 10.836 -5.590 -16.094 1.00 0.00 C ATOM 1003 CD1 LEU C 154 9.430 -6.168 -16.271 1.00 0.00 C ATOM 1004 CD2 LEU C 154 10.902 -4.858 -14.747 1.00 0.00 C ATOM 0 H LEU C 154 12.881 -5.244 -17.778 1.00 0.00 H new ATOM 0 HA LEU C 154 13.390 -5.644 -14.984 1.00 0.00 H new ATOM 0 HB2 LEU C 154 11.795 -7.270 -17.064 1.00 0.00 H new ATOM 0 HB3 LEU C 154 11.612 -7.461 -15.332 1.00 0.00 H new ATOM 0 HG LEU C 154 11.064 -4.893 -16.900 1.00 0.00 H new ATOM 0 HD11 LEU C 154 8.700 -5.359 -16.259 1.00 0.00 H new ATOM 0 HD12 LEU C 154 9.371 -6.696 -17.223 1.00 0.00 H new ATOM 0 HD13 LEU C 154 9.217 -6.862 -15.458 1.00 0.00 H new ATOM 0 HD21 LEU C 154 10.177 -4.044 -14.739 1.00 0.00 H new ATOM 0 HD22 LEU C 154 10.673 -5.556 -13.942 1.00 0.00 H new ATOM 0 HD23 LEU C 154 11.904 -4.453 -14.602 1.00 0.00 H new ATOM 1016 N GLU C 155 14.598 -8.017 -16.942 1.00 0.00 N ATOM 1017 CA GLU C 155 15.490 -9.213 -16.880 1.00 0.00 C ATOM 1018 C GLU C 155 16.898 -8.873 -16.363 1.00 0.00 C ATOM 1019 O GLU C 155 17.452 -9.648 -15.610 1.00 0.00 O ATOM 1020 CB GLU C 155 15.513 -9.840 -18.274 1.00 0.00 C ATOM 1021 CG GLU C 155 14.099 -10.350 -18.612 1.00 0.00 C ATOM 1022 CD GLU C 155 14.187 -11.377 -19.698 1.00 0.00 C ATOM 1023 OE1 GLU C 155 14.322 -12.531 -19.368 1.00 0.00 O ATOM 1024 OE2 GLU C 155 14.103 -11.015 -20.837 1.00 0.00 O1- ATOM 0 H GLU C 155 14.304 -7.734 -17.877 1.00 0.00 H new ATOM 0 HA GLU C 155 15.100 -9.929 -16.157 1.00 0.00 H new ATOM 0 HB2 GLU C 155 15.836 -9.106 -19.013 1.00 0.00 H new ATOM 0 HB3 GLU C 155 16.228 -10.662 -18.307 1.00 0.00 H new ATOM 0 HG2 GLU C 155 13.634 -10.781 -17.725 1.00 0.00 H new ATOM 0 HG3 GLU C 155 13.468 -9.521 -18.931 1.00 0.00 H new ATOM 1031 N PHE C 156 17.452 -7.696 -16.690 1.00 0.00 N ATOM 1032 CA PHE C 156 18.827 -7.334 -16.125 1.00 0.00 C ATOM 1033 C PHE C 156 18.769 -7.476 -14.603 1.00 0.00 C ATOM 1034 O PHE C 156 19.528 -8.190 -14.007 1.00 0.00 O ATOM 1035 CB PHE C 156 19.037 -5.824 -16.408 1.00 0.00 C ATOM 1036 CG PHE C 156 19.363 -5.518 -17.847 1.00 0.00 C ATOM 1037 CD1 PHE C 156 18.341 -5.291 -18.769 1.00 0.00 C ATOM 1038 CD2 PHE C 156 20.695 -5.412 -18.249 1.00 0.00 C ATOM 1039 CE1 PHE C 156 18.648 -4.948 -20.086 1.00 0.00 C ATOM 1040 CE2 PHE C 156 20.998 -5.077 -19.564 1.00 0.00 C ATOM 1041 CZ PHE C 156 19.977 -4.846 -20.486 1.00 0.00 C ATOM 0 H PHE C 156 17.029 -6.997 -17.300 1.00 0.00 H new ATOM 0 HA PHE C 156 19.607 -7.961 -16.556 1.00 0.00 H new ATOM 0 HB2 PHE C 156 18.135 -5.281 -16.126 1.00 0.00 H new ATOM 0 HB3 PHE C 156 19.843 -5.453 -15.775 1.00 0.00 H new ATOM 0 HD1 PHE C 156 17.309 -5.381 -18.462 1.00 0.00 H new ATOM 0 HD2 PHE C 156 21.490 -5.590 -17.540 1.00 0.00 H new ATOM 0 HE1 PHE C 156 17.855 -4.762 -20.795 1.00 0.00 H new ATOM 0 HE2 PHE C 156 22.030 -4.995 -19.873 1.00 0.00 H new ATOM 0 HZ PHE C 156 20.217 -4.589 -21.507 1.00 0.00 H new ATOM 1051 N MET C 157 17.825 -6.803 -13.984 1.00 0.00 N ATOM 1052 CA MET C 157 17.664 -6.893 -12.498 1.00 0.00 C ATOM 1053 C MET C 157 17.155 -8.294 -12.094 1.00 0.00 C ATOM 1054 O MET C 157 17.521 -8.807 -11.059 1.00 0.00 O ATOM 1055 CB MET C 157 16.673 -5.775 -12.141 1.00 0.00 C ATOM 1056 CG MET C 157 17.362 -4.411 -12.399 1.00 0.00 C ATOM 1057 SD MET C 157 16.232 -3.055 -12.031 1.00 0.00 S ATOM 1058 CE MET C 157 15.052 -3.381 -13.366 1.00 0.00 C ATOM 0 H MET C 157 17.155 -6.191 -14.450 1.00 0.00 H new ATOM 0 HA MET C 157 18.602 -6.764 -11.959 1.00 0.00 H new ATOM 0 HB2 MET C 157 15.769 -5.863 -12.743 1.00 0.00 H new ATOM 0 HB3 MET C 157 16.370 -5.856 -11.097 1.00 0.00 H new ATOM 0 HG2 MET C 157 18.256 -4.325 -11.781 1.00 0.00 H new ATOM 0 HG3 MET C 157 17.686 -4.351 -13.438 1.00 0.00 H new ATOM 0 HE1 MET C 157 14.340 -2.559 -13.431 1.00 0.00 H new ATOM 0 HE2 MET C 157 15.588 -3.472 -14.311 1.00 0.00 H new ATOM 0 HE3 MET C 157 14.518 -4.309 -13.161 1.00 0.00 H new ATOM 1068 N LYS C 158 16.295 -8.894 -12.894 1.00 0.00 N ATOM 1069 CA LYS C 158 15.729 -10.257 -12.555 1.00 0.00 C ATOM 1070 C LYS C 158 16.854 -11.288 -12.393 1.00 0.00 C ATOM 1071 O LYS C 158 16.749 -12.193 -11.571 1.00 0.00 O ATOM 1072 CB LYS C 158 14.887 -10.652 -13.789 1.00 0.00 C ATOM 1073 CG LYS C 158 14.100 -11.954 -13.518 1.00 0.00 C ATOM 1074 CD LYS C 158 14.448 -13.033 -14.572 1.00 0.00 C ATOM 1075 CE LYS C 158 13.984 -12.607 -15.994 1.00 0.00 C ATOM 1076 NZ LYS C 158 14.892 -13.322 -16.937 1.00 0.00 N1+ ATOM 0 H LYS C 158 15.957 -8.500 -13.772 1.00 0.00 H new ATOM 0 HA LYS C 158 15.160 -10.229 -11.626 1.00 0.00 H new ATOM 0 HB2 LYS C 158 14.195 -9.847 -14.036 1.00 0.00 H new ATOM 0 HB3 LYS C 158 15.539 -10.788 -14.652 1.00 0.00 H new ATOM 0 HG2 LYS C 158 14.333 -12.325 -12.520 1.00 0.00 H new ATOM 0 HG3 LYS C 158 13.030 -11.749 -13.540 1.00 0.00 H new ATOM 0 HD2 LYS C 158 15.524 -13.207 -14.576 1.00 0.00 H new ATOM 0 HD3 LYS C 158 13.974 -13.976 -14.300 1.00 0.00 H new ATOM 0 HE2 LYS C 158 12.943 -12.881 -16.166 1.00 0.00 H new ATOM 0 HE3 LYS C 158 14.055 -11.527 -16.123 1.00 0.00 H new ATOM 0 HZ1 LYS C 158 14.467 -13.335 -17.886 1.00 0.00 H new ATOM 0 HZ2 LYS C 158 15.809 -12.832 -16.975 1.00 0.00 H new ATOM 0 HZ3 LYS C 158 15.035 -14.298 -16.608 1.00 0.00 H new