USER MOD reduce.3.24.130724 H: found=0, std=0, add=1764, rem=0, adj=57 USER MOD reduce.3.24.130724 removed 1766 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: B 20 TYR OH : rot 180:sc= 0.839 USER MOD Set 1.2: B 102 LYS NZ :NH3+ -138:sc= 1.61 (180deg=0.398) USER MOD Set 2.1: A 30 SER OG : rot 92:sc= 1.09 USER MOD Set 2.2: B 97 LYS NZ :NH3+ 164:sc= 0.737 (180deg=0.11) USER MOD Set 3.1: B 69 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: B 70 HIS : no HD1:sc= -1.03 K(o=-1,f=0.054) USER MOD Set 4.1: B 47 ASN : amide:sc= -1.35 K(o=0.91,f=-2.7!) USER MOD Set 4.2: B 48 LYS NZ :NH3+ 156:sc= 2.27 (180deg=1.24) USER MOD Set 5.1: B 42 GLN : amide:sc= -2.23! C(o=-1.1!,f=-5.7!) USER MOD Set 5.2: B 43 ASN : amide:sc= 0.561 K(o=-1.1,f=-11!) USER MOD Set 5.3: B 49 TYR OH : rot 151:sc= 0.584 USER MOD Set 6.1: A 97 LYS NZ :NH3+ 152:sc= 0.903 (180deg=-0.448!) USER MOD Set 6.2: B 30 SER OG : rot 96:sc= 0.811 USER MOD Set 7.1: A 69 THR OG1 : rot 180:sc= 0 USER MOD Set 7.2: A 70 HIS : no HD1:sc= -0.986 K(o=-0.99,f=0.17) USER MOD Set 8.1: A 42 GLN : amide:sc= -2.86! C(o=-2.6!,f=-4.5!) USER MOD Set 8.2: A 43 ASN : amide:sc= -0.0603 K(o=-2.6,f=-13!) USER MOD Set 8.3: A 49 TYR OH : rot 151:sc= 0.337 USER MOD Set 9.1: A 47 ASN : amide:sc= -0.51 K(o=1.8,f=0.87) USER MOD Set 9.2: A 48 LYS NZ :NH3+ 155:sc= 2.35 (180deg=1.06) USER MOD Set10.1: A 20 TYR OH : rot 180:sc= 0.915 USER MOD Set10.2: A 102 LYS NZ :NH3+ -134:sc= 2.03 (180deg=0.837) USER MOD Single : A 25 SER OG : rot -60:sc= -1.77! USER MOD Single : A 28 GLN : amide:sc= -7.84! K(o=-7.8!,f=-0.93) USER MOD Single : A 32 GLN : amide:sc= -0.548 K(o=-0.55,f=-0.002) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 50 SER OG : rot -169:sc= 1.25 USER MOD Single : A 52 THR OG1 : rot 82:sc= -0.223 USER MOD Single : A 59 THR OG1 : rot 180:sc= 0.3 USER MOD Single : A 75 LYS NZ :NH3+ -159:sc= -0.0651 (180deg=-0.433) USER MOD Single : A 76 LYS NZ :NH3+ -164:sc= -0.0239 (180deg=-0.249) USER MOD Single : A 77 LYS NZ :NH3+ -170:sc= -0.0255 (180deg=-0.159) USER MOD Single : A 78 TYR OH : rot 180:sc= -0.153 USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 LYS NZ :NH3+ -172:sc= 0.0103 (180deg=-0.109) USER MOD Single : A 84 SER OG : rot 140:sc= -0.954 USER MOD Single : A 90 GLN : amide:sc= -0.317 X(o=-0.32,f=-0.52) USER MOD Single : A 93 THR OG1 : rot -130:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ -173:sc= 1.3 (180deg=1.12) USER MOD Single : A 100 LYS NZ :NH3+ -161:sc= -0.138 (180deg=-0.619) USER MOD Single : A 104 THR OG1 : rot -170:sc= 0.527 USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= -0.111 USER MOD Single : A 110 LYS NZ :NH3+ -177:sc= 0.216 (180deg=0.13) USER MOD Single : A 111 MET CE :methyl -158:sc= -1.47 (180deg=-3.96!) USER MOD Single : A 112 LYS NZ :NH3+ -177:sc= -2.03! (180deg=-2.23!) USER MOD Single : A 116 ASN : amide:sc= 1.09 K(o=1.1,f=-0.11) USER MOD Single : A 119 MET CE :methyl 161:sc= -0.395 (180deg=-1.78!) USER MOD Single : A 121 SER OG : rot -164:sc= -0.0575 USER MOD Single : A 125 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 25 SER OG : rot -60:sc= -1.56! USER MOD Single : B 28 GLN : amide:sc= -1.77 K(o=-1.8,f=-0.24) USER MOD Single : B 32 GLN : amide:sc= -0.912 K(o=-0.91,f=-0.008) USER MOD Single : B 45 THR OG1 : rot 180:sc= 0 USER MOD Single : B 50 SER OG : rot -171:sc= 1.27 USER MOD Single : B 52 THR OG1 : rot 82:sc= 0.173 USER MOD Single : B 59 THR OG1 : rot 180:sc= 0.195 USER MOD Single : B 75 LYS NZ :NH3+ -162:sc= -0.0245 (180deg=-0.321) USER MOD Single : B 76 LYS NZ :NH3+ -161:sc= -0.0668 (180deg=-0.379) USER MOD Single : B 77 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.078) USER MOD Single : B 78 TYR OH : rot 180:sc= -0.236 USER MOD Single : B 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 82 LYS NZ :NH3+ -117:sc= 0.813 (180deg=-0.868) USER MOD Single : B 84 SER OG : rot 144:sc= -0.801 USER MOD Single : B 90 GLN : amide:sc= -0.22 X(o=-0.22,f=-0.53) USER MOD Single : B 93 THR OG1 : rot -130:sc= 0 USER MOD Single : B 96 LYS NZ :NH3+ 166:sc= 1.28 (180deg=1.17) USER MOD Single : B 100 LYS NZ :NH3+ -158:sc= -0.136 (180deg=-0.577) USER MOD Single : B 104 THR OG1 : rot -168:sc= 0.587 USER MOD Single : B 105 TYR OH : rot 180:sc= 0 USER MOD Single : B 107 SER OG : rot 180:sc= 0.0902 USER MOD Single : B 110 LYS NZ :NH3+ -176:sc= 0.481 (180deg=0.155) USER MOD Single : B 111 MET CE :methyl -160:sc= -1.4 (180deg=-4.04!) USER MOD Single : B 112 LYS NZ :NH3+ 180:sc= -2.51! (180deg=-2.51!) USER MOD Single : B 116 ASN : amide:sc= 1.03 K(o=1,f=-0.13) USER MOD Single : B 119 MET CE :methyl 159:sc= -0.433 (180deg=-1.84!) USER MOD Single : B 121 SER OG : rot -164:sc= -0.107 USER MOD Single : B 125 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 188 N ILE A 14 16.207 -9.375 -0.395 1.00 0.00 N ATOM 189 CA ILE A 14 15.603 -8.060 -0.217 1.00 0.00 C ATOM 190 C ILE A 14 15.413 -7.760 1.273 1.00 0.00 C ATOM 191 O ILE A 14 14.914 -8.605 2.033 1.00 0.00 O ATOM 192 CB ILE A 14 14.226 -7.976 -0.947 1.00 0.00 C ATOM 193 CG1 ILE A 14 14.394 -8.309 -2.439 1.00 0.00 C ATOM 194 CG2 ILE A 14 13.608 -6.585 -0.779 1.00 0.00 C ATOM 195 CD1 ILE A 14 13.093 -8.342 -3.220 1.00 0.00 C ATOM 0 HA ILE A 14 16.275 -7.320 -0.652 1.00 0.00 H new ATOM 0 HB ILE A 14 13.553 -8.706 -0.497 1.00 0.00 H new ATOM 0 HG12 ILE A 14 15.058 -7.572 -2.892 1.00 0.00 H new ATOM 0 HG13 ILE A 14 14.884 -9.278 -2.530 1.00 0.00 H new ATOM 0 HG21 ILE A 14 12.649 -6.548 -1.295 1.00 0.00 H new ATOM 0 HG22 ILE A 14 13.458 -6.379 0.281 1.00 0.00 H new ATOM 0 HG23 ILE A 14 14.277 -5.836 -1.203 1.00 0.00 H new ATOM 0 HD11 ILE A 14 13.300 -8.584 -4.262 1.00 0.00 H new ATOM 0 HD12 ILE A 14 12.433 -9.099 -2.796 1.00 0.00 H new ATOM 0 HD13 ILE A 14 12.610 -7.367 -3.163 1.00 0.00 H new ATOM 207 N ARG A 15 15.855 -6.601 1.696 1.00 0.00 N ATOM 208 CA ARG A 15 15.712 -6.198 3.060 1.00 0.00 C ATOM 209 C ARG A 15 14.800 -4.989 3.074 1.00 0.00 C ATOM 210 O ARG A 15 14.876 -4.143 2.168 1.00 0.00 O ATOM 211 CB ARG A 15 17.080 -5.774 3.648 1.00 0.00 C ATOM 212 CG ARG A 15 18.239 -6.750 3.425 1.00 0.00 C ATOM 213 CD ARG A 15 18.014 -8.087 4.094 1.00 0.00 C ATOM 214 NE ARG A 15 19.138 -9.007 3.869 1.00 0.00 N ATOM 215 CZ ARG A 15 19.384 -10.119 4.586 1.00 0.00 C ATOM 216 NH1 ARG A 15 18.553 -10.493 5.562 1.00 0.00 N1+ ATOM 217 NH2 ARG A 15 20.457 -10.850 4.327 1.00 0.00 N ATOM 0 H ARG A 15 16.322 -5.917 1.101 1.00 0.00 H new ATOM 0 HA ARG A 15 15.314 -7.023 3.650 1.00 0.00 H new ATOM 0 HB2 ARG A 15 17.355 -4.811 3.218 1.00 0.00 H new ATOM 0 HB3 ARG A 15 16.961 -5.622 4.721 1.00 0.00 H new ATOM 0 HG2 ARG A 15 18.379 -6.903 2.355 1.00 0.00 H new ATOM 0 HG3 ARG A 15 19.159 -6.308 3.807 1.00 0.00 H new ATOM 0 HD2 ARG A 15 17.875 -7.939 5.165 1.00 0.00 H new ATOM 0 HD3 ARG A 15 17.096 -8.534 3.712 1.00 0.00 H new ATOM 0 HE ARG A 15 19.782 -8.785 3.110 1.00 0.00 H new ATOM 0 HH11 ARG A 15 17.725 -9.935 5.769 1.00 0.00 H new ATOM 0 HH12 ARG A 15 18.746 -11.337 6.101 1.00 0.00 H new ATOM 0 HH21 ARG A 15 21.097 -10.570 3.584 1.00 0.00 H new ATOM 0 HH22 ARG A 15 20.643 -11.693 4.871 1.00 0.00 H new ATOM 231 N ARG A 16 13.890 -4.922 4.020 1.00 0.00 N ATOM 232 CA ARG A 16 13.140 -3.694 4.189 1.00 0.00 C ATOM 233 C ARG A 16 14.109 -2.578 4.542 1.00 0.00 C ATOM 234 O ARG A 16 15.034 -2.771 5.343 1.00 0.00 O ATOM 235 CB ARG A 16 12.021 -3.811 5.233 1.00 0.00 C ATOM 236 CG ARG A 16 12.456 -4.227 6.628 1.00 0.00 C ATOM 237 CD ARG A 16 11.272 -4.243 7.589 1.00 0.00 C ATOM 238 NE ARG A 16 10.701 -2.898 7.814 1.00 0.00 N ATOM 239 CZ ARG A 16 9.387 -2.587 7.732 1.00 0.00 C ATOM 240 NH1 ARG A 16 8.538 -3.451 7.202 1.00 0.00 N1+ ATOM 241 NH2 ARG A 16 8.960 -1.383 8.107 1.00 0.00 N ATOM 0 H ARG A 16 13.655 -5.676 4.666 1.00 0.00 H new ATOM 0 HA ARG A 16 12.636 -3.470 3.249 1.00 0.00 H new ATOM 0 HB2 ARG A 16 11.514 -2.849 5.303 1.00 0.00 H new ATOM 0 HB3 ARG A 16 11.288 -4.532 4.872 1.00 0.00 H new ATOM 0 HG2 ARG A 16 12.912 -5.217 6.591 1.00 0.00 H new ATOM 0 HG3 ARG A 16 13.218 -3.539 6.995 1.00 0.00 H new ATOM 0 HD2 ARG A 16 10.498 -4.900 7.194 1.00 0.00 H new ATOM 0 HD3 ARG A 16 11.590 -4.663 8.544 1.00 0.00 H new ATOM 0 HE ARG A 16 11.348 -2.146 8.049 1.00 0.00 H new ATOM 0 HH11 ARG A 16 8.874 -4.350 6.856 1.00 0.00 H new ATOM 0 HH12 ARG A 16 7.547 -3.219 7.139 1.00 0.00 H new ATOM 0 HH21 ARG A 16 9.624 -0.693 8.457 1.00 0.00 H new ATOM 0 HH22 ARG A 16 7.969 -1.151 8.044 1.00 0.00 H new ATOM 255 N GLY A 17 13.944 -1.456 3.911 1.00 0.00 N ATOM 256 CA GLY A 17 14.856 -0.372 4.118 1.00 0.00 C ATOM 257 C GLY A 17 15.742 -0.150 2.921 1.00 0.00 C ATOM 258 O GLY A 17 16.416 0.865 2.837 1.00 0.00 O ATOM 0 H GLY A 17 13.190 -1.267 3.251 1.00 0.00 H new ATOM 0 HA2 GLY A 17 14.296 0.539 4.329 1.00 0.00 H new ATOM 0 HA3 GLY A 17 15.472 -0.578 4.993 1.00 0.00 H new ATOM 262 N ASP A 18 15.752 -1.101 1.996 1.00 0.00 N ATOM 263 CA ASP A 18 16.513 -0.974 0.793 1.00 0.00 C ATOM 264 C ASP A 18 15.823 -0.073 -0.186 1.00 0.00 C ATOM 265 O ASP A 18 14.625 0.262 -0.062 1.00 0.00 O ATOM 266 CB ASP A 18 16.735 -2.308 0.075 1.00 0.00 C ATOM 267 CG ASP A 18 17.880 -3.169 0.570 1.00 0.00 C ATOM 268 OD1 ASP A 18 19.051 -2.738 0.481 1.00 0.00 O1- ATOM 269 OD2 ASP A 18 17.647 -4.326 0.959 1.00 0.00 O ATOM 0 H ASP A 18 15.229 -1.974 2.072 1.00 0.00 H new ATOM 0 HA ASP A 18 17.473 -0.567 1.111 1.00 0.00 H new ATOM 0 HB2 ASP A 18 15.816 -2.890 0.148 1.00 0.00 H new ATOM 0 HB3 ASP A 18 16.898 -2.101 -0.983 1.00 0.00 H new ATOM 274 N VAL A 19 16.577 0.279 -1.143 1.00 0.00 N ATOM 275 CA VAL A 19 16.181 1.089 -2.266 1.00 0.00 C ATOM 276 C VAL A 19 16.638 0.407 -3.558 1.00 0.00 C ATOM 277 O VAL A 19 17.805 0.115 -3.732 1.00 0.00 O ATOM 278 CB VAL A 19 16.808 2.508 -2.162 1.00 0.00 C ATOM 279 CG1 VAL A 19 16.684 3.269 -3.413 1.00 0.00 C ATOM 280 CG2 VAL A 19 16.088 3.322 -1.206 1.00 0.00 C ATOM 0 H VAL A 19 17.558 0.002 -1.187 1.00 0.00 H new ATOM 0 HA VAL A 19 15.096 1.195 -2.269 1.00 0.00 H new ATOM 0 HB VAL A 19 17.849 2.331 -1.890 1.00 0.00 H new ATOM 0 HG11 VAL A 19 17.137 4.252 -3.287 1.00 0.00 H new ATOM 0 HG12 VAL A 19 17.193 2.735 -4.216 1.00 0.00 H new ATOM 0 HG13 VAL A 19 15.630 3.385 -3.665 1.00 0.00 H new ATOM 0 HG21 VAL A 19 16.546 4.310 -1.151 1.00 0.00 H new ATOM 0 HG22 VAL A 19 15.049 3.420 -1.521 1.00 0.00 H new ATOM 0 HG23 VAL A 19 16.126 2.850 -0.224 1.00 0.00 H new ATOM 290 N TYR A 20 15.706 0.152 -4.402 1.00 0.00 N ATOM 291 CA TYR A 20 15.884 -0.464 -5.710 1.00 0.00 C ATOM 292 C TYR A 20 15.221 0.338 -6.755 1.00 0.00 C ATOM 293 O TYR A 20 14.247 1.013 -6.492 1.00 0.00 O ATOM 294 CB TYR A 20 15.283 -1.882 -5.769 1.00 0.00 C ATOM 295 CG TYR A 20 16.015 -2.886 -4.968 1.00 0.00 C ATOM 296 CD1 TYR A 20 17.051 -3.600 -5.520 1.00 0.00 C ATOM 297 CD2 TYR A 20 15.696 -3.105 -3.662 1.00 0.00 C ATOM 298 CE1 TYR A 20 17.762 -4.496 -4.782 1.00 0.00 C ATOM 299 CE2 TYR A 20 16.382 -4.003 -2.920 1.00 0.00 C ATOM 300 CZ TYR A 20 17.425 -4.702 -3.482 1.00 0.00 C ATOM 301 OH TYR A 20 18.166 -5.569 -2.731 1.00 0.00 O ATOM 0 H TYR A 20 14.730 0.373 -4.207 1.00 0.00 H new ATOM 0 HA TYR A 20 16.960 -0.516 -5.879 1.00 0.00 H new ATOM 0 HB2 TYR A 20 14.250 -1.841 -5.423 1.00 0.00 H new ATOM 0 HB3 TYR A 20 15.258 -2.211 -6.808 1.00 0.00 H new ATOM 0 HD1 TYR A 20 17.306 -3.448 -6.558 1.00 0.00 H new ATOM 0 HD2 TYR A 20 14.883 -2.553 -3.213 1.00 0.00 H new ATOM 0 HE1 TYR A 20 18.585 -5.037 -5.225 1.00 0.00 H new ATOM 0 HE2 TYR A 20 16.112 -4.171 -1.888 1.00 0.00 H new ATOM 0 HH TYR A 20 17.802 -5.608 -1.822 1.00 0.00 H new ATOM 311 N LEU A 21 15.789 0.325 -7.923 1.00 0.00 N ATOM 312 CA LEU A 21 15.119 0.821 -9.042 1.00 0.00 C ATOM 313 C LEU A 21 14.147 -0.196 -9.444 1.00 0.00 C ATOM 314 O LEU A 21 14.392 -1.412 -9.286 1.00 0.00 O ATOM 315 CB LEU A 21 16.011 1.127 -10.219 1.00 0.00 C ATOM 316 CG LEU A 21 16.902 2.346 -10.156 1.00 0.00 C ATOM 317 CD1 LEU A 21 18.350 1.931 -9.999 1.00 0.00 C ATOM 318 CD2 LEU A 21 16.716 3.202 -11.401 1.00 0.00 C ATOM 0 H LEU A 21 16.727 -0.032 -8.106 1.00 0.00 H new ATOM 0 HA LEU A 21 14.663 1.770 -8.759 1.00 0.00 H new ATOM 0 HB2 LEU A 21 16.649 0.259 -10.385 1.00 0.00 H new ATOM 0 HB3 LEU A 21 15.375 1.227 -11.099 1.00 0.00 H new ATOM 0 HG LEU A 21 16.621 2.942 -9.287 1.00 0.00 H new ATOM 0 HD11 LEU A 21 18.980 2.819 -9.955 1.00 0.00 H new ATOM 0 HD12 LEU A 21 18.466 1.357 -9.079 1.00 0.00 H new ATOM 0 HD13 LEU A 21 18.647 1.317 -10.849 1.00 0.00 H new ATOM 0 HD21 LEU A 21 17.364 4.076 -11.342 1.00 0.00 H new ATOM 0 HD22 LEU A 21 16.973 2.619 -12.285 1.00 0.00 H new ATOM 0 HD23 LEU A 21 15.677 3.524 -11.469 1.00 0.00 H new ATOM 330 N ALA A 22 13.097 0.248 -9.961 1.00 0.00 N ATOM 331 CA ALA A 22 12.062 -0.627 -10.308 1.00 0.00 C ATOM 332 C ALA A 22 11.456 -0.241 -11.598 1.00 0.00 C ATOM 333 O ALA A 22 11.382 0.944 -11.941 1.00 0.00 O ATOM 334 CB ALA A 22 11.009 -0.670 -9.213 1.00 0.00 C ATOM 0 H ALA A 22 12.918 1.232 -10.161 1.00 0.00 H new ATOM 0 HA ALA A 22 12.485 -1.626 -10.418 1.00 0.00 H new ATOM 0 HB1 ALA A 22 10.212 -1.356 -9.501 1.00 0.00 H new ATOM 0 HB2 ALA A 22 11.464 -1.012 -8.284 1.00 0.00 H new ATOM 0 HB3 ALA A 22 10.594 0.327 -9.068 1.00 0.00 H new ATOM 340 N ASP A 23 11.036 -1.236 -12.311 1.00 0.00 N ATOM 341 CA ASP A 23 10.284 -1.090 -13.535 1.00 0.00 C ATOM 342 C ASP A 23 8.872 -0.930 -13.086 1.00 0.00 C ATOM 343 O ASP A 23 8.057 -1.836 -13.090 1.00 0.00 O ATOM 344 CB ASP A 23 10.458 -2.303 -14.457 1.00 0.00 C ATOM 345 CG ASP A 23 9.693 -2.169 -15.750 1.00 0.00 C ATOM 346 OD1 ASP A 23 9.952 -1.206 -16.504 1.00 0.00 O1- ATOM 347 OD2 ASP A 23 8.841 -3.017 -16.039 1.00 0.00 O ATOM 0 H ASP A 23 11.208 -2.209 -12.057 1.00 0.00 H new ATOM 0 HA ASP A 23 10.623 -0.241 -14.128 1.00 0.00 H new ATOM 0 HB2 ASP A 23 11.517 -2.436 -14.679 1.00 0.00 H new ATOM 0 HB3 ASP A 23 10.126 -3.201 -13.935 1.00 0.00 H new ATOM 352 N LEU A 24 8.671 0.211 -12.554 1.00 0.00 N ATOM 353 CA LEU A 24 7.549 0.558 -11.822 1.00 0.00 C ATOM 354 C LEU A 24 6.391 0.820 -12.734 1.00 0.00 C ATOM 355 O LEU A 24 5.241 0.482 -12.401 1.00 0.00 O ATOM 356 CB LEU A 24 7.957 1.825 -11.062 1.00 0.00 C ATOM 357 CG LEU A 24 7.158 2.360 -9.875 1.00 0.00 C ATOM 358 CD1 LEU A 24 7.845 3.608 -9.399 1.00 0.00 C ATOM 359 CD2 LEU A 24 5.747 2.689 -10.248 1.00 0.00 C ATOM 0 H LEU A 24 9.344 0.974 -12.632 1.00 0.00 H new ATOM 0 HA LEU A 24 7.229 -0.234 -11.145 1.00 0.00 H new ATOM 0 HB2 LEU A 24 8.974 1.662 -10.706 1.00 0.00 H new ATOM 0 HB3 LEU A 24 8.002 2.629 -11.796 1.00 0.00 H new ATOM 0 HG LEU A 24 7.117 1.595 -9.100 1.00 0.00 H new ATOM 0 HD11 LEU A 24 7.302 4.021 -8.549 1.00 0.00 H new ATOM 0 HD12 LEU A 24 8.865 3.369 -9.097 1.00 0.00 H new ATOM 0 HD13 LEU A 24 7.868 4.341 -10.205 1.00 0.00 H new ATOM 0 HD21 LEU A 24 5.218 3.066 -9.373 1.00 0.00 H new ATOM 0 HD22 LEU A 24 5.745 3.450 -11.029 1.00 0.00 H new ATOM 0 HD23 LEU A 24 5.249 1.792 -10.615 1.00 0.00 H new ATOM 371 N SER A 25 6.642 1.408 -13.878 1.00 0.00 N ATOM 372 CA SER A 25 5.546 1.875 -14.609 1.00 0.00 C ATOM 373 C SER A 25 5.234 1.361 -15.961 1.00 0.00 C ATOM 374 O SER A 25 6.004 1.490 -16.907 1.00 0.00 O ATOM 375 CB SER A 25 5.495 3.337 -14.611 1.00 0.00 C ATOM 376 OG SER A 25 5.234 3.789 -13.313 1.00 0.00 O ATOM 0 H SER A 25 7.563 1.559 -14.290 1.00 0.00 H new ATOM 0 HA SER A 25 4.751 1.405 -14.030 1.00 0.00 H new ATOM 0 HB2 SER A 25 6.440 3.745 -14.968 1.00 0.00 H new ATOM 0 HB3 SER A 25 4.719 3.685 -15.293 1.00 0.00 H new ATOM 0 HG SER A 25 4.374 3.432 -13.009 1.00 0.00 H new ATOM 382 N PRO A 26 4.096 0.705 -16.022 1.00 0.00 N ATOM 383 CA PRO A 26 3.305 0.612 -17.196 1.00 0.00 C ATOM 384 C PRO A 26 2.067 1.535 -16.956 1.00 0.00 C ATOM 385 O PRO A 26 0.982 1.300 -17.492 1.00 0.00 O ATOM 386 CB PRO A 26 2.861 -0.855 -17.183 1.00 0.00 C ATOM 387 CG PRO A 26 3.150 -1.371 -15.798 1.00 0.00 C ATOM 388 CD PRO A 26 3.551 -0.182 -14.985 1.00 0.00 C ATOM 0 HA PRO A 26 3.798 0.895 -18.126 1.00 0.00 H new ATOM 0 HB2 PRO A 26 1.800 -0.942 -17.417 1.00 0.00 H new ATOM 0 HB3 PRO A 26 3.402 -1.432 -17.934 1.00 0.00 H new ATOM 0 HG2 PRO A 26 2.271 -1.855 -15.372 1.00 0.00 H new ATOM 0 HG3 PRO A 26 3.946 -2.115 -15.818 1.00 0.00 H new ATOM 0 HD2 PRO A 26 2.704 0.265 -14.465 1.00 0.00 H new ATOM 0 HD3 PRO A 26 4.293 -0.433 -14.227 1.00 0.00 H new ATOM 396 N VAL A 27 2.268 2.587 -16.107 1.00 0.00 N ATOM 397 CA VAL A 27 1.189 3.493 -15.669 1.00 0.00 C ATOM 398 C VAL A 27 0.994 4.646 -16.590 1.00 0.00 C ATOM 399 O VAL A 27 1.871 5.019 -17.368 1.00 0.00 O ATOM 400 CB VAL A 27 1.369 4.115 -14.243 1.00 0.00 C ATOM 401 CG1 VAL A 27 1.491 3.099 -13.165 1.00 0.00 C ATOM 402 CG2 VAL A 27 2.482 5.155 -14.169 1.00 0.00 C ATOM 0 H VAL A 27 3.181 2.820 -15.716 1.00 0.00 H new ATOM 0 HA VAL A 27 0.329 2.823 -15.663 1.00 0.00 H new ATOM 0 HB VAL A 27 0.436 4.649 -14.060 1.00 0.00 H new ATOM 0 HG11 VAL A 27 1.613 3.600 -12.205 1.00 0.00 H new ATOM 0 HG12 VAL A 27 0.592 2.484 -13.141 1.00 0.00 H new ATOM 0 HG13 VAL A 27 2.358 2.467 -13.357 1.00 0.00 H new ATOM 0 HG21 VAL A 27 2.550 5.543 -13.153 1.00 0.00 H new ATOM 0 HG22 VAL A 27 3.430 4.694 -14.445 1.00 0.00 H new ATOM 0 HG23 VAL A 27 2.262 5.972 -14.856 1.00 0.00 H new ATOM 412 N GLN A 28 -0.183 5.183 -16.489 1.00 0.00 N ATOM 413 CA GLN A 28 -0.593 6.349 -17.188 1.00 0.00 C ATOM 414 C GLN A 28 -1.650 7.023 -16.361 1.00 0.00 C ATOM 415 O GLN A 28 -2.251 6.367 -15.525 1.00 0.00 O ATOM 416 CB GLN A 28 -1.087 6.106 -18.648 1.00 0.00 C ATOM 417 CG GLN A 28 -2.199 5.063 -18.828 1.00 0.00 C ATOM 418 CD GLN A 28 -1.743 3.666 -19.087 1.00 0.00 C ATOM 419 OE1 GLN A 28 -2.353 2.933 -19.869 1.00 0.00 O ATOM 420 NE2 GLN A 28 -0.849 3.229 -18.344 1.00 0.00 N ATOM 0 H GLN A 28 -0.912 4.798 -15.888 1.00 0.00 H new ATOM 0 HA GLN A 28 0.285 6.982 -17.317 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -1.440 7.055 -19.051 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -0.232 5.801 -19.252 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -2.819 5.062 -17.932 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -2.835 5.377 -19.656 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -0.362 3.859 -17.707 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -0.602 2.240 -18.371 1.00 0.00 H new ATOM 429 N GLY A 29 -1.830 8.301 -16.529 1.00 0.00 N ATOM 430 CA GLY A 29 -2.843 8.985 -15.815 1.00 0.00 C ATOM 431 C GLY A 29 -2.243 9.805 -14.732 1.00 0.00 C ATOM 432 O GLY A 29 -1.269 10.523 -14.963 1.00 0.00 O ATOM 0 H GLY A 29 -1.280 8.884 -17.160 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -3.408 9.624 -16.494 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -3.546 8.268 -15.391 1.00 0.00 H new ATOM 436 N SER A 30 -2.765 9.688 -13.556 1.00 0.00 N ATOM 437 CA SER A 30 -2.264 10.453 -12.458 1.00 0.00 C ATOM 438 C SER A 30 -1.225 9.665 -11.682 1.00 0.00 C ATOM 439 O SER A 30 -0.579 10.213 -10.766 1.00 0.00 O ATOM 440 CB SER A 30 -3.397 10.839 -11.555 1.00 0.00 C ATOM 441 OG SER A 30 -4.499 11.307 -12.320 1.00 0.00 O ATOM 0 H SER A 30 -3.542 9.068 -13.328 1.00 0.00 H new ATOM 0 HA SER A 30 -1.788 11.353 -12.848 1.00 0.00 H new ATOM 0 HB2 SER A 30 -3.700 9.982 -10.954 1.00 0.00 H new ATOM 0 HB3 SER A 30 -3.071 11.615 -10.862 1.00 0.00 H new ATOM 0 HG SER A 30 -5.097 10.558 -12.524 1.00 0.00 H new ATOM 447 N GLU A 31 -1.059 8.379 -12.015 1.00 0.00 N ATOM 448 CA GLU A 31 -0.078 7.584 -11.320 1.00 0.00 C ATOM 449 C GLU A 31 1.330 8.020 -11.713 1.00 0.00 C ATOM 450 O GLU A 31 1.545 8.573 -12.800 1.00 0.00 O ATOM 451 CB GLU A 31 -0.285 6.088 -11.523 1.00 0.00 C ATOM 452 CG GLU A 31 -1.658 5.578 -11.101 1.00 0.00 C ATOM 453 CD GLU A 31 -2.635 5.472 -12.252 1.00 0.00 C ATOM 454 OE1 GLU A 31 -2.685 4.390 -12.876 1.00 0.00 O ATOM 455 OE2 GLU A 31 -3.369 6.451 -12.538 1.00 0.00 O1- ATOM 0 H GLU A 31 -1.582 7.891 -12.742 1.00 0.00 H new ATOM 0 HA GLU A 31 -0.208 7.761 -10.252 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -0.131 5.852 -12.576 1.00 0.00 H new ATOM 0 HB3 GLU A 31 0.478 5.549 -10.961 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -1.547 4.599 -10.636 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -2.069 6.246 -10.344 1.00 0.00 H new ATOM 462 N GLN A 32 2.273 7.761 -10.859 1.00 0.00 N ATOM 463 CA GLN A 32 3.596 8.254 -11.012 1.00 0.00 C ATOM 464 C GLN A 32 4.553 7.147 -10.767 1.00 0.00 C ATOM 465 O GLN A 32 4.495 6.476 -9.741 1.00 0.00 O ATOM 466 CB GLN A 32 3.792 9.451 -10.037 1.00 0.00 C ATOM 467 CG GLN A 32 5.232 9.899 -9.688 1.00 0.00 C ATOM 468 CD GLN A 32 6.134 10.187 -10.870 1.00 0.00 C ATOM 469 OE1 GLN A 32 6.143 11.291 -11.417 1.00 0.00 O ATOM 470 NE2 GLN A 32 6.970 9.239 -11.183 1.00 0.00 N ATOM 0 H GLN A 32 2.136 7.191 -10.024 1.00 0.00 H new ATOM 0 HA GLN A 32 3.777 8.618 -12.023 1.00 0.00 H new ATOM 0 HB2 GLN A 32 3.272 10.310 -10.461 1.00 0.00 H new ATOM 0 HB3 GLN A 32 3.288 9.202 -9.103 1.00 0.00 H new ATOM 0 HG2 GLN A 32 5.175 10.796 -9.071 1.00 0.00 H new ATOM 0 HG3 GLN A 32 5.697 9.123 -9.080 1.00 0.00 H new ATOM 0 HE21 GLN A 32 6.925 8.340 -10.703 1.00 0.00 H new ATOM 0 HE22 GLN A 32 7.670 9.395 -11.908 1.00 0.00 H new ATOM 479 N GLY A 33 5.338 6.866 -11.747 1.00 0.00 N ATOM 480 CA GLY A 33 6.363 5.946 -11.548 1.00 0.00 C ATOM 481 C GLY A 33 7.506 6.111 -12.489 1.00 0.00 C ATOM 482 O GLY A 33 8.397 6.928 -12.275 1.00 0.00 O ATOM 0 H GLY A 33 5.278 7.266 -12.684 1.00 0.00 H new ATOM 0 HA2 GLY A 33 6.729 6.039 -10.526 1.00 0.00 H new ATOM 0 HA3 GLY A 33 5.960 4.938 -11.652 1.00 0.00 H new ATOM 486 N GLY A 34 7.441 5.369 -13.539 1.00 0.00 N ATOM 487 CA GLY A 34 8.527 5.252 -14.476 1.00 0.00 C ATOM 488 C GLY A 34 9.535 4.296 -13.896 1.00 0.00 C ATOM 489 O GLY A 34 9.357 3.845 -12.768 1.00 0.00 O ATOM 0 H GLY A 34 6.622 4.813 -13.784 1.00 0.00 H new ATOM 0 HA2 GLY A 34 8.164 4.888 -15.437 1.00 0.00 H new ATOM 0 HA3 GLY A 34 8.983 6.226 -14.655 1.00 0.00 H new ATOM 493 N VAL A 35 10.537 3.922 -14.622 1.00 0.00 N ATOM 494 CA VAL A 35 11.568 3.157 -14.021 1.00 0.00 C ATOM 495 C VAL A 35 12.401 4.119 -13.175 1.00 0.00 C ATOM 496 O VAL A 35 13.154 4.964 -13.665 1.00 0.00 O ATOM 497 CB VAL A 35 12.382 2.356 -15.043 1.00 0.00 C ATOM 498 CG1 VAL A 35 12.887 3.249 -16.114 1.00 0.00 C ATOM 499 CG2 VAL A 35 13.507 1.627 -14.375 1.00 0.00 C ATOM 0 H VAL A 35 10.660 4.131 -15.613 1.00 0.00 H new ATOM 0 HA VAL A 35 11.150 2.383 -13.378 1.00 0.00 H new ATOM 0 HB VAL A 35 11.728 1.612 -15.499 1.00 0.00 H new ATOM 0 HG11 VAL A 35 13.463 2.666 -16.832 1.00 0.00 H new ATOM 0 HG12 VAL A 35 12.045 3.721 -16.621 1.00 0.00 H new ATOM 0 HG13 VAL A 35 13.524 4.018 -15.677 1.00 0.00 H new ATOM 0 HG21 VAL A 35 14.070 1.066 -15.120 1.00 0.00 H new ATOM 0 HG22 VAL A 35 14.166 2.345 -13.886 1.00 0.00 H new ATOM 0 HG23 VAL A 35 13.104 0.939 -13.631 1.00 0.00 H new ATOM 509 N ARG A 36 12.159 4.040 -11.938 1.00 0.00 N ATOM 510 CA ARG A 36 12.619 4.989 -10.977 1.00 0.00 C ATOM 511 C ARG A 36 12.939 4.234 -9.682 1.00 0.00 C ATOM 512 O ARG A 36 12.429 3.123 -9.492 1.00 0.00 O ATOM 513 CB ARG A 36 11.432 5.944 -10.744 1.00 0.00 C ATOM 514 CG ARG A 36 11.791 7.329 -10.296 1.00 0.00 C ATOM 515 CD ARG A 36 10.540 8.183 -10.106 1.00 0.00 C ATOM 516 NE ARG A 36 10.846 9.615 -9.934 1.00 0.00 N ATOM 517 CZ ARG A 36 10.094 10.506 -9.259 1.00 0.00 C ATOM 518 NH1 ARG A 36 9.047 10.089 -8.525 1.00 0.00 N1+ ATOM 519 NH2 ARG A 36 10.422 11.805 -9.289 1.00 0.00 N ATOM 0 H ARG A 36 11.611 3.283 -11.529 1.00 0.00 H new ATOM 0 HA ARG A 36 13.508 5.530 -11.301 1.00 0.00 H new ATOM 0 HB2 ARG A 36 10.861 6.018 -11.670 1.00 0.00 H new ATOM 0 HB3 ARG A 36 10.773 5.500 -9.998 1.00 0.00 H new ATOM 0 HG2 ARG A 36 12.348 7.280 -9.360 1.00 0.00 H new ATOM 0 HG3 ARG A 36 12.446 7.795 -11.032 1.00 0.00 H new ATOM 0 HD2 ARG A 36 9.885 8.057 -10.968 1.00 0.00 H new ATOM 0 HD3 ARG A 36 9.991 7.826 -9.234 1.00 0.00 H new ATOM 0 HE ARG A 36 11.703 9.962 -10.364 1.00 0.00 H new ATOM 0 HH11 ARG A 36 8.820 9.096 -8.478 1.00 0.00 H new ATOM 0 HH12 ARG A 36 8.480 10.766 -8.015 1.00 0.00 H new ATOM 0 HH21 ARG A 36 11.236 12.113 -9.820 1.00 0.00 H new ATOM 0 HH22 ARG A 36 9.857 12.485 -8.780 1.00 0.00 H new ATOM 533 N PRO A 37 13.832 4.761 -8.814 1.00 0.00 N ATOM 534 CA PRO A 37 14.104 4.152 -7.507 1.00 0.00 C ATOM 535 C PRO A 37 12.896 4.215 -6.557 1.00 0.00 C ATOM 536 O PRO A 37 12.162 5.222 -6.503 1.00 0.00 O ATOM 537 CB PRO A 37 15.292 4.961 -6.957 1.00 0.00 C ATOM 538 CG PRO A 37 15.860 5.654 -8.152 1.00 0.00 C ATOM 539 CD PRO A 37 14.694 5.935 -9.045 1.00 0.00 C ATOM 0 HA PRO A 37 14.320 3.087 -7.598 1.00 0.00 H new ATOM 0 HB2 PRO A 37 14.969 5.676 -6.200 1.00 0.00 H new ATOM 0 HB3 PRO A 37 16.030 4.312 -6.487 1.00 0.00 H new ATOM 0 HG2 PRO A 37 16.366 6.576 -7.867 1.00 0.00 H new ATOM 0 HG3 PRO A 37 16.597 5.028 -8.655 1.00 0.00 H new ATOM 0 HD2 PRO A 37 14.193 6.866 -8.779 1.00 0.00 H new ATOM 0 HD3 PRO A 37 14.993 6.021 -10.090 1.00 0.00 H new ATOM 547 N VAL A 38 12.691 3.134 -5.844 1.00 0.00 N ATOM 548 CA VAL A 38 11.614 2.983 -4.891 1.00 0.00 C ATOM 549 C VAL A 38 12.177 2.534 -3.537 1.00 0.00 C ATOM 550 O VAL A 38 13.326 2.056 -3.459 1.00 0.00 O ATOM 551 CB VAL A 38 10.585 1.911 -5.360 1.00 0.00 C ATOM 552 CG1 VAL A 38 9.855 2.315 -6.629 1.00 0.00 C ATOM 553 CG2 VAL A 38 11.243 0.560 -5.553 1.00 0.00 C ATOM 0 H VAL A 38 13.287 2.309 -5.912 1.00 0.00 H new ATOM 0 HA VAL A 38 11.116 3.949 -4.806 1.00 0.00 H new ATOM 0 HB VAL A 38 9.846 1.836 -4.563 1.00 0.00 H new ATOM 0 HG11 VAL A 38 9.151 1.531 -6.909 1.00 0.00 H new ATOM 0 HG12 VAL A 38 9.313 3.245 -6.457 1.00 0.00 H new ATOM 0 HG13 VAL A 38 10.576 2.459 -7.433 1.00 0.00 H new ATOM 0 HG21 VAL A 38 10.497 -0.165 -5.880 1.00 0.00 H new ATOM 0 HG22 VAL A 38 12.026 0.641 -6.307 1.00 0.00 H new ATOM 0 HG23 VAL A 38 11.680 0.230 -4.611 1.00 0.00 H new ATOM 563 N VAL A 39 11.382 2.680 -2.496 1.00 0.00 N ATOM 564 CA VAL A 39 11.771 2.241 -1.157 1.00 0.00 C ATOM 565 C VAL A 39 11.006 0.969 -0.770 1.00 0.00 C ATOM 566 O VAL A 39 9.789 0.868 -0.996 1.00 0.00 O ATOM 567 CB VAL A 39 11.578 3.356 -0.067 1.00 0.00 C ATOM 568 CG1 VAL A 39 12.488 4.524 -0.344 1.00 0.00 C ATOM 569 CG2 VAL A 39 10.138 3.838 -0.004 1.00 0.00 C ATOM 0 H VAL A 39 10.455 3.102 -2.546 1.00 0.00 H new ATOM 0 HA VAL A 39 12.838 2.024 -1.193 1.00 0.00 H new ATOM 0 HB VAL A 39 11.832 2.915 0.897 1.00 0.00 H new ATOM 0 HG11 VAL A 39 12.342 5.288 0.420 1.00 0.00 H new ATOM 0 HG12 VAL A 39 13.525 4.189 -0.329 1.00 0.00 H new ATOM 0 HG13 VAL A 39 12.256 4.942 -1.324 1.00 0.00 H new ATOM 0 HG21 VAL A 39 10.045 4.608 0.761 1.00 0.00 H new ATOM 0 HG22 VAL A 39 9.850 4.251 -0.971 1.00 0.00 H new ATOM 0 HG23 VAL A 39 9.485 3.001 0.243 1.00 0.00 H new ATOM 579 N ILE A 40 11.718 0.000 -0.227 1.00 0.00 N ATOM 580 CA ILE A 40 11.145 -1.259 0.175 1.00 0.00 C ATOM 581 C ILE A 40 10.680 -1.126 1.607 1.00 0.00 C ATOM 582 O ILE A 40 11.503 -1.020 2.524 1.00 0.00 O ATOM 583 CB ILE A 40 12.203 -2.395 0.111 1.00 0.00 C ATOM 584 CG1 ILE A 40 12.974 -2.386 -1.222 1.00 0.00 C ATOM 585 CG2 ILE A 40 11.553 -3.747 0.336 1.00 0.00 C ATOM 586 CD1 ILE A 40 12.142 -2.585 -2.469 1.00 0.00 C ATOM 0 H ILE A 40 12.721 0.071 -0.053 1.00 0.00 H new ATOM 0 HA ILE A 40 10.321 -1.506 -0.495 1.00 0.00 H new ATOM 0 HB ILE A 40 12.922 -2.213 0.910 1.00 0.00 H new ATOM 0 HG12 ILE A 40 13.501 -1.436 -1.308 1.00 0.00 H new ATOM 0 HG13 ILE A 40 13.732 -3.168 -1.186 1.00 0.00 H new ATOM 0 HG21 ILE A 40 12.312 -4.528 0.287 1.00 0.00 H new ATOM 0 HG22 ILE A 40 11.078 -3.764 1.317 1.00 0.00 H new ATOM 0 HG23 ILE A 40 10.802 -3.922 -0.434 1.00 0.00 H new ATOM 0 HD11 ILE A 40 12.789 -2.560 -3.346 1.00 0.00 H new ATOM 0 HD12 ILE A 40 11.636 -3.549 -2.419 1.00 0.00 H new ATOM 0 HD13 ILE A 40 11.401 -1.789 -2.543 1.00 0.00 H new ATOM 598 N ILE A 41 9.388 -1.097 1.799 1.00 0.00 N ATOM 599 CA ILE A 41 8.840 -0.927 3.147 1.00 0.00 C ATOM 600 C ILE A 41 8.289 -2.233 3.666 1.00 0.00 C ATOM 601 O ILE A 41 7.909 -2.325 4.797 1.00 0.00 O ATOM 602 CB ILE A 41 7.710 0.197 3.213 1.00 0.00 C ATOM 603 CG1 ILE A 41 6.219 -0.336 3.171 1.00 0.00 C ATOM 604 CG2 ILE A 41 7.920 1.258 2.149 1.00 0.00 C ATOM 605 CD1 ILE A 41 5.814 -1.227 1.992 1.00 0.00 C ATOM 0 H ILE A 41 8.691 -1.186 1.059 1.00 0.00 H new ATOM 0 HA ILE A 41 9.666 -0.600 3.779 1.00 0.00 H new ATOM 0 HB ILE A 41 7.832 0.637 4.203 1.00 0.00 H new ATOM 0 HG12 ILE A 41 6.036 -0.892 4.090 1.00 0.00 H new ATOM 0 HG13 ILE A 41 5.554 0.527 3.183 1.00 0.00 H new ATOM 0 HG21 ILE A 41 7.132 2.008 2.223 1.00 0.00 H new ATOM 0 HG22 ILE A 41 8.889 1.734 2.296 1.00 0.00 H new ATOM 0 HG23 ILE A 41 7.889 0.795 1.163 1.00 0.00 H new ATOM 0 HD11 ILE A 41 4.768 -1.515 2.096 1.00 0.00 H new ATOM 0 HD12 ILE A 41 5.948 -0.679 1.059 1.00 0.00 H new ATOM 0 HD13 ILE A 41 6.437 -2.121 1.981 1.00 0.00 H new ATOM 617 N GLN A 42 8.239 -3.226 2.789 1.00 0.00 N ATOM 618 CA GLN A 42 7.571 -4.476 3.060 1.00 0.00 C ATOM 619 C GLN A 42 8.154 -5.275 4.203 1.00 0.00 C ATOM 620 O GLN A 42 9.229 -4.990 4.723 1.00 0.00 O ATOM 621 CB GLN A 42 7.558 -5.297 1.818 1.00 0.00 C ATOM 622 CG GLN A 42 8.963 -5.762 1.355 1.00 0.00 C ATOM 623 CD GLN A 42 9.051 -7.170 0.761 1.00 0.00 C ATOM 624 OE1 GLN A 42 9.809 -7.393 -0.172 1.00 0.00 O ATOM 625 NE2 GLN A 42 8.484 -8.139 1.415 1.00 0.00 N ATOM 0 H GLN A 42 8.667 -3.179 1.864 1.00 0.00 H new ATOM 0 HA GLN A 42 6.561 -4.219 3.380 1.00 0.00 H new ATOM 0 HB2 GLN A 42 6.932 -6.174 1.981 1.00 0.00 H new ATOM 0 HB3 GLN A 42 7.096 -4.719 1.018 1.00 0.00 H new ATOM 0 HG2 GLN A 42 9.330 -5.054 0.612 1.00 0.00 H new ATOM 0 HG3 GLN A 42 9.639 -5.708 2.208 1.00 0.00 H new ATOM 0 HE21 GLN A 42 7.855 -7.931 2.190 1.00 0.00 H new ATOM 0 HE22 GLN A 42 8.668 -9.107 1.153 1.00 0.00 H new ATOM 634 N ASN A 43 7.413 -6.280 4.578 1.00 0.00 N ATOM 635 CA ASN A 43 7.810 -7.191 5.650 1.00 0.00 C ATOM 636 C ASN A 43 9.036 -7.980 5.290 1.00 0.00 C ATOM 637 O ASN A 43 9.528 -7.951 4.155 1.00 0.00 O ATOM 638 CB ASN A 43 6.696 -8.179 6.040 1.00 0.00 C ATOM 639 CG ASN A 43 6.451 -9.295 5.039 1.00 0.00 C ATOM 640 OD1 ASN A 43 6.667 -9.137 3.849 1.00 0.00 O ATOM 641 ND2 ASN A 43 6.027 -10.438 5.528 1.00 0.00 N ATOM 0 H ASN A 43 6.511 -6.503 4.156 1.00 0.00 H new ATOM 0 HA ASN A 43 8.022 -6.546 6.503 1.00 0.00 H new ATOM 0 HB2 ASN A 43 6.946 -8.623 7.004 1.00 0.00 H new ATOM 0 HB3 ASN A 43 5.769 -7.623 6.176 1.00 0.00 H new ATOM 0 HD21 ASN A 43 5.868 -11.231 4.906 1.00 0.00 H new ATOM 0 HD22 ASN A 43 5.857 -10.533 6.529 1.00 0.00 H new ATOM 648 N ASP A 44 9.471 -8.721 6.233 1.00 0.00 N ATOM 649 CA ASP A 44 10.673 -9.520 6.079 1.00 0.00 C ATOM 650 C ASP A 44 10.465 -10.704 5.143 1.00 0.00 C ATOM 651 O ASP A 44 11.244 -10.942 4.229 1.00 0.00 O ATOM 652 CB ASP A 44 11.163 -10.045 7.433 1.00 0.00 C ATOM 653 CG ASP A 44 12.385 -10.928 7.292 1.00 0.00 C ATOM 654 OD1 ASP A 44 12.243 -12.135 7.010 1.00 0.00 O1- ATOM 655 OD2 ASP A 44 13.505 -10.425 7.427 1.00 0.00 O ATOM 0 H ASP A 44 9.021 -8.808 7.144 1.00 0.00 H new ATOM 0 HA ASP A 44 11.422 -8.859 5.643 1.00 0.00 H new ATOM 0 HB2 ASP A 44 11.398 -9.203 8.085 1.00 0.00 H new ATOM 0 HB3 ASP A 44 10.363 -10.608 7.914 1.00 0.00 H new ATOM 660 N THR A 45 9.429 -11.442 5.374 1.00 0.00 N ATOM 661 CA THR A 45 9.261 -12.697 4.718 1.00 0.00 C ATOM 662 C THR A 45 8.566 -12.610 3.346 1.00 0.00 C ATOM 663 O THR A 45 8.703 -13.516 2.542 1.00 0.00 O ATOM 664 CB THR A 45 8.599 -13.728 5.645 1.00 0.00 C ATOM 665 OG1 THR A 45 9.237 -13.652 6.934 1.00 0.00 O ATOM 666 CG2 THR A 45 8.782 -15.154 5.099 1.00 0.00 C ATOM 0 H THR A 45 8.679 -11.194 6.019 1.00 0.00 H new ATOM 0 HA THR A 45 10.268 -13.047 4.490 1.00 0.00 H new ATOM 0 HB THR A 45 7.533 -13.510 5.713 1.00 0.00 H new ATOM 0 HG1 THR A 45 8.826 -14.303 7.541 1.00 0.00 H new ATOM 0 HG21 THR A 45 8.305 -15.866 5.773 1.00 0.00 H new ATOM 0 HG22 THR A 45 8.326 -15.227 4.112 1.00 0.00 H new ATOM 0 HG23 THR A 45 9.845 -15.382 5.025 1.00 0.00 H new ATOM 674 N GLY A 46 7.824 -11.538 3.092 1.00 0.00 N ATOM 675 CA GLY A 46 7.084 -11.384 1.825 1.00 0.00 C ATOM 676 C GLY A 46 7.960 -11.558 0.618 1.00 0.00 C ATOM 677 O GLY A 46 7.574 -12.191 -0.320 1.00 0.00 O ATOM 0 H GLY A 46 7.713 -10.758 3.740 1.00 0.00 H new ATOM 0 HA2 GLY A 46 6.275 -12.114 1.790 1.00 0.00 H new ATOM 0 HA3 GLY A 46 6.624 -10.396 1.796 1.00 0.00 H new ATOM 681 N ASN A 47 9.184 -11.086 0.700 1.00 0.00 N ATOM 682 CA ASN A 47 10.128 -11.235 -0.411 1.00 0.00 C ATOM 683 C ASN A 47 10.460 -12.721 -0.705 1.00 0.00 C ATOM 684 O ASN A 47 10.951 -13.060 -1.791 1.00 0.00 O ATOM 685 CB ASN A 47 11.407 -10.360 -0.277 1.00 0.00 C ATOM 686 CG ASN A 47 12.166 -10.503 1.035 1.00 0.00 C ATOM 687 OD1 ASN A 47 12.910 -11.455 1.228 1.00 0.00 O ATOM 688 ND2 ASN A 47 12.086 -9.503 1.894 1.00 0.00 N ATOM 0 H ASN A 47 9.557 -10.597 1.514 1.00 0.00 H new ATOM 0 HA ASN A 47 9.605 -10.843 -1.284 1.00 0.00 H new ATOM 0 HB2 ASN A 47 12.082 -10.607 -1.096 1.00 0.00 H new ATOM 0 HB3 ASN A 47 11.125 -9.314 -0.401 1.00 0.00 H new ATOM 0 HD21 ASN A 47 12.653 -9.513 2.742 1.00 0.00 H new ATOM 0 HD22 ASN A 47 11.458 -8.721 1.709 1.00 0.00 H new ATOM 695 N LYS A 48 10.204 -13.593 0.275 1.00 0.00 N ATOM 696 CA LYS A 48 10.379 -15.032 0.124 1.00 0.00 C ATOM 697 C LYS A 48 9.153 -15.643 -0.561 1.00 0.00 C ATOM 698 O LYS A 48 9.246 -16.160 -1.670 1.00 0.00 O ATOM 699 CB LYS A 48 10.534 -15.761 1.480 1.00 0.00 C ATOM 700 CG LYS A 48 11.826 -15.589 2.276 1.00 0.00 C ATOM 701 CD LYS A 48 12.070 -14.174 2.742 1.00 0.00 C ATOM 702 CE LYS A 48 12.583 -14.170 4.166 1.00 0.00 C ATOM 703 NZ LYS A 48 13.164 -12.867 4.551 1.00 0.00 N1+ ATOM 0 H LYS A 48 9.868 -13.315 1.197 1.00 0.00 H new ATOM 0 HA LYS A 48 11.287 -15.162 -0.465 1.00 0.00 H new ATOM 0 HB2 LYS A 48 9.710 -15.443 2.119 1.00 0.00 H new ATOM 0 HB3 LYS A 48 10.402 -16.827 1.296 1.00 0.00 H new ATOM 0 HG2 LYS A 48 11.798 -16.248 3.144 1.00 0.00 H new ATOM 0 HG3 LYS A 48 12.667 -15.909 1.660 1.00 0.00 H new ATOM 0 HD2 LYS A 48 12.793 -13.688 2.087 1.00 0.00 H new ATOM 0 HD3 LYS A 48 11.146 -13.599 2.680 1.00 0.00 H new ATOM 0 HE2 LYS A 48 11.766 -14.415 4.844 1.00 0.00 H new ATOM 0 HE3 LYS A 48 13.337 -14.949 4.280 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 13.111 -12.755 5.584 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 14.158 -12.827 4.249 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 12.632 -12.100 4.092 1.00 0.00 H new ATOM 717 N TYR A 49 7.993 -15.558 0.106 1.00 0.00 N ATOM 718 CA TYR A 49 6.793 -16.242 -0.381 1.00 0.00 C ATOM 719 C TYR A 49 6.016 -15.481 -1.451 1.00 0.00 C ATOM 720 O TYR A 49 5.455 -16.091 -2.366 1.00 0.00 O ATOM 721 CB TYR A 49 5.848 -16.709 0.748 1.00 0.00 C ATOM 722 CG TYR A 49 5.441 -15.645 1.724 1.00 0.00 C ATOM 723 CD1 TYR A 49 4.351 -14.810 1.501 1.00 0.00 C ATOM 724 CD2 TYR A 49 6.157 -15.480 2.862 1.00 0.00 C ATOM 725 CE1 TYR A 49 4.018 -13.826 2.415 1.00 0.00 C ATOM 726 CE2 TYR A 49 5.842 -14.521 3.773 1.00 0.00 C ATOM 727 CZ TYR A 49 4.777 -13.686 3.555 1.00 0.00 C ATOM 728 OH TYR A 49 4.479 -12.705 4.473 1.00 0.00 O ATOM 0 H TYR A 49 7.863 -15.031 0.970 1.00 0.00 H new ATOM 0 HA TYR A 49 7.197 -17.131 -0.866 1.00 0.00 H new ATOM 0 HB2 TYR A 49 4.949 -17.128 0.297 1.00 0.00 H new ATOM 0 HB3 TYR A 49 6.335 -17.515 1.297 1.00 0.00 H new ATOM 0 HD1 TYR A 49 3.759 -14.931 0.606 1.00 0.00 H new ATOM 0 HD2 TYR A 49 7.001 -16.127 3.051 1.00 0.00 H new ATOM 0 HE1 TYR A 49 3.174 -13.176 2.236 1.00 0.00 H new ATOM 0 HE2 TYR A 49 6.433 -14.417 4.671 1.00 0.00 H new ATOM 0 HH TYR A 49 4.748 -13.001 5.368 1.00 0.00 H new ATOM 738 N SER A 50 5.980 -14.177 -1.349 1.00 0.00 N ATOM 739 CA SER A 50 5.238 -13.376 -2.279 1.00 0.00 C ATOM 740 C SER A 50 6.081 -13.146 -3.518 1.00 0.00 C ATOM 741 O SER A 50 7.299 -12.947 -3.421 1.00 0.00 O ATOM 742 CB SER A 50 4.884 -12.011 -1.653 1.00 0.00 C ATOM 743 OG SER A 50 4.182 -12.154 -0.420 1.00 0.00 O ATOM 0 H SER A 50 6.462 -13.647 -0.623 1.00 0.00 H new ATOM 0 HA SER A 50 4.317 -13.898 -2.538 1.00 0.00 H new ATOM 0 HB2 SER A 50 5.798 -11.441 -1.486 1.00 0.00 H new ATOM 0 HB3 SER A 50 4.275 -11.438 -2.353 1.00 0.00 H new ATOM 0 HG SER A 50 3.821 -11.285 -0.146 1.00 0.00 H new ATOM 749 N PRO A 51 5.496 -13.261 -4.712 1.00 0.00 N ATOM 750 CA PRO A 51 6.182 -12.868 -5.925 1.00 0.00 C ATOM 751 C PRO A 51 6.184 -11.349 -6.003 1.00 0.00 C ATOM 752 O PRO A 51 6.989 -10.748 -6.699 1.00 0.00 O ATOM 753 CB PRO A 51 5.320 -13.456 -7.061 1.00 0.00 C ATOM 754 CG PRO A 51 4.324 -14.342 -6.389 1.00 0.00 C ATOM 755 CD PRO A 51 4.168 -13.824 -4.992 1.00 0.00 C ATOM 0 HA PRO A 51 7.214 -13.214 -5.975 1.00 0.00 H new ATOM 0 HB2 PRO A 51 4.824 -12.667 -7.626 1.00 0.00 H new ATOM 0 HB3 PRO A 51 5.932 -14.018 -7.767 1.00 0.00 H new ATOM 0 HG2 PRO A 51 3.371 -14.325 -6.918 1.00 0.00 H new ATOM 0 HG3 PRO A 51 4.667 -15.377 -6.383 1.00 0.00 H new ATOM 0 HD2 PRO A 51 3.385 -13.069 -4.924 1.00 0.00 H new ATOM 0 HD3 PRO A 51 3.908 -14.618 -4.292 1.00 0.00 H new ATOM 763 N THR A 52 5.289 -10.765 -5.238 1.00 0.00 N ATOM 764 CA THR A 52 5.063 -9.370 -5.166 1.00 0.00 C ATOM 765 C THR A 52 5.903 -8.711 -4.072 1.00 0.00 C ATOM 766 O THR A 52 6.297 -9.350 -3.098 1.00 0.00 O ATOM 767 CB THR A 52 3.572 -9.130 -4.880 1.00 0.00 C ATOM 768 OG1 THR A 52 3.138 -10.025 -3.846 1.00 0.00 O ATOM 769 CG2 THR A 52 2.719 -9.337 -6.128 1.00 0.00 C ATOM 0 H THR A 52 4.674 -11.296 -4.622 1.00 0.00 H new ATOM 0 HA THR A 52 5.355 -8.924 -6.117 1.00 0.00 H new ATOM 0 HB THR A 52 3.449 -8.095 -4.560 1.00 0.00 H new ATOM 0 HG1 THR A 52 3.381 -9.656 -2.971 1.00 0.00 H new ATOM 0 HG21 THR A 52 1.671 -9.158 -5.886 1.00 0.00 H new ATOM 0 HG22 THR A 52 3.036 -8.641 -6.905 1.00 0.00 H new ATOM 0 HG23 THR A 52 2.840 -10.360 -6.486 1.00 0.00 H new ATOM 777 N VAL A 53 6.226 -7.470 -4.300 1.00 0.00 N ATOM 778 CA VAL A 53 6.885 -6.611 -3.368 1.00 0.00 C ATOM 779 C VAL A 53 6.096 -5.301 -3.408 1.00 0.00 C ATOM 780 O VAL A 53 5.667 -4.864 -4.478 1.00 0.00 O ATOM 781 CB VAL A 53 8.369 -6.334 -3.840 1.00 0.00 C ATOM 782 CG1 VAL A 53 9.134 -5.395 -2.918 1.00 0.00 C ATOM 783 CG2 VAL A 53 9.142 -7.623 -4.002 1.00 0.00 C ATOM 0 H VAL A 53 6.025 -7.010 -5.188 1.00 0.00 H new ATOM 0 HA VAL A 53 6.925 -7.050 -2.371 1.00 0.00 H new ATOM 0 HB VAL A 53 8.277 -5.836 -4.805 1.00 0.00 H new ATOM 0 HG11 VAL A 53 10.144 -5.250 -3.303 1.00 0.00 H new ATOM 0 HG12 VAL A 53 8.622 -4.434 -2.871 1.00 0.00 H new ATOM 0 HG13 VAL A 53 9.185 -5.828 -1.919 1.00 0.00 H new ATOM 0 HG21 VAL A 53 10.158 -7.400 -4.327 1.00 0.00 H new ATOM 0 HG22 VAL A 53 9.174 -8.150 -3.049 1.00 0.00 H new ATOM 0 HG23 VAL A 53 8.652 -8.250 -4.747 1.00 0.00 H new ATOM 793 N ILE A 54 5.898 -4.701 -2.291 1.00 0.00 N ATOM 794 CA ILE A 54 5.215 -3.439 -2.216 1.00 0.00 C ATOM 795 C ILE A 54 6.198 -2.338 -1.834 1.00 0.00 C ATOM 796 O ILE A 54 6.983 -2.478 -0.878 1.00 0.00 O ATOM 797 CB ILE A 54 3.968 -3.488 -1.273 1.00 0.00 C ATOM 798 CG1 ILE A 54 3.292 -2.111 -1.196 1.00 0.00 C ATOM 799 CG2 ILE A 54 4.310 -4.032 0.125 1.00 0.00 C ATOM 800 CD1 ILE A 54 2.006 -2.102 -0.408 1.00 0.00 C ATOM 0 H ILE A 54 6.204 -5.066 -1.389 1.00 0.00 H new ATOM 0 HA ILE A 54 4.817 -3.208 -3.204 1.00 0.00 H new ATOM 0 HB ILE A 54 3.258 -4.191 -1.709 1.00 0.00 H new ATOM 0 HG12 ILE A 54 3.987 -1.401 -0.746 1.00 0.00 H new ATOM 0 HG13 ILE A 54 3.089 -1.760 -2.208 1.00 0.00 H new ATOM 0 HG21 ILE A 54 3.410 -4.045 0.740 1.00 0.00 H new ATOM 0 HG22 ILE A 54 4.703 -5.045 0.035 1.00 0.00 H new ATOM 0 HG23 ILE A 54 5.059 -3.392 0.591 1.00 0.00 H new ATOM 0 HD11 ILE A 54 1.591 -1.094 -0.401 1.00 0.00 H new ATOM 0 HD12 ILE A 54 1.292 -2.785 -0.869 1.00 0.00 H new ATOM 0 HD13 ILE A 54 2.204 -2.420 0.615 1.00 0.00 H new ATOM 812 N VAL A 55 6.197 -1.277 -2.613 1.00 0.00 N ATOM 813 CA VAL A 55 7.139 -0.204 -2.457 1.00 0.00 C ATOM 814 C VAL A 55 6.432 1.151 -2.478 1.00 0.00 C ATOM 815 O VAL A 55 5.239 1.231 -2.761 1.00 0.00 O ATOM 816 CB VAL A 55 8.176 -0.238 -3.611 1.00 0.00 C ATOM 817 CG1 VAL A 55 8.935 -1.554 -3.624 1.00 0.00 C ATOM 818 CG2 VAL A 55 7.503 -0.002 -4.959 1.00 0.00 C ATOM 0 H VAL A 55 5.535 -1.140 -3.376 1.00 0.00 H new ATOM 0 HA VAL A 55 7.638 -0.334 -1.497 1.00 0.00 H new ATOM 0 HB VAL A 55 8.889 0.568 -3.437 1.00 0.00 H new ATOM 0 HG11 VAL A 55 9.655 -1.551 -4.442 1.00 0.00 H new ATOM 0 HG12 VAL A 55 9.462 -1.680 -2.678 1.00 0.00 H new ATOM 0 HG13 VAL A 55 8.234 -2.377 -3.761 1.00 0.00 H new ATOM 0 HG21 VAL A 55 8.253 -0.031 -5.750 1.00 0.00 H new ATOM 0 HG22 VAL A 55 6.759 -0.779 -5.135 1.00 0.00 H new ATOM 0 HG23 VAL A 55 7.016 0.973 -4.957 1.00 0.00 H new ATOM 828 N ALA A 56 7.174 2.192 -2.206 1.00 0.00 N ATOM 829 CA ALA A 56 6.683 3.543 -2.256 1.00 0.00 C ATOM 830 C ALA A 56 7.644 4.358 -3.125 1.00 0.00 C ATOM 831 O ALA A 56 8.860 4.092 -3.121 1.00 0.00 O ATOM 832 CB ALA A 56 6.592 4.138 -0.849 1.00 0.00 C ATOM 0 H ALA A 56 8.156 2.123 -1.938 1.00 0.00 H new ATOM 0 HA ALA A 56 5.680 3.563 -2.682 1.00 0.00 H new ATOM 0 HB1 ALA A 56 6.219 5.160 -0.910 1.00 0.00 H new ATOM 0 HB2 ALA A 56 5.912 3.539 -0.244 1.00 0.00 H new ATOM 0 HB3 ALA A 56 7.581 4.140 -0.390 1.00 0.00 H new ATOM 838 N ALA A 57 7.112 5.285 -3.885 1.00 0.00 N ATOM 839 CA ALA A 57 7.895 6.106 -4.799 1.00 0.00 C ATOM 840 C ALA A 57 8.733 7.207 -4.152 1.00 0.00 C ATOM 841 O ALA A 57 8.271 7.982 -3.292 1.00 0.00 O ATOM 842 CB ALA A 57 7.022 6.669 -5.907 1.00 0.00 C ATOM 0 H ALA A 57 6.115 5.498 -3.892 1.00 0.00 H new ATOM 0 HA ALA A 57 8.629 5.418 -5.218 1.00 0.00 H new ATOM 0 HB1 ALA A 57 7.630 7.278 -6.576 1.00 0.00 H new ATOM 0 HB2 ALA A 57 6.574 5.850 -6.469 1.00 0.00 H new ATOM 0 HB3 ALA A 57 6.234 7.284 -5.472 1.00 0.00 H new ATOM 848 N ILE A 58 9.978 7.245 -4.598 1.00 0.00 N ATOM 849 CA ILE A 58 10.942 8.262 -4.266 1.00 0.00 C ATOM 850 C ILE A 58 10.797 9.373 -5.286 1.00 0.00 C ATOM 851 O ILE A 58 10.991 9.151 -6.484 1.00 0.00 O ATOM 852 CB ILE A 58 12.396 7.710 -4.357 1.00 0.00 C ATOM 853 CG1 ILE A 58 12.612 6.581 -3.343 1.00 0.00 C ATOM 854 CG2 ILE A 58 13.421 8.826 -4.149 1.00 0.00 C ATOM 855 CD1 ILE A 58 13.994 5.964 -3.386 1.00 0.00 C ATOM 0 H ILE A 58 10.353 6.535 -5.227 1.00 0.00 H new ATOM 0 HA ILE A 58 10.764 8.608 -3.248 1.00 0.00 H new ATOM 0 HB ILE A 58 12.539 7.304 -5.358 1.00 0.00 H new ATOM 0 HG12 ILE A 58 12.430 6.969 -2.341 1.00 0.00 H new ATOM 0 HG13 ILE A 58 11.872 5.801 -3.522 1.00 0.00 H new ATOM 0 HG21 ILE A 58 14.427 8.413 -4.218 1.00 0.00 H new ATOM 0 HG22 ILE A 58 13.289 9.589 -4.916 1.00 0.00 H new ATOM 0 HG23 ILE A 58 13.278 9.272 -3.165 1.00 0.00 H new ATOM 0 HD11 ILE A 58 14.063 5.174 -2.638 1.00 0.00 H new ATOM 0 HD12 ILE A 58 14.174 5.544 -4.375 1.00 0.00 H new ATOM 0 HD13 ILE A 58 14.741 6.729 -3.176 1.00 0.00 H new ATOM 867 N THR A 59 10.473 10.530 -4.835 1.00 0.00 N ATOM 868 CA THR A 59 10.246 11.640 -5.692 1.00 0.00 C ATOM 869 C THR A 59 11.185 12.788 -5.351 1.00 0.00 C ATOM 870 O THR A 59 11.184 13.301 -4.243 1.00 0.00 O ATOM 871 CB THR A 59 8.764 12.087 -5.592 1.00 0.00 C ATOM 872 OG1 THR A 59 7.920 10.995 -6.016 1.00 0.00 O ATOM 873 CG2 THR A 59 8.474 13.310 -6.458 1.00 0.00 C ATOM 0 H THR A 59 10.356 10.738 -3.843 1.00 0.00 H new ATOM 0 HA THR A 59 10.452 11.339 -6.719 1.00 0.00 H new ATOM 0 HB THR A 59 8.562 12.359 -4.556 1.00 0.00 H new ATOM 0 HG1 THR A 59 6.980 11.265 -5.955 1.00 0.00 H new ATOM 0 HG21 THR A 59 7.425 13.587 -6.357 1.00 0.00 H new ATOM 0 HG22 THR A 59 9.102 14.141 -6.136 1.00 0.00 H new ATOM 0 HG23 THR A 59 8.688 13.076 -7.501 1.00 0.00 H new ATOM 881 N GLY A 60 12.027 13.125 -6.276 1.00 0.00 N ATOM 882 CA GLY A 60 12.853 14.271 -6.116 1.00 0.00 C ATOM 883 C GLY A 60 12.228 15.443 -6.829 1.00 0.00 C ATOM 884 O GLY A 60 11.207 15.268 -7.523 1.00 0.00 O ATOM 0 H GLY A 60 12.158 12.619 -7.152 1.00 0.00 H new ATOM 0 HA2 GLY A 60 12.976 14.499 -5.057 1.00 0.00 H new ATOM 0 HA3 GLY A 60 13.847 14.075 -6.518 1.00 0.00 H new ATOM 999 N ILE A 67 3.548 17.854 5.801 1.00 0.00 N ATOM 1000 CA ILE A 67 2.297 17.171 5.804 1.00 0.00 C ATOM 1001 C ILE A 67 2.628 15.708 6.085 1.00 0.00 C ATOM 1002 O ILE A 67 3.532 15.171 5.468 1.00 0.00 O ATOM 1003 CB ILE A 67 1.556 17.336 4.430 1.00 0.00 C ATOM 1004 CG1 ILE A 67 0.280 16.472 4.370 1.00 0.00 C ATOM 1005 CG2 ILE A 67 2.481 17.067 3.244 1.00 0.00 C ATOM 1006 CD1 ILE A 67 -0.397 16.456 3.020 1.00 0.00 C ATOM 0 HA ILE A 67 1.621 17.577 6.557 1.00 0.00 H new ATOM 0 HB ILE A 67 1.246 18.378 4.355 1.00 0.00 H new ATOM 0 HG12 ILE A 67 0.534 15.449 4.648 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -0.428 16.838 5.114 1.00 0.00 H new ATOM 0 HG21 ILE A 67 1.926 17.193 2.314 1.00 0.00 H new ATOM 0 HG22 ILE A 67 3.315 17.768 3.267 1.00 0.00 H new ATOM 0 HG23 ILE A 67 2.862 16.048 3.304 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -1.285 15.825 3.066 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -0.686 17.471 2.746 1.00 0.00 H new ATOM 0 HD13 ILE A 67 0.291 16.060 2.273 1.00 0.00 H new ATOM 1018 N PRO A 68 1.923 15.056 7.022 1.00 0.00 N ATOM 1019 CA PRO A 68 2.244 13.673 7.486 1.00 0.00 C ATOM 1020 C PRO A 68 2.255 12.564 6.403 1.00 0.00 C ATOM 1021 O PRO A 68 2.573 11.419 6.706 1.00 0.00 O ATOM 1022 CB PRO A 68 1.141 13.385 8.512 1.00 0.00 C ATOM 1023 CG PRO A 68 0.062 14.362 8.205 1.00 0.00 C ATOM 1024 CD PRO A 68 0.760 15.596 7.747 1.00 0.00 C ATOM 0 HA PRO A 68 3.267 13.648 7.862 1.00 0.00 H new ATOM 0 HB2 PRO A 68 0.781 12.360 8.426 1.00 0.00 H new ATOM 0 HB3 PRO A 68 1.508 13.510 9.531 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -0.606 13.979 7.433 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -0.549 14.561 9.085 1.00 0.00 H new ATOM 0 HD2 PRO A 68 0.126 16.204 7.102 1.00 0.00 H new ATOM 0 HD3 PRO A 68 1.061 16.226 8.584 1.00 0.00 H new ATOM 1032 N THR A 69 1.904 12.886 5.180 1.00 0.00 N ATOM 1033 CA THR A 69 1.869 11.893 4.139 1.00 0.00 C ATOM 1034 C THR A 69 3.117 11.999 3.227 1.00 0.00 C ATOM 1035 O THR A 69 3.460 11.054 2.496 1.00 0.00 O ATOM 1036 CB THR A 69 0.583 12.057 3.300 1.00 0.00 C ATOM 1037 OG1 THR A 69 0.572 13.362 2.710 1.00 0.00 O ATOM 1038 CG2 THR A 69 -0.659 11.936 4.175 1.00 0.00 C ATOM 0 H THR A 69 1.640 13.826 4.885 1.00 0.00 H new ATOM 0 HA THR A 69 1.872 10.907 4.605 1.00 0.00 H new ATOM 0 HB THR A 69 0.572 11.276 2.540 1.00 0.00 H new ATOM 0 HG1 THR A 69 -0.241 13.472 2.174 1.00 0.00 H new ATOM 0 HG21 THR A 69 -1.551 12.055 3.560 1.00 0.00 H new ATOM 0 HG22 THR A 69 -0.675 10.955 4.651 1.00 0.00 H new ATOM 0 HG23 THR A 69 -0.641 12.711 4.942 1.00 0.00 H new ATOM 1046 N HIS A 70 3.791 13.149 3.264 1.00 0.00 N ATOM 1047 CA HIS A 70 4.970 13.362 2.432 1.00 0.00 C ATOM 1048 C HIS A 70 6.177 13.447 3.348 1.00 0.00 C ATOM 1049 O HIS A 70 6.170 14.216 4.301 1.00 0.00 O ATOM 1050 CB HIS A 70 4.831 14.687 1.630 1.00 0.00 C ATOM 1051 CG HIS A 70 3.654 14.766 0.682 1.00 0.00 C ATOM 1052 ND1 HIS A 70 3.320 15.903 -0.009 1.00 0.00 N ATOM 1053 CD2 HIS A 70 2.731 13.833 0.329 1.00 0.00 C ATOM 1054 CE1 HIS A 70 2.232 15.646 -0.741 1.00 0.00 C ATOM 1055 NE2 HIS A 70 1.832 14.394 -0.572 1.00 0.00 N ATOM 0 H HIS A 70 3.541 13.940 3.857 1.00 0.00 H new ATOM 0 HA HIS A 70 5.080 12.541 1.723 1.00 0.00 H new ATOM 0 HB2 HIS A 70 4.758 15.512 2.339 1.00 0.00 H new ATOM 0 HB3 HIS A 70 5.745 14.840 1.057 1.00 0.00 H new ATOM 0 HD2 HIS A 70 2.700 12.816 0.691 1.00 0.00 H new ATOM 0 HE1 HIS A 70 1.744 16.363 -1.384 1.00 0.00 H new ATOM 0 HE2 HIS A 70 1.032 13.937 -1.011 1.00 0.00 H new ATOM 1063 N VAL A 71 7.211 12.682 3.066 1.00 0.00 N ATOM 1064 CA VAL A 71 8.372 12.656 3.931 1.00 0.00 C ATOM 1065 C VAL A 71 9.604 13.160 3.194 1.00 0.00 C ATOM 1066 O VAL A 71 9.861 12.748 2.060 1.00 0.00 O ATOM 1067 CB VAL A 71 8.627 11.212 4.422 1.00 0.00 C ATOM 1068 CG1 VAL A 71 9.810 11.150 5.376 1.00 0.00 C ATOM 1069 CG2 VAL A 71 7.376 10.659 5.080 1.00 0.00 C ATOM 0 H VAL A 71 7.272 12.073 2.250 1.00 0.00 H new ATOM 0 HA VAL A 71 8.179 13.308 4.783 1.00 0.00 H new ATOM 0 HB VAL A 71 8.873 10.596 3.557 1.00 0.00 H new ATOM 0 HG11 VAL A 71 9.961 10.121 5.702 1.00 0.00 H new ATOM 0 HG12 VAL A 71 10.706 11.505 4.868 1.00 0.00 H new ATOM 0 HG13 VAL A 71 9.611 11.780 6.243 1.00 0.00 H new ATOM 0 HG21 VAL A 71 7.565 9.642 5.423 1.00 0.00 H new ATOM 0 HG22 VAL A 71 7.106 11.284 5.931 1.00 0.00 H new ATOM 0 HG23 VAL A 71 6.558 10.653 4.360 1.00 0.00 H new ATOM 1079 N GLU A 72 10.354 14.044 3.824 1.00 0.00 N ATOM 1080 CA GLU A 72 11.578 14.564 3.242 1.00 0.00 C ATOM 1081 C GLU A 72 12.809 13.937 3.922 1.00 0.00 C ATOM 1082 O GLU A 72 12.920 13.912 5.160 1.00 0.00 O ATOM 1083 CB GLU A 72 11.612 16.114 3.271 1.00 0.00 C ATOM 1084 CG GLU A 72 11.449 16.738 4.656 1.00 0.00 C ATOM 1085 CD GLU A 72 11.462 18.253 4.628 1.00 0.00 C ATOM 1086 OE1 GLU A 72 12.545 18.859 4.635 1.00 0.00 O1- ATOM 1087 OE2 GLU A 72 10.381 18.878 4.614 1.00 0.00 O ATOM 0 H GLU A 72 10.135 14.420 4.747 1.00 0.00 H new ATOM 0 HA GLU A 72 11.605 14.278 2.190 1.00 0.00 H new ATOM 0 HB2 GLU A 72 12.558 16.450 2.847 1.00 0.00 H new ATOM 0 HB3 GLU A 72 10.821 16.492 2.623 1.00 0.00 H new ATOM 0 HG2 GLU A 72 10.511 16.396 5.094 1.00 0.00 H new ATOM 0 HG3 GLU A 72 12.251 16.385 5.304 1.00 0.00 H new ATOM 1094 N ILE A 73 13.703 13.415 3.113 1.00 0.00 N ATOM 1095 CA ILE A 73 14.889 12.717 3.571 1.00 0.00 C ATOM 1096 C ILE A 73 16.152 13.309 2.996 1.00 0.00 C ATOM 1097 O ILE A 73 16.132 13.922 1.911 1.00 0.00 O ATOM 1098 CB ILE A 73 14.880 11.204 3.270 1.00 0.00 C ATOM 1099 CG1 ILE A 73 13.769 10.738 2.279 1.00 0.00 C ATOM 1100 CG2 ILE A 73 14.791 10.463 4.563 1.00 0.00 C ATOM 1101 CD1 ILE A 73 12.374 10.556 2.880 1.00 0.00 C ATOM 0 H ILE A 73 13.627 13.463 2.097 1.00 0.00 H new ATOM 0 HA ILE A 73 14.873 12.847 4.653 1.00 0.00 H new ATOM 0 HB ILE A 73 15.812 10.978 2.752 1.00 0.00 H new ATOM 0 HG12 ILE A 73 13.703 11.465 1.469 1.00 0.00 H new ATOM 0 HG13 ILE A 73 14.079 9.792 1.834 1.00 0.00 H new ATOM 0 HG21 ILE A 73 14.784 9.391 4.368 1.00 0.00 H new ATOM 0 HG22 ILE A 73 15.650 10.713 5.185 1.00 0.00 H new ATOM 0 HG23 ILE A 73 13.874 10.744 5.081 1.00 0.00 H new ATOM 0 HD11 ILE A 73 11.683 10.231 2.103 1.00 0.00 H new ATOM 0 HD12 ILE A 73 12.413 9.805 3.669 1.00 0.00 H new ATOM 0 HD13 ILE A 73 12.031 11.503 3.298 1.00 0.00 H new ATOM 1113 N GLU A 74 17.249 13.115 3.709 1.00 0.00 N ATOM 1114 CA GLU A 74 18.533 13.674 3.321 1.00 0.00 C ATOM 1115 C GLU A 74 19.090 13.018 2.093 1.00 0.00 C ATOM 1116 O GLU A 74 19.057 11.789 1.938 1.00 0.00 O ATOM 1117 CB GLU A 74 19.635 13.551 4.398 1.00 0.00 C ATOM 1118 CG GLU A 74 19.345 14.075 5.753 1.00 0.00 C ATOM 1119 CD GLU A 74 18.693 13.035 6.606 1.00 0.00 C ATOM 1120 OE1 GLU A 74 17.526 12.659 6.359 1.00 0.00 O ATOM 1121 OE2 GLU A 74 19.382 12.504 7.520 1.00 0.00 O1- ATOM 0 H GLU A 74 17.275 12.568 4.569 1.00 0.00 H new ATOM 0 HA GLU A 74 18.299 14.725 3.152 1.00 0.00 H new ATOM 0 HB2 GLU A 74 19.890 12.496 4.496 1.00 0.00 H new ATOM 0 HB3 GLU A 74 20.524 14.061 4.026 1.00 0.00 H new ATOM 0 HG2 GLU A 74 20.271 14.407 6.223 1.00 0.00 H new ATOM 0 HG3 GLU A 74 18.695 14.947 5.677 1.00 0.00 H new ATOM 1128 N LYS A 75 19.675 13.850 1.285 1.00 0.00 N ATOM 1129 CA LYS A 75 20.429 13.479 0.111 1.00 0.00 C ATOM 1130 C LYS A 75 21.611 12.609 0.528 1.00 0.00 C ATOM 1131 O LYS A 75 22.008 11.695 -0.165 1.00 0.00 O ATOM 1132 CB LYS A 75 20.945 14.780 -0.461 1.00 0.00 C ATOM 1133 CG LYS A 75 21.873 14.670 -1.638 1.00 0.00 C ATOM 1134 CD LYS A 75 22.204 16.048 -2.167 1.00 0.00 C ATOM 1135 CE LYS A 75 23.386 16.013 -3.118 1.00 0.00 C ATOM 1136 NZ LYS A 75 24.632 15.630 -2.430 1.00 0.00 N1+ ATOM 0 H LYS A 75 19.641 14.859 1.429 1.00 0.00 H new ATOM 0 HA LYS A 75 19.826 12.924 -0.608 1.00 0.00 H new ATOM 0 HB2 LYS A 75 20.089 15.387 -0.756 1.00 0.00 H new ATOM 0 HB3 LYS A 75 21.461 15.321 0.332 1.00 0.00 H new ATOM 0 HG2 LYS A 75 22.788 14.155 -1.344 1.00 0.00 H new ATOM 0 HG3 LYS A 75 21.409 14.072 -2.423 1.00 0.00 H new ATOM 0 HD2 LYS A 75 21.335 16.459 -2.681 1.00 0.00 H new ATOM 0 HD3 LYS A 75 22.427 16.714 -1.334 1.00 0.00 H new ATOM 0 HE2 LYS A 75 23.184 15.307 -3.923 1.00 0.00 H new ATOM 0 HE3 LYS A 75 23.511 16.993 -3.578 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 25.449 15.951 -2.988 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 24.660 16.073 -1.489 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 24.668 14.596 -2.327 1.00 0.00 H new ATOM 1150 N LYS A 76 22.119 12.941 1.684 1.00 0.00 N ATOM 1151 CA LYS A 76 23.285 12.338 2.307 1.00 0.00 C ATOM 1152 C LYS A 76 23.198 10.814 2.474 1.00 0.00 C ATOM 1153 O LYS A 76 24.078 10.093 2.019 1.00 0.00 O ATOM 1154 CB LYS A 76 23.426 12.943 3.685 1.00 0.00 C ATOM 1155 CG LYS A 76 23.643 14.433 3.714 1.00 0.00 C ATOM 1156 CD LYS A 76 23.379 14.941 5.108 1.00 0.00 C ATOM 1157 CE LYS A 76 23.822 16.372 5.298 1.00 0.00 C ATOM 1158 NZ LYS A 76 25.285 16.525 5.191 1.00 0.00 N1+ ATOM 0 H LYS A 76 21.713 13.682 2.256 1.00 0.00 H new ATOM 0 HA LYS A 76 24.133 12.534 1.652 1.00 0.00 H new ATOM 0 HB2 LYS A 76 22.529 12.712 4.259 1.00 0.00 H new ATOM 0 HB3 LYS A 76 24.262 12.461 4.192 1.00 0.00 H new ATOM 0 HG2 LYS A 76 24.664 14.671 3.414 1.00 0.00 H new ATOM 0 HG3 LYS A 76 22.979 14.924 3.002 1.00 0.00 H new ATOM 0 HD2 LYS A 76 22.313 14.863 5.324 1.00 0.00 H new ATOM 0 HD3 LYS A 76 23.897 14.306 5.826 1.00 0.00 H new ATOM 0 HE2 LYS A 76 23.338 17.002 4.552 1.00 0.00 H new ATOM 0 HE3 LYS A 76 23.493 16.725 6.275 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 25.568 17.444 5.588 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 25.753 15.761 5.718 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 25.567 16.479 4.191 1.00 0.00 H new ATOM 1172 N LYS A 77 22.132 10.324 3.088 1.00 0.00 N ATOM 1173 CA LYS A 77 22.070 8.891 3.408 1.00 0.00 C ATOM 1174 C LYS A 77 21.479 8.106 2.267 1.00 0.00 C ATOM 1175 O LYS A 77 21.921 7.001 1.946 1.00 0.00 O ATOM 1176 CB LYS A 77 21.309 8.639 4.720 1.00 0.00 C ATOM 1177 CG LYS A 77 21.267 7.163 5.131 1.00 0.00 C ATOM 1178 CD LYS A 77 20.645 6.951 6.507 1.00 0.00 C ATOM 1179 CE LYS A 77 21.471 7.600 7.622 1.00 0.00 C ATOM 1180 NZ LYS A 77 22.860 7.075 7.689 1.00 0.00 N1+ ATOM 0 H LYS A 77 21.318 10.870 3.371 1.00 0.00 H new ATOM 0 HA LYS A 77 23.092 8.541 3.556 1.00 0.00 H new ATOM 0 HB2 LYS A 77 21.776 9.217 5.518 1.00 0.00 H new ATOM 0 HB3 LYS A 77 20.289 9.007 4.615 1.00 0.00 H new ATOM 0 HG2 LYS A 77 20.699 6.600 4.390 1.00 0.00 H new ATOM 0 HG3 LYS A 77 22.280 6.761 5.129 1.00 0.00 H new ATOM 0 HD2 LYS A 77 19.637 7.365 6.516 1.00 0.00 H new ATOM 0 HD3 LYS A 77 20.552 5.882 6.701 1.00 0.00 H new ATOM 0 HE2 LYS A 77 21.502 8.678 7.465 1.00 0.00 H new ATOM 0 HE3 LYS A 77 20.977 7.432 8.579 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 23.319 7.418 8.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 22.838 6.035 7.697 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 23.396 7.404 6.861 1.00 0.00 H new ATOM 1194 N TYR A 78 20.535 8.715 1.620 1.00 0.00 N ATOM 1195 CA TYR A 78 19.854 8.126 0.497 1.00 0.00 C ATOM 1196 C TYR A 78 20.743 8.234 -0.770 1.00 0.00 C ATOM 1197 O TYR A 78 20.423 7.690 -1.809 1.00 0.00 O ATOM 1198 CB TYR A 78 18.478 8.822 0.339 1.00 0.00 C ATOM 1199 CG TYR A 78 17.397 8.337 1.280 1.00 0.00 C ATOM 1200 CD1 TYR A 78 17.565 8.334 2.664 1.00 0.00 C ATOM 1201 CD2 TYR A 78 16.180 7.904 0.770 1.00 0.00 C ATOM 1202 CE1 TYR A 78 16.560 7.922 3.489 1.00 0.00 C ATOM 1203 CE2 TYR A 78 15.163 7.498 1.602 1.00 0.00 C ATOM 1204 CZ TYR A 78 15.356 7.512 2.957 1.00 0.00 C ATOM 1205 OH TYR A 78 14.340 7.122 3.797 1.00 0.00 O ATOM 0 H TYR A 78 20.206 9.651 1.857 1.00 0.00 H new ATOM 0 HA TYR A 78 19.673 7.063 0.656 1.00 0.00 H new ATOM 0 HB2 TYR A 78 18.612 9.894 0.487 1.00 0.00 H new ATOM 0 HB3 TYR A 78 18.134 8.683 -0.686 1.00 0.00 H new ATOM 0 HD1 TYR A 78 18.503 8.662 3.088 1.00 0.00 H new ATOM 0 HD2 TYR A 78 16.030 7.886 -0.299 1.00 0.00 H new ATOM 0 HE1 TYR A 78 16.707 7.917 4.559 1.00 0.00 H new ATOM 0 HE2 TYR A 78 14.220 7.171 1.190 1.00 0.00 H new ATOM 0 HH TYR A 78 13.558 6.863 3.266 1.00 0.00 H new ATOM 1215 N LYS A 79 21.881 8.926 -0.611 1.00 0.00 N ATOM 1216 CA LYS A 79 22.947 9.115 -1.616 1.00 0.00 C ATOM 1217 C LYS A 79 22.469 9.599 -2.992 1.00 0.00 C ATOM 1218 O LYS A 79 23.055 9.248 -4.022 1.00 0.00 O ATOM 1219 CB LYS A 79 23.914 7.893 -1.707 1.00 0.00 C ATOM 1220 CG LYS A 79 23.289 6.566 -2.136 1.00 0.00 C ATOM 1221 CD LYS A 79 24.301 5.421 -2.124 1.00 0.00 C ATOM 1222 CE LYS A 79 25.431 5.651 -3.114 1.00 0.00 C ATOM 1223 NZ LYS A 79 26.437 4.569 -3.089 1.00 0.00 N1+ ATOM 0 H LYS A 79 22.098 9.396 0.268 1.00 0.00 H new ATOM 0 HA LYS A 79 23.529 9.952 -1.230 1.00 0.00 H new ATOM 0 HB2 LYS A 79 24.711 8.139 -2.409 1.00 0.00 H new ATOM 0 HB3 LYS A 79 24.380 7.752 -0.732 1.00 0.00 H new ATOM 0 HG2 LYS A 79 22.461 6.324 -1.470 1.00 0.00 H new ATOM 0 HG3 LYS A 79 22.872 6.670 -3.138 1.00 0.00 H new ATOM 0 HD2 LYS A 79 24.714 5.312 -1.121 1.00 0.00 H new ATOM 0 HD3 LYS A 79 23.794 4.486 -2.363 1.00 0.00 H new ATOM 0 HE2 LYS A 79 25.017 5.734 -4.119 1.00 0.00 H new ATOM 0 HE3 LYS A 79 25.918 6.600 -2.890 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 27.185 4.774 -3.782 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 26.854 4.504 -2.138 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 25.981 3.666 -3.329 1.00 0.00 H new ATOM 1237 N LEU A 80 21.468 10.461 -3.012 1.00 0.00 N ATOM 1238 CA LEU A 80 21.011 11.022 -4.279 1.00 0.00 C ATOM 1239 C LEU A 80 21.798 12.248 -4.636 1.00 0.00 C ATOM 1240 O LEU A 80 22.740 12.654 -3.937 1.00 0.00 O ATOM 1241 CB LEU A 80 19.504 11.380 -4.304 1.00 0.00 C ATOM 1242 CG LEU A 80 18.480 10.275 -4.530 1.00 0.00 C ATOM 1243 CD1 LEU A 80 18.350 9.405 -3.330 1.00 0.00 C ATOM 1244 CD2 LEU A 80 17.144 10.883 -4.881 1.00 0.00 C ATOM 0 H LEU A 80 20.963 10.785 -2.187 1.00 0.00 H new ATOM 0 HA LEU A 80 21.172 10.231 -5.011 1.00 0.00 H new ATOM 0 HB2 LEU A 80 19.265 11.859 -3.355 1.00 0.00 H new ATOM 0 HB3 LEU A 80 19.357 12.127 -5.084 1.00 0.00 H new ATOM 0 HG LEU A 80 18.824 9.653 -5.357 1.00 0.00 H new ATOM 0 HD11 LEU A 80 17.612 8.627 -3.523 1.00 0.00 H new ATOM 0 HD12 LEU A 80 19.313 8.945 -3.108 1.00 0.00 H new ATOM 0 HD13 LEU A 80 18.030 10.005 -2.478 1.00 0.00 H new ATOM 0 HD21 LEU A 80 16.414 10.090 -5.042 1.00 0.00 H new ATOM 0 HD22 LEU A 80 16.810 11.523 -4.065 1.00 0.00 H new ATOM 0 HD23 LEU A 80 17.242 11.476 -5.790 1.00 0.00 H new ATOM 1256 N ASP A 81 21.393 12.826 -5.717 1.00 0.00 N ATOM 1257 CA ASP A 81 21.982 14.049 -6.251 1.00 0.00 C ATOM 1258 C ASP A 81 21.213 15.240 -5.709 1.00 0.00 C ATOM 1259 O ASP A 81 21.608 16.392 -5.881 1.00 0.00 O ATOM 1260 CB ASP A 81 21.888 14.059 -7.786 1.00 0.00 C ATOM 1261 CG ASP A 81 20.454 14.164 -8.277 1.00 0.00 C ATOM 1262 OD1 ASP A 81 19.662 13.224 -8.056 1.00 0.00 O1- ATOM 1263 OD2 ASP A 81 20.072 15.194 -8.853 1.00 0.00 O ATOM 0 H ASP A 81 20.624 12.466 -6.282 1.00 0.00 H new ATOM 0 HA ASP A 81 23.030 14.100 -5.955 1.00 0.00 H new ATOM 0 HB2 ASP A 81 22.466 14.896 -8.177 1.00 0.00 H new ATOM 0 HB3 ASP A 81 22.339 13.149 -8.181 1.00 0.00 H new ATOM 1268 N LYS A 82 20.133 14.950 -5.031 1.00 0.00 N ATOM 1269 CA LYS A 82 19.255 15.939 -4.504 1.00 0.00 C ATOM 1270 C LYS A 82 18.553 15.342 -3.295 1.00 0.00 C ATOM 1271 O LYS A 82 18.628 14.125 -3.089 1.00 0.00 O ATOM 1272 CB LYS A 82 18.224 16.312 -5.588 1.00 0.00 C ATOM 1273 CG LYS A 82 17.341 15.136 -6.049 1.00 0.00 C ATOM 1274 CD LYS A 82 16.266 15.528 -7.081 1.00 0.00 C ATOM 1275 CE LYS A 82 16.775 15.634 -8.528 1.00 0.00 C ATOM 1276 NZ LYS A 82 17.351 14.362 -9.008 1.00 0.00 N1+ ATOM 0 H LYS A 82 19.841 13.994 -4.830 1.00 0.00 H new ATOM 0 HA LYS A 82 19.800 16.836 -4.209 1.00 0.00 H new ATOM 0 HB2 LYS A 82 17.582 17.106 -5.206 1.00 0.00 H new ATOM 0 HB3 LYS A 82 18.751 16.717 -6.452 1.00 0.00 H new ATOM 0 HG2 LYS A 82 17.978 14.363 -6.479 1.00 0.00 H new ATOM 0 HG3 LYS A 82 16.852 14.699 -5.178 1.00 0.00 H new ATOM 0 HD2 LYS A 82 15.462 14.793 -7.046 1.00 0.00 H new ATOM 0 HD3 LYS A 82 15.835 16.486 -6.791 1.00 0.00 H new ATOM 0 HE2 LYS A 82 15.953 15.928 -9.180 1.00 0.00 H new ATOM 0 HE3 LYS A 82 17.528 16.419 -8.590 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 17.802 14.512 -9.933 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 18.061 14.023 -8.327 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 16.596 13.653 -9.103 1.00 0.00 H new ATOM 1290 N ASP A 83 17.948 16.179 -2.482 1.00 0.00 N ATOM 1291 CA ASP A 83 17.111 15.730 -1.363 1.00 0.00 C ATOM 1292 C ASP A 83 15.988 14.820 -1.851 1.00 0.00 C ATOM 1293 O ASP A 83 15.487 14.963 -2.980 1.00 0.00 O ATOM 1294 CB ASP A 83 16.562 16.923 -0.541 1.00 0.00 C ATOM 1295 CG ASP A 83 15.938 18.018 -1.384 1.00 0.00 C ATOM 1296 OD1 ASP A 83 16.681 18.911 -1.844 1.00 0.00 O ATOM 1297 OD2 ASP A 83 14.722 18.038 -1.584 1.00 0.00 O1- ATOM 0 H ASP A 83 18.015 17.193 -2.568 1.00 0.00 H new ATOM 0 HA ASP A 83 17.743 15.147 -0.693 1.00 0.00 H new ATOM 0 HB2 ASP A 83 15.818 16.553 0.164 1.00 0.00 H new ATOM 0 HB3 ASP A 83 17.374 17.350 0.047 1.00 0.00 H new ATOM 1302 N SER A 84 15.618 13.881 -1.025 1.00 0.00 N ATOM 1303 CA SER A 84 14.684 12.865 -1.410 1.00 0.00 C ATOM 1304 C SER A 84 13.341 13.080 -0.726 1.00 0.00 C ATOM 1305 O SER A 84 13.293 13.357 0.461 1.00 0.00 O ATOM 1306 CB SER A 84 15.276 11.530 -0.987 1.00 0.00 C ATOM 1307 OG SER A 84 16.600 11.410 -1.472 1.00 0.00 O ATOM 0 H SER A 84 15.957 13.800 -0.066 1.00 0.00 H new ATOM 0 HA SER A 84 14.512 12.895 -2.486 1.00 0.00 H new ATOM 0 HB2 SER A 84 15.270 11.449 0.100 1.00 0.00 H new ATOM 0 HB3 SER A 84 14.664 10.714 -1.371 1.00 0.00 H new ATOM 0 HG SER A 84 17.163 10.993 -0.787 1.00 0.00 H new ATOM 1313 N VAL A 85 12.265 13.014 -1.468 1.00 0.00 N ATOM 1314 CA VAL A 85 10.951 13.081 -0.877 1.00 0.00 C ATOM 1315 C VAL A 85 10.244 11.778 -1.190 1.00 0.00 C ATOM 1316 O VAL A 85 10.149 11.375 -2.336 1.00 0.00 O ATOM 1317 CB VAL A 85 10.117 14.222 -1.472 1.00 0.00 C ATOM 1318 CG1 VAL A 85 8.864 14.507 -0.648 1.00 0.00 C ATOM 1319 CG2 VAL A 85 10.944 15.467 -1.700 1.00 0.00 C ATOM 0 H VAL A 85 12.272 12.914 -2.483 1.00 0.00 H new ATOM 0 HA VAL A 85 11.057 13.254 0.194 1.00 0.00 H new ATOM 0 HB VAL A 85 9.777 13.887 -2.452 1.00 0.00 H new ATOM 0 HG11 VAL A 85 8.304 15.322 -1.107 1.00 0.00 H new ATOM 0 HG12 VAL A 85 8.241 13.614 -0.613 1.00 0.00 H new ATOM 0 HG13 VAL A 85 9.151 14.789 0.365 1.00 0.00 H new ATOM 0 HG21 VAL A 85 10.314 16.250 -2.122 1.00 0.00 H new ATOM 0 HG22 VAL A 85 11.359 15.807 -0.751 1.00 0.00 H new ATOM 0 HG23 VAL A 85 11.756 15.243 -2.391 1.00 0.00 H new ATOM 1329 N ILE A 86 9.796 11.121 -0.204 1.00 0.00 N ATOM 1330 CA ILE A 86 9.104 9.850 -0.378 1.00 0.00 C ATOM 1331 C ILE A 86 7.682 10.041 -0.040 1.00 0.00 C ATOM 1332 O ILE A 86 7.328 10.602 1.008 1.00 0.00 O ATOM 1333 CB ILE A 86 9.761 8.602 0.373 1.00 0.00 C ATOM 1334 CG1 ILE A 86 11.007 8.073 -0.361 1.00 0.00 C ATOM 1335 CG2 ILE A 86 8.779 7.448 0.514 1.00 0.00 C ATOM 1336 CD1 ILE A 86 12.110 9.060 -0.569 1.00 0.00 C ATOM 0 H ILE A 86 9.882 11.423 0.766 1.00 0.00 H new ATOM 0 HA ILE A 86 9.205 9.568 -1.426 1.00 0.00 H new ATOM 0 HB ILE A 86 10.046 8.972 1.358 1.00 0.00 H new ATOM 0 HG12 ILE A 86 11.404 7.227 0.200 1.00 0.00 H new ATOM 0 HG13 ILE A 86 10.697 7.693 -1.334 1.00 0.00 H new ATOM 0 HG21 ILE A 86 9.264 6.619 1.030 1.00 0.00 H new ATOM 0 HG22 ILE A 86 7.912 7.776 1.088 1.00 0.00 H new ATOM 0 HG23 ILE A 86 8.457 7.122 -0.475 1.00 0.00 H new ATOM 0 HD11 ILE A 86 12.935 8.579 -1.095 1.00 0.00 H new ATOM 0 HD12 ILE A 86 11.742 9.898 -1.161 1.00 0.00 H new ATOM 0 HD13 ILE A 86 12.459 9.425 0.397 1.00 0.00 H new ATOM 1348 N LEU A 87 6.877 9.640 -0.949 1.00 0.00 N ATOM 1349 CA LEU A 87 5.456 9.860 -0.836 1.00 0.00 C ATOM 1350 C LEU A 87 4.721 8.626 -0.349 1.00 0.00 C ATOM 1351 O LEU A 87 4.488 7.679 -1.100 1.00 0.00 O ATOM 1352 CB LEU A 87 4.874 10.416 -2.152 1.00 0.00 C ATOM 1353 CG LEU A 87 5.528 11.722 -2.673 1.00 0.00 C ATOM 1354 CD1 LEU A 87 4.820 12.246 -3.906 1.00 0.00 C ATOM 1355 CD2 LEU A 87 5.556 12.792 -1.607 1.00 0.00 C ATOM 0 H LEU A 87 7.166 9.150 -1.796 1.00 0.00 H new ATOM 0 HA LEU A 87 5.301 10.620 -0.070 1.00 0.00 H new ATOM 0 HB2 LEU A 87 4.968 9.651 -2.922 1.00 0.00 H new ATOM 0 HB3 LEU A 87 3.808 10.596 -2.010 1.00 0.00 H new ATOM 0 HG LEU A 87 6.554 11.472 -2.942 1.00 0.00 H new ATOM 0 HD11 LEU A 87 5.306 13.162 -4.243 1.00 0.00 H new ATOM 0 HD12 LEU A 87 4.867 11.498 -4.698 1.00 0.00 H new ATOM 0 HD13 LEU A 87 3.778 12.455 -3.666 1.00 0.00 H new ATOM 0 HD21 LEU A 87 6.021 13.693 -2.008 1.00 0.00 H new ATOM 0 HD22 LEU A 87 4.537 13.019 -1.292 1.00 0.00 H new ATOM 0 HD23 LEU A 87 6.130 12.438 -0.751 1.00 0.00 H new ATOM 1367 N LEU A 88 4.344 8.653 0.915 1.00 0.00 N ATOM 1368 CA LEU A 88 3.628 7.548 1.555 1.00 0.00 C ATOM 1369 C LEU A 88 2.168 7.713 1.304 1.00 0.00 C ATOM 1370 O LEU A 88 1.411 8.098 2.180 1.00 0.00 O ATOM 1371 CB LEU A 88 3.908 7.439 3.075 1.00 0.00 C ATOM 1372 CG LEU A 88 5.303 6.961 3.510 1.00 0.00 C ATOM 1373 CD1 LEU A 88 5.583 5.578 2.999 1.00 0.00 C ATOM 1374 CD2 LEU A 88 6.375 7.918 3.085 1.00 0.00 C ATOM 0 H LEU A 88 4.523 9.442 1.536 1.00 0.00 H new ATOM 0 HA LEU A 88 3.990 6.618 1.116 1.00 0.00 H new ATOM 0 HB2 LEU A 88 3.735 8.419 3.519 1.00 0.00 H new ATOM 0 HB3 LEU A 88 3.171 6.760 3.504 1.00 0.00 H new ATOM 0 HG LEU A 88 5.310 6.927 4.599 1.00 0.00 H new ATOM 0 HD11 LEU A 88 6.576 5.265 3.321 1.00 0.00 H new ATOM 0 HD12 LEU A 88 4.839 4.887 3.394 1.00 0.00 H new ATOM 0 HD13 LEU A 88 5.538 5.576 1.910 1.00 0.00 H new ATOM 0 HD21 LEU A 88 7.346 7.545 3.411 1.00 0.00 H new ATOM 0 HD22 LEU A 88 6.369 8.013 1.999 1.00 0.00 H new ATOM 0 HD23 LEU A 88 6.191 8.893 3.535 1.00 0.00 H new ATOM 1386 N GLU A 89 1.827 7.490 0.077 1.00 0.00 N ATOM 1387 CA GLU A 89 0.504 7.691 -0.472 1.00 0.00 C ATOM 1388 C GLU A 89 0.573 7.225 -1.906 1.00 0.00 C ATOM 1389 O GLU A 89 -0.195 6.382 -2.356 1.00 0.00 O ATOM 1390 CB GLU A 89 0.185 9.202 -0.349 1.00 0.00 C ATOM 1391 CG GLU A 89 -0.825 9.822 -1.310 1.00 0.00 C ATOM 1392 CD GLU A 89 -2.250 9.423 -1.077 1.00 0.00 C ATOM 1393 OE1 GLU A 89 -2.884 10.007 -0.183 1.00 0.00 O ATOM 1394 OE2 GLU A 89 -2.765 8.612 -1.857 1.00 0.00 O1- ATOM 0 H GLU A 89 2.491 7.144 -0.615 1.00 0.00 H new ATOM 0 HA GLU A 89 -0.284 7.140 0.041 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -0.171 9.382 0.665 1.00 0.00 H new ATOM 0 HB3 GLU A 89 1.123 9.747 -0.459 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -0.751 10.907 -1.240 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -0.549 9.549 -2.329 1.00 0.00 H new ATOM 1401 N GLN A 90 1.585 7.695 -2.576 1.00 0.00 N ATOM 1402 CA GLN A 90 1.819 7.342 -3.944 1.00 0.00 C ATOM 1403 C GLN A 90 2.776 6.150 -3.936 1.00 0.00 C ATOM 1404 O GLN A 90 4.006 6.307 -3.960 1.00 0.00 O ATOM 1405 CB GLN A 90 2.426 8.543 -4.662 1.00 0.00 C ATOM 1406 CG GLN A 90 2.266 8.593 -6.178 1.00 0.00 C ATOM 1407 CD GLN A 90 3.111 7.594 -6.911 1.00 0.00 C ATOM 1408 OE1 GLN A 90 4.244 7.876 -7.239 1.00 0.00 O ATOM 1409 NE2 GLN A 90 2.563 6.446 -7.213 1.00 0.00 N ATOM 0 H GLN A 90 2.274 8.337 -2.185 1.00 0.00 H new ATOM 0 HA GLN A 90 0.901 7.071 -4.466 1.00 0.00 H new ATOM 0 HB2 GLN A 90 1.984 9.447 -4.244 1.00 0.00 H new ATOM 0 HB3 GLN A 90 3.491 8.573 -4.432 1.00 0.00 H new ATOM 0 HG2 GLN A 90 1.219 8.423 -6.429 1.00 0.00 H new ATOM 0 HG3 GLN A 90 2.519 9.594 -6.527 1.00 0.00 H new ATOM 0 HE21 GLN A 90 1.607 6.244 -6.920 1.00 0.00 H new ATOM 0 HE22 GLN A 90 3.091 5.752 -7.742 1.00 0.00 H new ATOM 1418 N ILE A 91 2.217 4.976 -3.793 1.00 0.00 N ATOM 1419 CA ILE A 91 3.009 3.782 -3.674 1.00 0.00 C ATOM 1420 C ILE A 91 2.675 2.792 -4.779 1.00 0.00 C ATOM 1421 O ILE A 91 1.820 3.071 -5.642 1.00 0.00 O ATOM 1422 CB ILE A 91 2.916 3.175 -2.214 1.00 0.00 C ATOM 1423 CG1 ILE A 91 1.560 2.648 -1.814 1.00 0.00 C ATOM 1424 CG2 ILE A 91 3.274 4.218 -1.249 1.00 0.00 C ATOM 1425 CD1 ILE A 91 1.257 1.290 -2.340 1.00 0.00 C ATOM 0 H ILE A 91 1.209 4.822 -3.756 1.00 0.00 H new ATOM 0 HA ILE A 91 4.058 4.040 -3.816 1.00 0.00 H new ATOM 0 HB ILE A 91 3.596 2.323 -2.216 1.00 0.00 H new ATOM 0 HG12 ILE A 91 1.497 2.627 -0.726 1.00 0.00 H new ATOM 0 HG13 ILE A 91 0.795 3.341 -2.165 1.00 0.00 H new ATOM 0 HG21 ILE A 91 3.214 3.814 -0.238 1.00 0.00 H new ATOM 0 HG22 ILE A 91 4.290 4.560 -1.444 1.00 0.00 H new ATOM 0 HG23 ILE A 91 2.584 5.056 -1.346 1.00 0.00 H new ATOM 0 HD11 ILE A 91 0.265 0.984 -2.008 1.00 0.00 H new ATOM 0 HD12 ILE A 91 1.286 1.307 -3.429 1.00 0.00 H new ATOM 0 HD13 ILE A 91 1.998 0.582 -1.969 1.00 0.00 H new ATOM 1437 N ARG A 92 3.348 1.675 -4.781 1.00 0.00 N ATOM 1438 CA ARG A 92 3.199 0.707 -5.839 1.00 0.00 C ATOM 1439 C ARG A 92 3.497 -0.735 -5.360 1.00 0.00 C ATOM 1440 O ARG A 92 4.344 -0.948 -4.525 1.00 0.00 O ATOM 1441 CB ARG A 92 4.185 1.119 -6.908 1.00 0.00 C ATOM 1442 CG ARG A 92 4.310 0.237 -8.104 1.00 0.00 C ATOM 1443 CD ARG A 92 3.092 0.260 -9.043 1.00 0.00 C ATOM 1444 NE ARG A 92 3.434 -0.335 -10.365 1.00 0.00 N ATOM 1445 CZ ARG A 92 2.908 -1.451 -10.926 1.00 0.00 C ATOM 1446 NH1 ARG A 92 1.960 -2.138 -10.329 1.00 0.00 N1+ ATOM 1447 NH2 ARG A 92 3.380 -1.881 -12.086 1.00 0.00 N ATOM 0 H ARG A 92 4.013 1.408 -4.055 1.00 0.00 H new ATOM 0 HA ARG A 92 2.172 0.693 -6.203 1.00 0.00 H new ATOM 0 HB2 ARG A 92 3.911 2.116 -7.252 1.00 0.00 H new ATOM 0 HB3 ARG A 92 5.169 1.200 -6.445 1.00 0.00 H new ATOM 0 HG2 ARG A 92 5.194 0.534 -8.668 1.00 0.00 H new ATOM 0 HG3 ARG A 92 4.475 -0.787 -7.769 1.00 0.00 H new ATOM 0 HD2 ARG A 92 2.268 -0.293 -8.592 1.00 0.00 H new ATOM 0 HD3 ARG A 92 2.750 1.286 -9.178 1.00 0.00 H new ATOM 0 HE ARG A 92 4.145 0.153 -10.910 1.00 0.00 H new ATOM 0 HH11 ARG A 92 1.604 -1.834 -9.423 1.00 0.00 H new ATOM 0 HH12 ARG A 92 1.580 -2.975 -10.772 1.00 0.00 H new ATOM 0 HH21 ARG A 92 4.133 -1.373 -12.550 1.00 0.00 H new ATOM 0 HH22 ARG A 92 2.990 -2.720 -12.516 1.00 0.00 H new ATOM 1461 N THR A 93 2.800 -1.694 -5.929 1.00 0.00 N ATOM 1462 CA THR A 93 3.019 -3.100 -5.666 1.00 0.00 C ATOM 1463 C THR A 93 3.504 -3.748 -6.982 1.00 0.00 C ATOM 1464 O THR A 93 2.818 -3.668 -8.006 1.00 0.00 O ATOM 1465 CB THR A 93 1.720 -3.789 -5.121 1.00 0.00 C ATOM 1466 OG1 THR A 93 1.283 -3.109 -3.943 1.00 0.00 O ATOM 1467 CG2 THR A 93 1.988 -5.242 -4.778 1.00 0.00 C ATOM 0 H THR A 93 2.052 -1.516 -6.599 1.00 0.00 H new ATOM 0 HA THR A 93 3.773 -3.228 -4.889 1.00 0.00 H new ATOM 0 HB THR A 93 0.952 -3.742 -5.893 1.00 0.00 H new ATOM 0 HG1 THR A 93 1.119 -3.761 -3.230 1.00 0.00 H new ATOM 0 HG21 THR A 93 1.074 -5.702 -4.402 1.00 0.00 H new ATOM 0 HG22 THR A 93 2.319 -5.772 -5.671 1.00 0.00 H new ATOM 0 HG23 THR A 93 2.764 -5.298 -4.014 1.00 0.00 H new ATOM 1475 N LEU A 94 4.691 -4.317 -6.942 1.00 0.00 N ATOM 1476 CA LEU A 94 5.424 -4.828 -8.105 1.00 0.00 C ATOM 1477 C LEU A 94 5.916 -6.214 -7.841 1.00 0.00 C ATOM 1478 O LEU A 94 6.265 -6.505 -6.732 1.00 0.00 O ATOM 1479 CB LEU A 94 6.657 -3.949 -8.234 1.00 0.00 C ATOM 1480 CG LEU A 94 6.357 -2.518 -8.534 1.00 0.00 C ATOM 1481 CD1 LEU A 94 7.511 -1.629 -8.185 1.00 0.00 C ATOM 1482 CD2 LEU A 94 6.016 -2.370 -9.987 1.00 0.00 C ATOM 0 H LEU A 94 5.201 -4.446 -6.068 1.00 0.00 H new ATOM 0 HA LEU A 94 4.785 -4.827 -8.988 1.00 0.00 H new ATOM 0 HB2 LEU A 94 7.227 -4.003 -7.306 1.00 0.00 H new ATOM 0 HB3 LEU A 94 7.294 -4.349 -9.023 1.00 0.00 H new ATOM 0 HG LEU A 94 5.507 -2.213 -7.923 1.00 0.00 H new ATOM 0 HD11 LEU A 94 7.257 -0.595 -8.417 1.00 0.00 H new ATOM 0 HD12 LEU A 94 7.731 -1.719 -7.121 1.00 0.00 H new ATOM 0 HD13 LEU A 94 8.386 -1.926 -8.763 1.00 0.00 H new ATOM 0 HD21 LEU A 94 5.797 -1.325 -10.205 1.00 0.00 H new ATOM 0 HD22 LEU A 94 6.860 -2.698 -10.594 1.00 0.00 H new ATOM 0 HD23 LEU A 94 5.143 -2.980 -10.220 1.00 0.00 H new ATOM 1494 N ASP A 95 5.937 -7.089 -8.821 1.00 0.00 N ATOM 1495 CA ASP A 95 6.610 -8.352 -8.566 1.00 0.00 C ATOM 1496 C ASP A 95 8.127 -8.186 -8.633 1.00 0.00 C ATOM 1497 O ASP A 95 8.626 -7.277 -9.287 1.00 0.00 O ATOM 1498 CB ASP A 95 6.114 -9.523 -9.405 1.00 0.00 C ATOM 1499 CG ASP A 95 6.806 -9.711 -10.722 1.00 0.00 C ATOM 1500 OD1 ASP A 95 7.901 -10.308 -10.747 1.00 0.00 O ATOM 1501 OD2 ASP A 95 6.237 -9.376 -11.761 1.00 0.00 O1- ATOM 0 H ASP A 95 5.526 -6.969 -9.747 1.00 0.00 H new ATOM 0 HA ASP A 95 6.339 -8.628 -7.547 1.00 0.00 H new ATOM 0 HB2 ASP A 95 6.224 -10.438 -8.822 1.00 0.00 H new ATOM 0 HB3 ASP A 95 5.048 -9.389 -9.590 1.00 0.00 H new ATOM 1506 N LYS A 96 8.822 -9.037 -7.901 1.00 0.00 N ATOM 1507 CA LYS A 96 10.297 -9.046 -7.715 1.00 0.00 C ATOM 1508 C LYS A 96 11.131 -8.795 -8.980 1.00 0.00 C ATOM 1509 O LYS A 96 12.241 -8.276 -8.872 1.00 0.00 O ATOM 1510 CB LYS A 96 10.723 -10.362 -7.064 1.00 0.00 C ATOM 1511 CG LYS A 96 10.099 -10.590 -5.692 1.00 0.00 C ATOM 1512 CD LYS A 96 10.496 -11.922 -5.075 1.00 0.00 C ATOM 1513 CE LYS A 96 11.986 -12.000 -4.800 1.00 0.00 C ATOM 1514 NZ LYS A 96 12.360 -13.264 -4.135 1.00 0.00 N1+ ATOM 0 H LYS A 96 8.366 -9.789 -7.384 1.00 0.00 H new ATOM 0 HA LYS A 96 10.507 -8.193 -7.070 1.00 0.00 H new ATOM 0 HB2 LYS A 96 10.450 -11.188 -7.721 1.00 0.00 H new ATOM 0 HB3 LYS A 96 11.809 -10.376 -6.968 1.00 0.00 H new ATOM 0 HG2 LYS A 96 10.398 -9.782 -5.024 1.00 0.00 H new ATOM 0 HG3 LYS A 96 9.013 -10.545 -5.780 1.00 0.00 H new ATOM 0 HD2 LYS A 96 9.948 -12.068 -4.144 1.00 0.00 H new ATOM 0 HD3 LYS A 96 10.208 -12.732 -5.745 1.00 0.00 H new ATOM 0 HE2 LYS A 96 12.533 -11.908 -5.738 1.00 0.00 H new ATOM 0 HE3 LYS A 96 12.284 -11.159 -4.174 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 13.362 -13.228 -3.859 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 11.772 -13.398 -3.288 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 12.210 -14.058 -4.789 1.00 0.00 H new ATOM 1528 N LYS A 97 10.616 -9.124 -10.161 1.00 0.00 N ATOM 1529 CA LYS A 97 11.387 -8.913 -11.391 1.00 0.00 C ATOM 1530 C LYS A 97 11.503 -7.436 -11.728 1.00 0.00 C ATOM 1531 O LYS A 97 12.387 -7.024 -12.460 1.00 0.00 O ATOM 1532 CB LYS A 97 10.790 -9.648 -12.579 1.00 0.00 C ATOM 1533 CG LYS A 97 9.477 -9.085 -13.115 1.00 0.00 C ATOM 1534 CD LYS A 97 9.026 -9.828 -14.363 1.00 0.00 C ATOM 1535 CE LYS A 97 8.703 -11.292 -14.081 1.00 0.00 C ATOM 1536 NZ LYS A 97 7.545 -11.430 -13.189 1.00 0.00 N1+ ATOM 0 H LYS A 97 9.690 -9.529 -10.297 1.00 0.00 H new ATOM 0 HA LYS A 97 12.380 -9.319 -11.196 1.00 0.00 H new ATOM 0 HB2 LYS A 97 11.521 -9.647 -13.388 1.00 0.00 H new ATOM 0 HB3 LYS A 97 10.629 -10.688 -12.296 1.00 0.00 H new ATOM 0 HG2 LYS A 97 8.707 -9.159 -12.347 1.00 0.00 H new ATOM 0 HG3 LYS A 97 9.599 -8.026 -13.344 1.00 0.00 H new ATOM 0 HD2 LYS A 97 8.145 -9.337 -14.777 1.00 0.00 H new ATOM 0 HD3 LYS A 97 9.808 -9.770 -15.120 1.00 0.00 H new ATOM 0 HE2 LYS A 97 8.503 -11.808 -15.020 1.00 0.00 H new ATOM 0 HE3 LYS A 97 9.570 -11.776 -13.630 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 7.065 -12.333 -13.380 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 7.865 -11.410 -12.200 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 6.884 -10.645 -13.355 1.00 0.00 H new ATOM 1550 N ARG A 98 10.590 -6.659 -11.200 1.00 0.00 N ATOM 1551 CA ARG A 98 10.567 -5.215 -11.434 1.00 0.00 C ATOM 1552 C ARG A 98 11.767 -4.562 -10.752 1.00 0.00 C ATOM 1553 O ARG A 98 12.299 -3.566 -11.234 1.00 0.00 O ATOM 1554 CB ARG A 98 9.283 -4.588 -10.895 1.00 0.00 C ATOM 1555 CG ARG A 98 7.983 -5.149 -11.467 1.00 0.00 C ATOM 1556 CD ARG A 98 7.824 -4.901 -12.947 1.00 0.00 C ATOM 1557 NE ARG A 98 6.477 -5.266 -13.376 1.00 0.00 N ATOM 1558 CZ ARG A 98 5.956 -5.062 -14.579 1.00 0.00 C ATOM 1559 NH1 ARG A 98 6.642 -4.447 -15.542 1.00 0.00 N1+ ATOM 1560 NH2 ARG A 98 4.721 -5.419 -14.794 1.00 0.00 N ATOM 0 H ARG A 98 9.840 -6.996 -10.597 1.00 0.00 H new ATOM 0 HA ARG A 98 10.611 -5.048 -12.510 1.00 0.00 H new ATOM 0 HB2 ARG A 98 9.266 -4.713 -9.812 1.00 0.00 H new ATOM 0 HB3 ARG A 98 9.313 -3.516 -11.092 1.00 0.00 H new ATOM 0 HG2 ARG A 98 7.945 -6.222 -11.280 1.00 0.00 H new ATOM 0 HG3 ARG A 98 7.140 -4.704 -10.939 1.00 0.00 H new ATOM 0 HD2 ARG A 98 8.013 -3.851 -13.170 1.00 0.00 H new ATOM 0 HD3 ARG A 98 8.561 -5.482 -13.502 1.00 0.00 H new ATOM 0 HE ARG A 98 5.880 -5.721 -12.685 1.00 0.00 H new ATOM 0 HH11 ARG A 98 7.592 -4.120 -15.363 1.00 0.00 H new ATOM 0 HH12 ARG A 98 6.218 -4.303 -16.458 1.00 0.00 H new ATOM 0 HH21 ARG A 98 4.176 -5.846 -14.045 1.00 0.00 H new ATOM 0 HH22 ARG A 98 4.300 -5.272 -15.711 1.00 0.00 H new ATOM 1574 N LEU A 99 12.150 -5.123 -9.621 1.00 0.00 N ATOM 1575 CA LEU A 99 13.289 -4.694 -8.840 1.00 0.00 C ATOM 1576 C LEU A 99 14.572 -5.031 -9.535 1.00 0.00 C ATOM 1577 O LEU A 99 14.903 -6.190 -9.756 1.00 0.00 O ATOM 1578 CB LEU A 99 13.226 -5.293 -7.434 1.00 0.00 C ATOM 1579 CG LEU A 99 12.238 -4.620 -6.468 1.00 0.00 C ATOM 1580 CD1 LEU A 99 10.756 -4.781 -6.810 1.00 0.00 C ATOM 1581 CD2 LEU A 99 12.547 -4.974 -5.039 1.00 0.00 C ATOM 0 H LEU A 99 11.659 -5.916 -9.209 1.00 0.00 H new ATOM 0 HA LEU A 99 13.256 -3.609 -8.739 1.00 0.00 H new ATOM 0 HB2 LEU A 99 12.962 -6.347 -7.519 1.00 0.00 H new ATOM 0 HB3 LEU A 99 14.223 -5.249 -6.995 1.00 0.00 H new ATOM 0 HG LEU A 99 12.404 -3.551 -6.602 1.00 0.00 H new ATOM 0 HD11 LEU A 99 10.152 -4.267 -6.062 1.00 0.00 H new ATOM 0 HD12 LEU A 99 10.561 -4.351 -7.792 1.00 0.00 H new ATOM 0 HD13 LEU A 99 10.498 -5.840 -6.819 1.00 0.00 H new ATOM 0 HD21 LEU A 99 11.831 -4.483 -4.380 1.00 0.00 H new ATOM 0 HD22 LEU A 99 12.479 -6.054 -4.909 1.00 0.00 H new ATOM 0 HD23 LEU A 99 13.555 -4.642 -4.792 1.00 0.00 H new ATOM 1593 N LYS A 100 15.271 -4.002 -9.884 1.00 0.00 N ATOM 1594 CA LYS A 100 16.465 -4.110 -10.663 1.00 0.00 C ATOM 1595 C LYS A 100 17.739 -4.105 -9.849 1.00 0.00 C ATOM 1596 O LYS A 100 18.467 -5.091 -9.823 1.00 0.00 O ATOM 1597 CB LYS A 100 16.498 -3.004 -11.693 1.00 0.00 C ATOM 1598 CG LYS A 100 15.502 -3.205 -12.811 1.00 0.00 C ATOM 1599 CD LYS A 100 15.579 -2.108 -13.844 1.00 0.00 C ATOM 1600 CE LYS A 100 14.679 -2.418 -15.025 1.00 0.00 C ATOM 1601 NZ LYS A 100 15.060 -3.689 -15.687 1.00 0.00 N1+ ATOM 0 H LYS A 100 15.026 -3.044 -9.632 1.00 0.00 H new ATOM 0 HA LYS A 100 16.430 -5.086 -11.147 1.00 0.00 H new ATOM 0 HB2 LYS A 100 16.296 -2.052 -11.202 1.00 0.00 H new ATOM 0 HB3 LYS A 100 17.501 -2.939 -12.115 1.00 0.00 H new ATOM 0 HG2 LYS A 100 15.685 -4.167 -13.290 1.00 0.00 H new ATOM 0 HG3 LYS A 100 14.495 -3.242 -12.396 1.00 0.00 H new ATOM 0 HD2 LYS A 100 15.285 -1.159 -13.396 1.00 0.00 H new ATOM 0 HD3 LYS A 100 16.608 -1.994 -14.185 1.00 0.00 H new ATOM 0 HE2 LYS A 100 13.644 -2.479 -14.688 1.00 0.00 H new ATOM 0 HE3 LYS A 100 14.731 -1.602 -15.746 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 14.660 -3.714 -16.647 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 16.096 -3.755 -15.742 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 14.691 -4.491 -15.137 1.00 0.00 H new ATOM 1615 N GLU A 101 18.005 -3.022 -9.178 1.00 0.00 N ATOM 1616 CA GLU A 101 19.247 -2.862 -8.514 1.00 0.00 C ATOM 1617 C GLU A 101 19.147 -1.883 -7.379 1.00 0.00 C ATOM 1618 O GLU A 101 18.375 -0.914 -7.415 1.00 0.00 O ATOM 1619 CB GLU A 101 20.358 -2.456 -9.482 1.00 0.00 C ATOM 1620 CG GLU A 101 20.112 -1.155 -10.218 1.00 0.00 C ATOM 1621 CD GLU A 101 21.256 -0.783 -11.104 1.00 0.00 C ATOM 1622 OE1 GLU A 101 21.295 -1.230 -12.262 1.00 0.00 O1- ATOM 1623 OE2 GLU A 101 22.144 -0.047 -10.669 1.00 0.00 O ATOM 0 H GLU A 101 17.365 -2.234 -9.081 1.00 0.00 H new ATOM 0 HA GLU A 101 19.508 -3.834 -8.096 1.00 0.00 H new ATOM 0 HB2 GLU A 101 21.292 -2.373 -8.927 1.00 0.00 H new ATOM 0 HB3 GLU A 101 20.492 -3.252 -10.214 1.00 0.00 H new ATOM 0 HG2 GLU A 101 19.205 -1.244 -10.816 1.00 0.00 H new ATOM 0 HG3 GLU A 101 19.940 -0.357 -9.495 1.00 0.00 H new ATOM 1630 N LYS A 102 19.872 -2.216 -6.382 1.00 0.00 N ATOM 1631 CA LYS A 102 20.015 -1.508 -5.141 1.00 0.00 C ATOM 1632 C LYS A 102 20.708 -0.176 -5.337 1.00 0.00 C ATOM 1633 O LYS A 102 21.806 -0.107 -5.888 1.00 0.00 O ATOM 1634 CB LYS A 102 20.846 -2.347 -4.170 1.00 0.00 C ATOM 1635 CG LYS A 102 20.818 -1.817 -2.744 1.00 0.00 C ATOM 1636 CD LYS A 102 21.807 -2.532 -1.843 1.00 0.00 C ATOM 1637 CE LYS A 102 21.578 -4.041 -1.761 1.00 0.00 C ATOM 1638 NZ LYS A 102 20.240 -4.409 -1.249 1.00 0.00 N1+ ATOM 0 H LYS A 102 20.437 -3.065 -6.401 1.00 0.00 H new ATOM 0 HA LYS A 102 19.016 -1.328 -4.744 1.00 0.00 H new ATOM 0 HB2 LYS A 102 20.476 -3.372 -4.177 1.00 0.00 H new ATOM 0 HB3 LYS A 102 21.878 -2.379 -4.519 1.00 0.00 H new ATOM 0 HG2 LYS A 102 21.042 -0.750 -2.751 1.00 0.00 H new ATOM 0 HG3 LYS A 102 19.813 -1.929 -2.337 1.00 0.00 H new ATOM 0 HD2 LYS A 102 22.818 -2.345 -2.206 1.00 0.00 H new ATOM 0 HD3 LYS A 102 21.745 -2.108 -0.841 1.00 0.00 H new ATOM 0 HE2 LYS A 102 21.711 -4.475 -2.752 1.00 0.00 H new ATOM 0 HE3 LYS A 102 22.339 -4.481 -1.116 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 20.336 -5.157 -0.533 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 19.791 -3.575 -0.820 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 19.651 -4.754 -2.034 1.00 0.00 H new ATOM 1652 N LEU A 103 20.056 0.869 -4.920 1.00 0.00 N ATOM 1653 CA LEU A 103 20.651 2.185 -4.911 1.00 0.00 C ATOM 1654 C LEU A 103 21.237 2.400 -3.578 1.00 0.00 C ATOM 1655 O LEU A 103 22.454 2.538 -3.398 1.00 0.00 O ATOM 1656 CB LEU A 103 19.593 3.268 -5.024 1.00 0.00 C ATOM 1657 CG LEU A 103 18.905 3.540 -6.287 1.00 0.00 C ATOM 1658 CD1 LEU A 103 19.919 3.921 -7.284 1.00 0.00 C ATOM 1659 CD2 LEU A 103 18.097 2.364 -6.738 1.00 0.00 C ATOM 0 H LEU A 103 19.096 0.840 -4.575 1.00 0.00 H new ATOM 0 HA LEU A 103 21.362 2.237 -5.736 1.00 0.00 H new ATOM 0 HB2 LEU A 103 18.823 3.036 -4.288 1.00 0.00 H new ATOM 0 HB3 LEU A 103 20.061 4.201 -4.712 1.00 0.00 H new ATOM 0 HG LEU A 103 18.196 4.357 -6.154 1.00 0.00 H new ATOM 0 HD11 LEU A 103 19.432 4.130 -8.237 1.00 0.00 H new ATOM 0 HD12 LEU A 103 20.447 4.812 -6.944 1.00 0.00 H new ATOM 0 HD13 LEU A 103 20.629 3.104 -7.411 1.00 0.00 H new ATOM 0 HD21 LEU A 103 17.601 2.603 -7.679 1.00 0.00 H new ATOM 0 HD22 LEU A 103 18.753 1.505 -6.882 1.00 0.00 H new ATOM 0 HD23 LEU A 103 17.348 2.126 -5.983 1.00 0.00 H new ATOM 1671 N THR A 104 20.356 2.391 -2.630 1.00 0.00 N ATOM 1672 CA THR A 104 20.737 2.715 -1.288 1.00 0.00 C ATOM 1673 C THR A 104 19.848 1.997 -0.255 1.00 0.00 C ATOM 1674 O THR A 104 19.252 0.953 -0.547 1.00 0.00 O ATOM 1675 CB THR A 104 20.753 4.282 -1.080 1.00 0.00 C ATOM 1676 OG1 THR A 104 21.436 4.625 0.137 1.00 0.00 O ATOM 1677 CG2 THR A 104 19.351 4.877 -1.023 1.00 0.00 C ATOM 0 H THR A 104 19.370 2.164 -2.757 1.00 0.00 H new ATOM 0 HA THR A 104 21.751 2.351 -1.124 1.00 0.00 H new ATOM 0 HB THR A 104 21.274 4.697 -1.943 1.00 0.00 H new ATOM 0 HG1 THR A 104 21.295 5.574 0.335 1.00 0.00 H new ATOM 0 HG21 THR A 104 19.419 5.955 -0.879 1.00 0.00 H new ATOM 0 HG22 THR A 104 18.829 4.668 -1.957 1.00 0.00 H new ATOM 0 HG23 THR A 104 18.801 4.434 -0.193 1.00 0.00 H new ATOM 1685 N TYR A 105 19.778 2.582 0.912 1.00 0.00 N ATOM 1686 CA TYR A 105 19.190 2.032 2.093 1.00 0.00 C ATOM 1687 C TYR A 105 18.896 3.138 3.071 1.00 0.00 C ATOM 1688 O TYR A 105 19.583 4.165 3.090 1.00 0.00 O ATOM 1689 CB TYR A 105 20.065 0.917 2.717 1.00 0.00 C ATOM 1690 CG TYR A 105 21.542 1.228 2.804 1.00 0.00 C ATOM 1691 CD1 TYR A 105 22.064 2.000 3.829 1.00 0.00 C ATOM 1692 CD2 TYR A 105 22.412 0.738 1.844 1.00 0.00 C ATOM 1693 CE1 TYR A 105 23.412 2.279 3.892 1.00 0.00 C ATOM 1694 CE2 TYR A 105 23.762 1.011 1.898 1.00 0.00 C ATOM 1695 CZ TYR A 105 24.257 1.782 2.925 1.00 0.00 C ATOM 1696 OH TYR A 105 25.612 2.065 2.985 1.00 0.00 O ATOM 0 H TYR A 105 20.157 3.516 1.067 1.00 0.00 H new ATOM 0 HA TYR A 105 18.250 1.551 1.821 1.00 0.00 H new ATOM 0 HB2 TYR A 105 19.695 0.706 3.720 1.00 0.00 H new ATOM 0 HB3 TYR A 105 19.936 0.006 2.132 1.00 0.00 H new ATOM 0 HD1 TYR A 105 21.404 2.389 4.590 1.00 0.00 H new ATOM 0 HD2 TYR A 105 22.026 0.131 1.039 1.00 0.00 H new ATOM 0 HE1 TYR A 105 23.804 2.885 4.696 1.00 0.00 H new ATOM 0 HE2 TYR A 105 24.426 0.623 1.140 1.00 0.00 H new ATOM 0 HH TYR A 105 26.069 1.639 2.230 1.00 0.00 H new ATOM 1706 N LEU A 106 17.879 2.961 3.823 1.00 0.00 N ATOM 1707 CA LEU A 106 17.488 3.919 4.817 1.00 0.00 C ATOM 1708 C LEU A 106 17.450 3.280 6.196 1.00 0.00 C ATOM 1709 O LEU A 106 17.250 2.065 6.328 1.00 0.00 O ATOM 1710 CB LEU A 106 16.145 4.568 4.469 1.00 0.00 C ATOM 1711 CG LEU A 106 14.906 3.669 4.419 1.00 0.00 C ATOM 1712 CD1 LEU A 106 13.887 4.161 5.429 1.00 0.00 C ATOM 1713 CD2 LEU A 106 14.288 3.659 3.019 1.00 0.00 C ATOM 0 H LEU A 106 17.277 2.139 3.776 1.00 0.00 H new ATOM 0 HA LEU A 106 18.238 4.710 4.832 1.00 0.00 H new ATOM 0 HB2 LEU A 106 15.956 5.357 5.197 1.00 0.00 H new ATOM 0 HB3 LEU A 106 16.248 5.049 3.497 1.00 0.00 H new ATOM 0 HG LEU A 106 15.206 2.650 4.663 1.00 0.00 H new ATOM 0 HD11 LEU A 106 13.004 3.523 5.395 1.00 0.00 H new ATOM 0 HD12 LEU A 106 14.320 4.128 6.429 1.00 0.00 H new ATOM 0 HD13 LEU A 106 13.603 5.186 5.190 1.00 0.00 H new ATOM 0 HD21 LEU A 106 13.410 3.013 3.013 1.00 0.00 H new ATOM 0 HD22 LEU A 106 13.994 4.672 2.744 1.00 0.00 H new ATOM 0 HD23 LEU A 106 15.018 3.285 2.301 1.00 0.00 H new ATOM 1725 N SER A 107 17.652 4.085 7.204 1.00 0.00 N ATOM 1726 CA SER A 107 17.700 3.627 8.574 1.00 0.00 C ATOM 1727 C SER A 107 16.287 3.492 9.221 1.00 0.00 C ATOM 1728 O SER A 107 15.309 4.087 8.739 1.00 0.00 O ATOM 1729 CB SER A 107 18.611 4.583 9.340 1.00 0.00 C ATOM 1730 OG SER A 107 18.359 5.932 8.955 1.00 0.00 O ATOM 0 H SER A 107 17.790 5.090 7.100 1.00 0.00 H new ATOM 0 HA SER A 107 18.104 2.615 8.611 1.00 0.00 H new ATOM 0 HB2 SER A 107 18.449 4.469 10.412 1.00 0.00 H new ATOM 0 HB3 SER A 107 19.654 4.333 9.147 1.00 0.00 H new ATOM 0 HG SER A 107 18.950 6.531 9.457 1.00 0.00 H new ATOM 1736 N ASP A 108 16.197 2.722 10.322 1.00 0.00 N ATOM 1737 CA ASP A 108 14.912 2.473 11.049 1.00 0.00 C ATOM 1738 C ASP A 108 14.337 3.767 11.595 1.00 0.00 C ATOM 1739 O ASP A 108 13.141 4.030 11.521 1.00 0.00 O ATOM 1740 CB ASP A 108 15.103 1.478 12.202 1.00 0.00 C ATOM 1741 CG ASP A 108 13.827 1.279 13.012 1.00 0.00 C ATOM 1742 OD1 ASP A 108 12.883 0.625 12.512 1.00 0.00 O ATOM 1743 OD2 ASP A 108 13.748 1.752 14.165 1.00 0.00 O1- ATOM 0 H ASP A 108 17.000 2.252 10.740 1.00 0.00 H new ATOM 0 HA ASP A 108 14.216 2.045 10.328 1.00 0.00 H new ATOM 0 HB2 ASP A 108 15.429 0.519 11.801 1.00 0.00 H new ATOM 0 HB3 ASP A 108 15.896 1.835 12.859 1.00 0.00 H new ATOM 1748 N ASP A 109 15.219 4.575 12.095 1.00 0.00 N ATOM 1749 CA ASP A 109 14.935 5.924 12.611 1.00 0.00 C ATOM 1750 C ASP A 109 14.448 6.852 11.499 1.00 0.00 C ATOM 1751 O ASP A 109 14.091 7.965 11.744 1.00 0.00 O ATOM 1752 CB ASP A 109 16.153 6.477 13.358 1.00 0.00 C ATOM 1753 CG ASP A 109 16.022 7.920 13.803 1.00 0.00 C ATOM 1754 OD1 ASP A 109 15.295 8.208 14.764 1.00 0.00 O1- ATOM 1755 OD2 ASP A 109 16.671 8.813 13.179 1.00 0.00 O ATOM 0 H ASP A 109 16.205 4.324 12.168 1.00 0.00 H new ATOM 0 HA ASP A 109 14.119 5.861 13.331 1.00 0.00 H new ATOM 0 HB2 ASP A 109 16.337 5.856 14.235 1.00 0.00 H new ATOM 0 HB3 ASP A 109 17.028 6.388 12.714 1.00 0.00 H new ATOM 1760 N LYS A 110 14.650 6.485 10.284 1.00 0.00 N ATOM 1761 CA LYS A 110 14.011 7.175 9.199 1.00 0.00 C ATOM 1762 C LYS A 110 12.693 6.513 8.874 1.00 0.00 C ATOM 1763 O LYS A 110 11.689 7.172 8.577 1.00 0.00 O ATOM 1764 CB LYS A 110 14.920 7.344 8.005 1.00 0.00 C ATOM 1765 CG LYS A 110 16.097 8.211 8.355 1.00 0.00 C ATOM 1766 CD LYS A 110 16.942 8.554 7.172 1.00 0.00 C ATOM 1767 CE LYS A 110 18.050 9.489 7.597 1.00 0.00 C ATOM 1768 NZ LYS A 110 17.526 10.737 8.184 1.00 0.00 N1+ ATOM 0 H LYS A 110 15.252 5.710 10.006 1.00 0.00 H new ATOM 0 HA LYS A 110 13.791 8.195 9.515 1.00 0.00 H new ATOM 0 HB2 LYS A 110 15.268 6.369 7.665 1.00 0.00 H new ATOM 0 HB3 LYS A 110 14.366 7.790 7.179 1.00 0.00 H new ATOM 0 HG2 LYS A 110 15.739 9.131 8.818 1.00 0.00 H new ATOM 0 HG3 LYS A 110 16.710 7.699 9.097 1.00 0.00 H new ATOM 0 HD2 LYS A 110 17.364 7.647 6.738 1.00 0.00 H new ATOM 0 HD3 LYS A 110 16.332 9.023 6.400 1.00 0.00 H new ATOM 0 HE2 LYS A 110 18.689 8.987 8.324 1.00 0.00 H new ATOM 0 HE3 LYS A 110 18.673 9.728 6.735 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 18.317 11.371 8.415 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 16.896 11.204 7.501 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 16.995 10.517 9.050 1.00 0.00 H new ATOM 1782 N MET A 111 12.681 5.199 8.982 1.00 0.00 N ATOM 1783 CA MET A 111 11.551 4.414 8.676 1.00 0.00 C ATOM 1784 C MET A 111 10.327 4.605 9.530 1.00 0.00 C ATOM 1785 O MET A 111 9.207 4.391 9.081 1.00 0.00 O ATOM 1786 CB MET A 111 11.920 3.004 8.405 1.00 0.00 C ATOM 1787 CG MET A 111 10.775 2.113 8.098 1.00 0.00 C ATOM 1788 SD MET A 111 11.291 0.538 7.441 1.00 0.00 S ATOM 1789 CE MET A 111 12.127 1.120 5.996 1.00 0.00 C ATOM 0 H MET A 111 13.486 4.656 9.294 1.00 0.00 H new ATOM 0 HA MET A 111 11.182 4.830 7.739 1.00 0.00 H new ATOM 0 HB2 MET A 111 12.617 2.979 7.567 1.00 0.00 H new ATOM 0 HB3 MET A 111 12.449 2.608 9.272 1.00 0.00 H new ATOM 0 HG2 MET A 111 10.192 1.951 9.004 1.00 0.00 H new ATOM 0 HG3 MET A 111 10.119 2.605 7.380 1.00 0.00 H new ATOM 0 HE1 MET A 111 12.182 0.318 5.260 1.00 0.00 H new ATOM 0 HE2 MET A 111 11.580 1.963 5.574 1.00 0.00 H new ATOM 0 HE3 MET A 111 13.135 1.438 6.262 1.00 0.00 H new ATOM 1799 N LYS A 112 10.529 5.022 10.689 1.00 0.00 N ATOM 1800 CA LYS A 112 9.485 5.380 11.563 1.00 0.00 C ATOM 1801 C LYS A 112 8.587 6.467 11.003 1.00 0.00 C ATOM 1802 O LYS A 112 7.580 6.732 11.553 1.00 0.00 O ATOM 1803 CB LYS A 112 9.968 5.710 12.984 1.00 0.00 C ATOM 1804 CG LYS A 112 11.336 6.281 13.257 1.00 0.00 C ATOM 1805 CD LYS A 112 11.440 7.769 12.957 1.00 0.00 C ATOM 1806 CE LYS A 112 11.324 8.108 11.479 1.00 0.00 C ATOM 1807 NZ LYS A 112 11.900 9.461 11.193 1.00 0.00 N1+ ATOM 0 H LYS A 112 11.460 5.135 11.090 1.00 0.00 H new ATOM 0 HA LYS A 112 8.871 4.484 11.649 1.00 0.00 H new ATOM 0 HB2 LYS A 112 9.247 6.411 13.405 1.00 0.00 H new ATOM 0 HB3 LYS A 112 9.892 4.789 13.562 1.00 0.00 H new ATOM 0 HG2 LYS A 112 11.591 6.110 14.303 1.00 0.00 H new ATOM 0 HG3 LYS A 112 12.072 5.745 12.658 1.00 0.00 H new ATOM 0 HD2 LYS A 112 10.657 8.296 13.503 1.00 0.00 H new ATOM 0 HD3 LYS A 112 12.394 8.139 13.331 1.00 0.00 H new ATOM 0 HE2 LYS A 112 11.844 7.355 10.887 1.00 0.00 H new ATOM 0 HE3 LYS A 112 10.277 8.083 11.177 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 11.763 9.691 10.188 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 11.421 10.173 11.780 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 12.917 9.459 11.413 1.00 0.00 H new ATOM 1821 N GLU A 113 9.007 7.161 9.947 1.00 0.00 N ATOM 1822 CA GLU A 113 8.106 8.048 9.311 1.00 0.00 C ATOM 1823 C GLU A 113 7.404 7.264 8.341 1.00 0.00 C ATOM 1824 O GLU A 113 6.265 7.135 8.407 1.00 0.00 O ATOM 1825 CB GLU A 113 8.758 9.217 8.657 1.00 0.00 C ATOM 1826 CG GLU A 113 9.429 10.117 9.605 1.00 0.00 C ATOM 1827 CD GLU A 113 10.147 11.274 8.960 1.00 0.00 C ATOM 1828 OE1 GLU A 113 9.524 12.273 8.599 1.00 0.00 O1- ATOM 1829 OE2 GLU A 113 11.385 11.177 8.831 1.00 0.00 O ATOM 0 H GLU A 113 9.942 7.113 9.542 1.00 0.00 H new ATOM 0 HA GLU A 113 7.449 8.487 10.062 1.00 0.00 H new ATOM 0 HB2 GLU A 113 9.487 8.858 7.931 1.00 0.00 H new ATOM 0 HB3 GLU A 113 8.007 9.780 8.103 1.00 0.00 H new ATOM 0 HG2 GLU A 113 8.689 10.508 10.303 1.00 0.00 H new ATOM 0 HG3 GLU A 113 10.146 9.541 10.190 1.00 0.00 H new ATOM 1836 N VAL A 114 8.172 6.638 7.525 1.00 0.00 N ATOM 1837 CA VAL A 114 7.720 5.836 6.445 1.00 0.00 C ATOM 1838 C VAL A 114 6.570 4.827 6.827 1.00 0.00 C ATOM 1839 O VAL A 114 5.519 4.851 6.200 1.00 0.00 O ATOM 1840 CB VAL A 114 8.954 5.169 5.799 1.00 0.00 C ATOM 1841 CG1 VAL A 114 8.631 3.847 5.234 1.00 0.00 C ATOM 1842 CG2 VAL A 114 9.542 6.083 4.732 1.00 0.00 C ATOM 0 H VAL A 114 9.189 6.673 7.596 1.00 0.00 H new ATOM 0 HA VAL A 114 7.231 6.474 5.709 1.00 0.00 H new ATOM 0 HB VAL A 114 9.697 5.011 6.581 1.00 0.00 H new ATOM 0 HG11 VAL A 114 9.526 3.413 4.790 1.00 0.00 H new ATOM 0 HG12 VAL A 114 8.265 3.193 6.025 1.00 0.00 H new ATOM 0 HG13 VAL A 114 7.863 3.956 4.469 1.00 0.00 H new ATOM 0 HG21 VAL A 114 10.412 5.604 4.282 1.00 0.00 H new ATOM 0 HG22 VAL A 114 8.794 6.273 3.963 1.00 0.00 H new ATOM 0 HG23 VAL A 114 9.842 7.027 5.187 1.00 0.00 H new ATOM 1852 N ASP A 115 6.754 4.014 7.868 1.00 0.00 N ATOM 1853 CA ASP A 115 5.673 3.057 8.302 1.00 0.00 C ATOM 1854 C ASP A 115 4.457 3.814 8.828 1.00 0.00 C ATOM 1855 O ASP A 115 3.307 3.552 8.506 1.00 0.00 O ATOM 1856 CB ASP A 115 6.144 2.179 9.470 1.00 0.00 C ATOM 1857 CG ASP A 115 7.150 1.103 9.151 1.00 0.00 C ATOM 1858 OD1 ASP A 115 6.798 0.108 8.508 1.00 0.00 O ATOM 1859 OD2 ASP A 115 8.304 1.215 9.632 1.00 0.00 O1- ATOM 0 H ASP A 115 7.606 3.979 8.428 1.00 0.00 H new ATOM 0 HA ASP A 115 5.430 2.457 7.425 1.00 0.00 H new ATOM 0 HB2 ASP A 115 6.573 2.830 10.232 1.00 0.00 H new ATOM 0 HB3 ASP A 115 5.268 1.704 9.912 1.00 0.00 H new ATOM 1864 N ASN A 116 4.763 4.748 9.614 1.00 0.00 N ATOM 1865 CA ASN A 116 3.849 5.537 10.408 1.00 0.00 C ATOM 1866 C ASN A 116 3.057 6.548 9.580 1.00 0.00 C ATOM 1867 O ASN A 116 1.854 6.723 9.798 1.00 0.00 O ATOM 1868 CB ASN A 116 4.775 6.164 11.345 1.00 0.00 C ATOM 1869 CG ASN A 116 4.375 7.316 12.148 1.00 0.00 C ATOM 1870 OD1 ASN A 116 3.232 7.511 12.586 1.00 0.00 O ATOM 1871 ND2 ASN A 116 5.363 8.105 12.293 1.00 0.00 N ATOM 0 H ASN A 116 5.733 5.029 9.753 1.00 0.00 H new ATOM 0 HA ASN A 116 3.056 4.960 10.883 1.00 0.00 H new ATOM 0 HB2 ASN A 116 5.098 5.389 12.040 1.00 0.00 H new ATOM 0 HB3 ASN A 116 5.652 6.465 10.772 1.00 0.00 H new ATOM 0 HD21 ASN A 116 5.246 8.979 12.805 1.00 0.00 H new ATOM 0 HD22 ASN A 116 6.271 7.863 11.897 1.00 0.00 H new ATOM 1878 N ALA A 117 3.731 7.165 8.623 1.00 0.00 N ATOM 1879 CA ALA A 117 3.167 8.102 7.663 1.00 0.00 C ATOM 1880 C ALA A 117 2.093 7.404 6.915 1.00 0.00 C ATOM 1881 O ALA A 117 1.009 7.918 6.695 1.00 0.00 O ATOM 1882 CB ALA A 117 4.245 8.506 6.663 1.00 0.00 C ATOM 0 H ALA A 117 4.732 7.020 8.488 1.00 0.00 H new ATOM 0 HA ALA A 117 2.784 8.981 8.181 1.00 0.00 H new ATOM 0 HB1 ALA A 117 3.827 9.208 5.941 1.00 0.00 H new ATOM 0 HB2 ALA A 117 5.073 8.978 7.192 1.00 0.00 H new ATOM 0 HB3 ALA A 117 4.606 7.621 6.140 1.00 0.00 H new ATOM 1888 N LEU A 118 2.388 6.165 6.635 1.00 0.00 N ATOM 1889 CA LEU A 118 1.618 5.321 5.873 1.00 0.00 C ATOM 1890 C LEU A 118 0.342 4.951 6.631 1.00 0.00 C ATOM 1891 O LEU A 118 -0.716 4.876 6.049 1.00 0.00 O ATOM 1892 CB LEU A 118 2.484 4.128 5.630 1.00 0.00 C ATOM 1893 CG LEU A 118 1.996 3.081 4.725 1.00 0.00 C ATOM 1894 CD1 LEU A 118 2.329 3.401 3.275 1.00 0.00 C ATOM 1895 CD2 LEU A 118 2.519 1.752 5.151 1.00 0.00 C ATOM 0 H LEU A 118 3.241 5.721 6.974 1.00 0.00 H new ATOM 0 HA LEU A 118 1.294 5.771 4.935 1.00 0.00 H new ATOM 0 HB2 LEU A 118 3.438 4.484 5.241 1.00 0.00 H new ATOM 0 HB3 LEU A 118 2.687 3.664 6.595 1.00 0.00 H new ATOM 0 HG LEU A 118 0.908 3.042 4.786 1.00 0.00 H new ATOM 0 HD11 LEU A 118 1.954 2.605 2.631 1.00 0.00 H new ATOM 0 HD12 LEU A 118 1.863 4.345 2.994 1.00 0.00 H new ATOM 0 HD13 LEU A 118 3.410 3.482 3.159 1.00 0.00 H new ATOM 0 HD21 LEU A 118 2.151 0.982 4.473 1.00 0.00 H new ATOM 0 HD22 LEU A 118 3.609 1.765 5.128 1.00 0.00 H new ATOM 0 HD23 LEU A 118 2.180 1.535 6.164 1.00 0.00 H new ATOM 1907 N MET A 119 0.438 4.753 7.943 1.00 0.00 N ATOM 1908 CA MET A 119 -0.705 4.457 8.745 1.00 0.00 C ATOM 1909 C MET A 119 -1.635 5.652 8.842 1.00 0.00 C ATOM 1910 O MET A 119 -2.783 5.503 9.209 1.00 0.00 O ATOM 1911 CB MET A 119 -0.255 4.100 10.105 1.00 0.00 C ATOM 1912 CG MET A 119 0.613 2.869 10.173 1.00 0.00 C ATOM 1913 SD MET A 119 1.376 2.661 11.775 1.00 0.00 S ATOM 1914 CE MET A 119 -0.064 2.957 12.756 1.00 0.00 C ATOM 0 H MET A 119 1.315 4.797 8.462 1.00 0.00 H new ATOM 0 HA MET A 119 -1.245 3.632 8.281 1.00 0.00 H new ATOM 0 HB2 MET A 119 0.296 4.942 10.524 1.00 0.00 H new ATOM 0 HB3 MET A 119 -1.131 3.947 10.735 1.00 0.00 H new ATOM 0 HG2 MET A 119 0.011 1.990 9.944 1.00 0.00 H new ATOM 0 HG3 MET A 119 1.389 2.932 9.410 1.00 0.00 H new ATOM 0 HE1 MET A 119 0.090 2.556 13.758 1.00 0.00 H new ATOM 0 HE2 MET A 119 -0.247 4.030 12.819 1.00 0.00 H new ATOM 0 HE3 MET A 119 -0.924 2.468 12.297 1.00 0.00 H new ATOM 1924 N ILE A 120 -1.128 6.827 8.563 1.00 0.00 N ATOM 1925 CA ILE A 120 -1.943 8.027 8.572 1.00 0.00 C ATOM 1926 C ILE A 120 -2.648 8.103 7.269 1.00 0.00 C ATOM 1927 O ILE A 120 -3.862 8.104 7.216 1.00 0.00 O ATOM 1928 CB ILE A 120 -1.093 9.273 8.685 1.00 0.00 C ATOM 1929 CG1 ILE A 120 -0.199 9.134 9.864 1.00 0.00 C ATOM 1930 CG2 ILE A 120 -1.992 10.475 8.818 1.00 0.00 C ATOM 1931 CD1 ILE A 120 0.909 10.132 9.916 1.00 0.00 C ATOM 0 H ILE A 120 -0.149 6.984 8.325 1.00 0.00 H new ATOM 0 HA ILE A 120 -2.624 7.977 9.422 1.00 0.00 H new ATOM 0 HB ILE A 120 -0.478 9.405 7.795 1.00 0.00 H new ATOM 0 HG12 ILE A 120 -0.797 9.225 10.771 1.00 0.00 H new ATOM 0 HG13 ILE A 120 0.230 8.132 9.864 1.00 0.00 H new ATOM 0 HG21 ILE A 120 -1.385 11.376 8.900 1.00 0.00 H new ATOM 0 HG22 ILE A 120 -2.634 10.548 7.940 1.00 0.00 H new ATOM 0 HG23 ILE A 120 -2.609 10.371 9.711 1.00 0.00 H new ATOM 0 HD11 ILE A 120 1.513 9.959 10.807 1.00 0.00 H new ATOM 0 HD12 ILE A 120 1.534 10.029 9.029 1.00 0.00 H new ATOM 0 HD13 ILE A 120 0.491 11.138 9.950 1.00 0.00 H new ATOM 1943 N SER A 121 -1.849 8.143 6.231 1.00 0.00 N ATOM 1944 CA SER A 121 -2.285 8.150 4.863 1.00 0.00 C ATOM 1945 C SER A 121 -3.343 7.049 4.585 1.00 0.00 C ATOM 1946 O SER A 121 -4.385 7.283 3.980 1.00 0.00 O ATOM 1947 CB SER A 121 -1.043 7.872 4.088 1.00 0.00 C ATOM 1948 OG SER A 121 -0.100 8.905 4.224 1.00 0.00 O ATOM 0 H SER A 121 -0.834 8.173 6.325 1.00 0.00 H new ATOM 0 HA SER A 121 -2.762 9.093 4.597 1.00 0.00 H new ATOM 0 HB2 SER A 121 -0.605 6.933 4.428 1.00 0.00 H new ATOM 0 HB3 SER A 121 -1.293 7.744 3.035 1.00 0.00 H new ATOM 0 HG SER A 121 0.576 8.826 3.519 1.00 0.00 H new ATOM 1954 N LEU A 122 -3.060 5.858 5.031 1.00 0.00 N ATOM 1955 CA LEU A 122 -3.938 4.763 4.870 1.00 0.00 C ATOM 1956 C LEU A 122 -4.968 4.644 6.031 1.00 0.00 C ATOM 1957 O LEU A 122 -5.789 3.761 6.028 1.00 0.00 O ATOM 1958 CB LEU A 122 -3.126 3.483 4.673 1.00 0.00 C ATOM 1959 CG LEU A 122 -2.375 3.315 3.320 1.00 0.00 C ATOM 1960 CD1 LEU A 122 -1.308 4.395 3.019 1.00 0.00 C ATOM 1961 CD2 LEU A 122 -1.798 1.916 3.199 1.00 0.00 C ATOM 0 H LEU A 122 -2.196 5.630 5.523 1.00 0.00 H new ATOM 0 HA LEU A 122 -4.538 4.933 3.976 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -2.392 3.423 5.476 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -3.800 2.634 4.792 1.00 0.00 H new ATOM 0 HG LEU A 122 -3.133 3.465 2.551 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -0.843 4.188 2.055 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -1.782 5.376 2.990 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -0.547 4.382 3.799 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -1.277 1.818 2.247 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -1.098 1.739 4.015 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -2.604 1.184 3.248 1.00 0.00 H new ATOM 1973 N GLY A 123 -4.908 5.547 7.017 1.00 0.00 N ATOM 1974 CA GLY A 123 -5.909 5.607 8.063 1.00 0.00 C ATOM 1975 C GLY A 123 -5.932 4.458 9.038 1.00 0.00 C ATOM 1976 O GLY A 123 -6.937 4.273 9.721 1.00 0.00 O ATOM 0 H GLY A 123 -4.169 6.245 7.103 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -5.760 6.529 8.625 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -6.890 5.675 7.593 1.00 0.00 H new ATOM 1980 N LEU A 124 -4.856 3.692 9.140 1.00 0.00 N ATOM 1981 CA LEU A 124 -4.840 2.613 10.076 1.00 0.00 C ATOM 1982 C LEU A 124 -4.781 3.176 11.439 1.00 0.00 C ATOM 1983 O LEU A 124 -5.641 2.883 12.301 1.00 0.00 O ATOM 1984 CB LEU A 124 -3.650 1.672 9.872 1.00 0.00 C ATOM 1985 CG LEU A 124 -3.650 0.788 8.627 1.00 0.00 C ATOM 1986 CD1 LEU A 124 -3.521 1.557 7.347 1.00 0.00 C ATOM 1987 CD2 LEU A 124 -2.581 -0.234 8.720 1.00 0.00 C ATOM 0 H LEU A 124 -4.004 3.805 8.591 1.00 0.00 H new ATOM 0 HA LEU A 124 -5.746 2.026 9.924 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -2.743 2.277 9.854 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -3.583 1.022 10.745 1.00 0.00 H new ATOM 0 HG LEU A 124 -4.625 0.302 8.598 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -3.528 0.865 6.505 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -4.356 2.251 7.254 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -2.585 2.115 7.350 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -2.594 -0.856 7.825 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -1.613 0.259 8.805 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -2.749 -0.858 9.598 1.00 0.00 H new ATOM 1999 N ASN A 125 -3.823 4.078 11.589 1.00 0.00 N ATOM 2000 CA ASN A 125 -3.463 4.695 12.833 1.00 0.00 C ATOM 2001 C ASN A 125 -3.560 3.660 13.971 1.00 0.00 C ATOM 2002 O ASN A 125 -3.120 2.520 13.814 1.00 0.00 O ATOM 2003 CB ASN A 125 -4.369 5.900 13.045 1.00 0.00 C ATOM 2004 CG ASN A 125 -3.673 6.919 13.839 1.00 0.00 C ATOM 2005 OD1 ASN A 125 -3.744 6.948 15.066 1.00 0.00 O ATOM 2006 ND2 ASN A 125 -2.978 7.729 13.143 1.00 0.00 N ATOM 0 H ASN A 125 -3.258 4.406 10.806 1.00 0.00 H new ATOM 0 HA ASN A 125 -2.431 5.047 12.821 1.00 0.00 H new ATOM 0 HB2 ASN A 125 -4.664 6.317 12.082 1.00 0.00 H new ATOM 0 HB3 ASN A 125 -5.283 5.593 13.553 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -2.434 8.460 13.602 1.00 0.00 H new ATOM 0 HD22 ASN A 125 -2.965 7.647 12.126 1.00 0.00 H new ATOM 2308 N ILE B 14 -16.092 9.426 -0.555 1.00 0.00 N ATOM 2309 CA ILE B 14 -15.526 8.099 -0.400 1.00 0.00 C ATOM 2310 C ILE B 14 -15.378 7.766 1.094 1.00 0.00 C ATOM 2311 O ILE B 14 -14.921 8.599 1.883 1.00 0.00 O ATOM 2312 CB ILE B 14 -14.144 8.009 -1.108 1.00 0.00 C ATOM 2313 CG1 ILE B 14 -14.288 8.358 -2.599 1.00 0.00 C ATOM 2314 CG2 ILE B 14 -13.532 6.622 -0.939 1.00 0.00 C ATOM 2315 CD1 ILE B 14 -12.977 8.381 -3.363 1.00 0.00 C ATOM 0 HA ILE B 14 -16.198 7.376 -0.863 1.00 0.00 H new ATOM 0 HB ILE B 14 -13.473 8.730 -0.642 1.00 0.00 H new ATOM 0 HG12 ILE B 14 -14.955 7.634 -3.067 1.00 0.00 H new ATOM 0 HG13 ILE B 14 -14.764 9.335 -2.688 1.00 0.00 H new ATOM 0 HG21 ILE B 14 -12.566 6.586 -1.443 1.00 0.00 H new ATOM 0 HG22 ILE B 14 -13.395 6.411 0.122 1.00 0.00 H new ATOM 0 HG23 ILE B 14 -14.196 5.876 -1.374 1.00 0.00 H new ATOM 0 HD11 ILE B 14 -13.168 8.635 -4.406 1.00 0.00 H new ATOM 0 HD12 ILE B 14 -12.313 9.125 -2.924 1.00 0.00 H new ATOM 0 HD13 ILE B 14 -12.507 7.399 -3.309 1.00 0.00 H new ATOM 2327 N ARG B 15 -15.803 6.591 1.489 1.00 0.00 N ATOM 2328 CA ARG B 15 -15.682 6.180 2.854 1.00 0.00 C ATOM 2329 C ARG B 15 -14.750 4.988 2.913 1.00 0.00 C ATOM 2330 O ARG B 15 -14.784 4.124 2.029 1.00 0.00 O ATOM 2331 CB ARG B 15 -17.053 5.754 3.408 1.00 0.00 C ATOM 2332 CG ARG B 15 -18.186 6.748 3.176 1.00 0.00 C ATOM 2333 CD ARG B 15 -17.917 8.082 3.829 1.00 0.00 C ATOM 2334 NE ARG B 15 -19.042 9.005 3.661 1.00 0.00 N ATOM 2335 CZ ARG B 15 -19.298 10.034 4.461 1.00 0.00 C ATOM 2336 NH1 ARG B 15 -18.438 10.355 5.430 1.00 0.00 N1+ ATOM 2337 NH2 ARG B 15 -20.396 10.748 4.281 1.00 0.00 N ATOM 0 H ARG B 15 -16.238 5.903 0.875 1.00 0.00 H new ATOM 0 HA ARG B 15 -15.297 7.010 3.447 1.00 0.00 H new ATOM 0 HB2 ARG B 15 -17.329 4.801 2.956 1.00 0.00 H new ATOM 0 HB3 ARG B 15 -16.956 5.582 4.480 1.00 0.00 H new ATOM 0 HG2 ARG B 15 -18.327 6.892 2.105 1.00 0.00 H new ATOM 0 HG3 ARG B 15 -19.116 6.335 3.567 1.00 0.00 H new ATOM 0 HD2 ARG B 15 -17.723 7.934 4.891 1.00 0.00 H new ATOM 0 HD3 ARG B 15 -17.018 8.523 3.399 1.00 0.00 H new ATOM 0 HE ARG B 15 -19.673 8.847 2.875 1.00 0.00 H new ATOM 0 HH11 ARG B 15 -17.585 9.810 5.556 1.00 0.00 H new ATOM 0 HH12 ARG B 15 -18.634 11.145 6.045 1.00 0.00 H new ATOM 0 HH21 ARG B 15 -21.043 10.508 3.530 1.00 0.00 H new ATOM 0 HH22 ARG B 15 -20.596 11.539 4.893 1.00 0.00 H new ATOM 2351 N ARG B 16 -13.868 4.955 3.887 1.00 0.00 N ATOM 2352 CA ARG B 16 -13.088 3.748 4.094 1.00 0.00 C ATOM 2353 C ARG B 16 -14.028 2.607 4.465 1.00 0.00 C ATOM 2354 O ARG B 16 -14.893 2.743 5.348 1.00 0.00 O ATOM 2355 CB ARG B 16 -11.976 3.909 5.135 1.00 0.00 C ATOM 2356 CG ARG B 16 -12.425 4.331 6.517 1.00 0.00 C ATOM 2357 CD ARG B 16 -11.256 4.342 7.484 1.00 0.00 C ATOM 2358 NE ARG B 16 -10.689 3.001 7.722 1.00 0.00 N ATOM 2359 CZ ARG B 16 -9.372 2.702 7.694 1.00 0.00 C ATOM 2360 NH1 ARG B 16 -8.510 3.562 7.174 1.00 0.00 N1+ ATOM 2361 NH2 ARG B 16 -8.953 1.510 8.110 1.00 0.00 N ATOM 0 H ARG B 16 -13.674 5.721 4.531 1.00 0.00 H new ATOM 0 HA ARG B 16 -12.575 3.523 3.159 1.00 0.00 H new ATOM 0 HB2 ARG B 16 -11.443 2.962 5.220 1.00 0.00 H new ATOM 0 HB3 ARG B 16 -11.261 4.644 4.765 1.00 0.00 H new ATOM 0 HG2 ARG B 16 -12.874 5.323 6.471 1.00 0.00 H new ATOM 0 HG3 ARG B 16 -13.195 3.649 6.878 1.00 0.00 H new ATOM 0 HD2 ARG B 16 -10.476 4.996 7.094 1.00 0.00 H new ATOM 0 HD3 ARG B 16 -11.582 4.766 8.434 1.00 0.00 H new ATOM 0 HE ARG B 16 -11.341 2.242 7.923 1.00 0.00 H new ATOM 0 HH11 ARG B 16 -8.841 4.449 6.795 1.00 0.00 H new ATOM 0 HH12 ARG B 16 -7.515 3.337 7.152 1.00 0.00 H new ATOM 0 HH21 ARG B 16 -9.626 0.823 8.450 1.00 0.00 H new ATOM 0 HH22 ARG B 16 -7.959 1.283 8.089 1.00 0.00 H new ATOM 2375 N GLY B 17 -13.895 1.524 3.774 1.00 0.00 N ATOM 2376 CA GLY B 17 -14.783 0.427 3.976 1.00 0.00 C ATOM 2377 C GLY B 17 -15.667 0.207 2.779 1.00 0.00 C ATOM 2378 O GLY B 17 -16.339 -0.806 2.691 1.00 0.00 O ATOM 0 H GLY B 17 -13.179 1.374 3.063 1.00 0.00 H new ATOM 0 HA2 GLY B 17 -14.207 -0.477 4.176 1.00 0.00 H new ATOM 0 HA3 GLY B 17 -15.399 0.613 4.856 1.00 0.00 H new ATOM 2382 N ASP B 18 -15.677 1.160 1.863 1.00 0.00 N ATOM 2383 CA ASP B 18 -16.432 1.036 0.657 1.00 0.00 C ATOM 2384 C ASP B 18 -15.749 0.119 -0.306 1.00 0.00 C ATOM 2385 O ASP B 18 -14.555 -0.225 -0.175 1.00 0.00 O ATOM 2386 CB ASP B 18 -16.591 2.355 -0.077 1.00 0.00 C ATOM 2387 CG ASP B 18 -17.696 3.266 0.386 1.00 0.00 C ATOM 2388 OD1 ASP B 18 -18.862 2.813 0.512 1.00 0.00 O1- ATOM 2389 OD2 ASP B 18 -17.448 4.472 0.532 1.00 0.00 O ATOM 0 H ASP B 18 -15.159 2.035 1.947 1.00 0.00 H new ATOM 0 HA ASP B 18 -17.405 0.658 0.970 1.00 0.00 H new ATOM 0 HB2 ASP B 18 -15.650 2.900 -0.003 1.00 0.00 H new ATOM 0 HB3 ASP B 18 -16.751 2.138 -1.133 1.00 0.00 H new ATOM 2394 N VAL B 19 -16.501 -0.222 -1.265 1.00 0.00 N ATOM 2395 CA VAL B 19 -16.104 -1.020 -2.386 1.00 0.00 C ATOM 2396 C VAL B 19 -16.562 -0.326 -3.671 1.00 0.00 C ATOM 2397 O VAL B 19 -17.726 -0.007 -3.826 1.00 0.00 O ATOM 2398 CB VAL B 19 -16.721 -2.443 -2.297 1.00 0.00 C ATOM 2399 CG1 VAL B 19 -16.607 -3.191 -3.552 1.00 0.00 C ATOM 2400 CG2 VAL B 19 -16.001 -3.265 -1.352 1.00 0.00 C ATOM 0 H VAL B 19 -17.481 0.058 -1.310 1.00 0.00 H new ATOM 0 HA VAL B 19 -15.019 -1.125 -2.387 1.00 0.00 H new ATOM 0 HB VAL B 19 -17.761 -2.268 -2.020 1.00 0.00 H new ATOM 0 HG11 VAL B 19 -17.055 -4.177 -3.430 1.00 0.00 H new ATOM 0 HG12 VAL B 19 -17.126 -2.652 -4.345 1.00 0.00 H new ATOM 0 HG13 VAL B 19 -15.555 -3.301 -3.816 1.00 0.00 H new ATOM 0 HG21 VAL B 19 -16.455 -4.255 -1.311 1.00 0.00 H new ATOM 0 HG22 VAL B 19 -14.961 -3.356 -1.667 1.00 0.00 H new ATOM 0 HG23 VAL B 19 -16.042 -2.805 -0.364 1.00 0.00 H new ATOM 2410 N TYR B 20 -15.636 -0.087 -4.531 1.00 0.00 N ATOM 2411 CA TYR B 20 -15.825 0.529 -5.837 1.00 0.00 C ATOM 2412 C TYR B 20 -15.149 -0.270 -6.874 1.00 0.00 C ATOM 2413 O TYR B 20 -14.172 -0.942 -6.597 1.00 0.00 O ATOM 2414 CB TYR B 20 -15.238 1.953 -5.900 1.00 0.00 C ATOM 2415 CG TYR B 20 -15.939 2.947 -5.058 1.00 0.00 C ATOM 2416 CD1 TYR B 20 -17.007 3.664 -5.551 1.00 0.00 C ATOM 2417 CD2 TYR B 20 -15.552 3.162 -3.772 1.00 0.00 C ATOM 2418 CE1 TYR B 20 -17.678 4.561 -4.766 1.00 0.00 C ATOM 2419 CE2 TYR B 20 -16.197 4.055 -2.989 1.00 0.00 C ATOM 2420 CZ TYR B 20 -17.265 4.757 -3.481 1.00 0.00 C ATOM 2421 OH TYR B 20 -17.949 5.626 -2.670 1.00 0.00 O ATOM 0 H TYR B 20 -14.660 -0.323 -4.350 1.00 0.00 H new ATOM 0 HA TYR B 20 -16.901 0.575 -6.006 1.00 0.00 H new ATOM 0 HB2 TYR B 20 -14.192 1.914 -5.598 1.00 0.00 H new ATOM 0 HB3 TYR B 20 -15.258 2.294 -6.935 1.00 0.00 H new ATOM 0 HD1 TYR B 20 -17.320 3.515 -6.574 1.00 0.00 H new ATOM 0 HD2 TYR B 20 -14.715 2.610 -3.370 1.00 0.00 H new ATOM 0 HE1 TYR B 20 -18.523 5.107 -5.158 1.00 0.00 H new ATOM 0 HE2 TYR B 20 -15.869 4.215 -1.973 1.00 0.00 H new ATOM 0 HH TYR B 20 -17.526 5.650 -1.786 1.00 0.00 H new ATOM 2431 N LEU B 21 -15.706 -0.261 -8.047 1.00 0.00 N ATOM 2432 CA LEU B 21 -15.025 -0.763 -9.156 1.00 0.00 C ATOM 2433 C LEU B 21 -14.047 0.249 -9.558 1.00 0.00 C ATOM 2434 O LEU B 21 -14.291 1.469 -9.429 1.00 0.00 O ATOM 2435 CB LEU B 21 -15.908 -1.077 -10.339 1.00 0.00 C ATOM 2436 CG LEU B 21 -16.808 -2.291 -10.267 1.00 0.00 C ATOM 2437 CD1 LEU B 21 -18.260 -1.862 -10.133 1.00 0.00 C ATOM 2438 CD2 LEU B 21 -16.610 -3.173 -11.498 1.00 0.00 C ATOM 0 H LEU B 21 -16.641 0.097 -8.241 1.00 0.00 H new ATOM 0 HA LEU B 21 -14.571 -1.709 -8.861 1.00 0.00 H new ATOM 0 HB2 LEU B 21 -16.539 -0.207 -10.522 1.00 0.00 H new ATOM 0 HB3 LEU B 21 -15.265 -1.193 -11.211 1.00 0.00 H new ATOM 0 HG LEU B 21 -16.542 -2.875 -9.386 1.00 0.00 H new ATOM 0 HD11 LEU B 21 -18.897 -2.745 -10.082 1.00 0.00 H new ATOM 0 HD12 LEU B 21 -18.383 -1.273 -9.224 1.00 0.00 H new ATOM 0 HD13 LEU B 21 -18.543 -1.260 -10.996 1.00 0.00 H new ATOM 0 HD21 LEU B 21 -17.264 -4.042 -11.432 1.00 0.00 H new ATOM 0 HD22 LEU B 21 -16.852 -2.604 -12.396 1.00 0.00 H new ATOM 0 HD23 LEU B 21 -15.572 -3.503 -11.546 1.00 0.00 H new ATOM 2450 N ALA B 22 -12.994 -0.207 -10.049 1.00 0.00 N ATOM 2451 CA ALA B 22 -11.950 0.649 -10.408 1.00 0.00 C ATOM 2452 C ALA B 22 -11.333 0.197 -11.666 1.00 0.00 C ATOM 2453 O ALA B 22 -11.255 -1.004 -11.944 1.00 0.00 O ATOM 2454 CB ALA B 22 -10.906 0.718 -9.303 1.00 0.00 C ATOM 0 H ALA B 22 -12.817 -1.197 -10.221 1.00 0.00 H new ATOM 0 HA ALA B 22 -12.359 1.649 -10.555 1.00 0.00 H new ATOM 0 HB1 ALA B 22 -10.102 1.390 -9.603 1.00 0.00 H new ATOM 0 HB2 ALA B 22 -11.368 1.091 -8.389 1.00 0.00 H new ATOM 0 HB3 ALA B 22 -10.499 -0.277 -9.124 1.00 0.00 H new ATOM 2460 N ASP B 23 -10.914 1.147 -12.433 1.00 0.00 N ATOM 2461 CA ASP B 23 -10.148 0.896 -13.627 1.00 0.00 C ATOM 2462 C ASP B 23 -8.751 0.796 -13.149 1.00 0.00 C ATOM 2463 O ASP B 23 -7.983 1.737 -13.120 1.00 0.00 O ATOM 2464 CB ASP B 23 -10.314 1.979 -14.688 1.00 0.00 C ATOM 2465 CG ASP B 23 -9.498 1.675 -15.923 1.00 0.00 C ATOM 2466 OD1 ASP B 23 -9.758 0.644 -16.593 1.00 0.00 O1- ATOM 2467 OD2 ASP B 23 -8.587 2.432 -16.231 1.00 0.00 O ATOM 0 H ASP B 23 -11.091 2.135 -12.254 1.00 0.00 H new ATOM 0 HA ASP B 23 -10.484 -0.009 -14.133 1.00 0.00 H new ATOM 0 HB2 ASP B 23 -11.366 2.066 -14.958 1.00 0.00 H new ATOM 0 HB3 ASP B 23 -10.009 2.942 -14.277 1.00 0.00 H new ATOM 2472 N LEU B 24 -8.516 -0.325 -12.620 1.00 0.00 N ATOM 2473 CA LEU B 24 -7.392 -0.614 -11.868 1.00 0.00 C ATOM 2474 C LEU B 24 -6.224 -0.880 -12.767 1.00 0.00 C ATOM 2475 O LEU B 24 -5.081 -0.519 -12.428 1.00 0.00 O ATOM 2476 CB LEU B 24 -7.784 -1.858 -11.071 1.00 0.00 C ATOM 2477 CG LEU B 24 -6.988 -2.347 -9.871 1.00 0.00 C ATOM 2478 CD1 LEU B 24 -7.682 -3.572 -9.361 1.00 0.00 C ATOM 2479 CD2 LEU B 24 -5.578 -2.693 -10.233 1.00 0.00 C ATOM 0 H LEU B 24 -9.152 -1.118 -12.710 1.00 0.00 H new ATOM 0 HA LEU B 24 -7.089 0.205 -11.216 1.00 0.00 H new ATOM 0 HB2 LEU B 24 -8.804 -1.696 -10.723 1.00 0.00 H new ATOM 0 HB3 LEU B 24 -7.817 -2.685 -11.781 1.00 0.00 H new ATOM 0 HG LEU B 24 -6.940 -1.557 -9.122 1.00 0.00 H new ATOM 0 HD11 LEU B 24 -7.145 -3.961 -8.496 1.00 0.00 H new ATOM 0 HD12 LEU B 24 -8.702 -3.318 -9.071 1.00 0.00 H new ATOM 0 HD13 LEU B 24 -7.705 -4.330 -10.144 1.00 0.00 H new ATOM 0 HD21 LEU B 24 -5.048 -3.037 -9.345 1.00 0.00 H new ATOM 0 HD22 LEU B 24 -5.579 -3.483 -10.984 1.00 0.00 H new ATOM 0 HD23 LEU B 24 -5.079 -1.811 -10.634 1.00 0.00 H new ATOM 2491 N SER B 25 -6.456 -1.490 -13.906 1.00 0.00 N ATOM 2492 CA SER B 25 -5.338 -1.958 -14.617 1.00 0.00 C ATOM 2493 C SER B 25 -5.000 -1.464 -15.973 1.00 0.00 C ATOM 2494 O SER B 25 -5.719 -1.680 -16.943 1.00 0.00 O ATOM 2495 CB SER B 25 -5.278 -3.421 -14.601 1.00 0.00 C ATOM 2496 OG SER B 25 -5.047 -3.856 -13.294 1.00 0.00 O ATOM 0 H SER B 25 -7.370 -1.658 -14.327 1.00 0.00 H new ATOM 0 HA SER B 25 -4.561 -1.467 -14.030 1.00 0.00 H new ATOM 0 HB2 SER B 25 -6.212 -3.839 -14.977 1.00 0.00 H new ATOM 0 HB3 SER B 25 -4.484 -3.772 -15.260 1.00 0.00 H new ATOM 0 HG SER B 25 -4.197 -3.490 -12.973 1.00 0.00 H new ATOM 2502 N PRO B 26 -3.868 -0.772 -16.036 1.00 0.00 N ATOM 2503 CA PRO B 26 -3.078 -0.687 -17.210 1.00 0.00 C ATOM 2504 C PRO B 26 -1.850 -1.631 -16.985 1.00 0.00 C ATOM 2505 O PRO B 26 -0.785 -1.461 -17.584 1.00 0.00 O ATOM 2506 CB PRO B 26 -2.626 0.782 -17.206 1.00 0.00 C ATOM 2507 CG PRO B 26 -3.041 1.342 -15.876 1.00 0.00 C ATOM 2508 CD PRO B 26 -3.343 0.159 -15.028 1.00 0.00 C ATOM 0 HA PRO B 26 -3.575 -0.966 -18.139 1.00 0.00 H new ATOM 0 HB2 PRO B 26 -1.547 0.858 -17.341 1.00 0.00 H new ATOM 0 HB3 PRO B 26 -3.090 1.335 -18.023 1.00 0.00 H new ATOM 0 HG2 PRO B 26 -2.246 1.947 -15.439 1.00 0.00 H new ATOM 0 HG3 PRO B 26 -3.914 1.987 -15.976 1.00 0.00 H new ATOM 0 HD2 PRO B 26 -2.455 -0.229 -14.529 1.00 0.00 H new ATOM 0 HD3 PRO B 26 -4.074 0.383 -14.251 1.00 0.00 H new ATOM 2516 N VAL B 27 -2.043 -2.644 -16.078 1.00 0.00 N ATOM 2517 CA VAL B 27 -0.969 -3.549 -15.640 1.00 0.00 C ATOM 2518 C VAL B 27 -0.796 -4.719 -16.565 1.00 0.00 C ATOM 2519 O VAL B 27 -1.648 -5.019 -17.400 1.00 0.00 O ATOM 2520 CB VAL B 27 -1.165 -4.158 -14.195 1.00 0.00 C ATOM 2521 CG1 VAL B 27 -1.339 -3.128 -13.124 1.00 0.00 C ATOM 2522 CG2 VAL B 27 -2.264 -5.217 -14.124 1.00 0.00 C ATOM 0 H VAL B 27 -2.945 -2.840 -15.644 1.00 0.00 H new ATOM 0 HA VAL B 27 -0.094 -2.899 -15.641 1.00 0.00 H new ATOM 0 HB VAL B 27 -0.221 -4.663 -13.993 1.00 0.00 H new ATOM 0 HG11 VAL B 27 -1.468 -3.622 -12.161 1.00 0.00 H new ATOM 0 HG12 VAL B 27 -0.457 -2.488 -13.088 1.00 0.00 H new ATOM 0 HG13 VAL B 27 -2.219 -2.522 -13.341 1.00 0.00 H new ATOM 0 HG21 VAL B 27 -2.343 -5.591 -13.103 1.00 0.00 H new ATOM 0 HG22 VAL B 27 -3.215 -4.776 -14.423 1.00 0.00 H new ATOM 0 HG23 VAL B 27 -2.019 -6.041 -14.795 1.00 0.00 H new ATOM 2532 N GLN B 28 0.323 -5.354 -16.383 1.00 0.00 N ATOM 2533 CA GLN B 28 0.707 -6.565 -17.046 1.00 0.00 C ATOM 2534 C GLN B 28 1.754 -7.199 -16.207 1.00 0.00 C ATOM 2535 O GLN B 28 2.335 -6.513 -15.396 1.00 0.00 O ATOM 2536 CB GLN B 28 1.207 -6.388 -18.499 1.00 0.00 C ATOM 2537 CG GLN B 28 2.258 -5.331 -18.681 1.00 0.00 C ATOM 2538 CD GLN B 28 1.633 -4.108 -19.166 1.00 0.00 C ATOM 2539 OE1 GLN B 28 1.523 -3.872 -20.368 1.00 0.00 O ATOM 2540 NE2 GLN B 28 1.202 -3.347 -18.275 1.00 0.00 N ATOM 0 H GLN B 28 1.033 -5.022 -15.730 1.00 0.00 H new ATOM 0 HA GLN B 28 -0.182 -7.187 -17.150 1.00 0.00 H new ATOM 0 HB2 GLN B 28 1.605 -7.340 -18.849 1.00 0.00 H new ATOM 0 HB3 GLN B 28 0.355 -6.146 -19.134 1.00 0.00 H new ATOM 0 HG2 GLN B 28 2.768 -5.142 -17.736 1.00 0.00 H new ATOM 0 HG3 GLN B 28 3.014 -5.672 -19.388 1.00 0.00 H new ATOM 0 HE21 GLN B 28 1.321 -3.593 -17.292 1.00 0.00 H new ATOM 0 HE22 GLN B 28 0.731 -2.479 -18.530 1.00 0.00 H new ATOM 2549 N GLY B 29 1.974 -8.467 -16.350 1.00 0.00 N ATOM 2550 CA GLY B 29 2.996 -9.099 -15.592 1.00 0.00 C ATOM 2551 C GLY B 29 2.394 -9.884 -14.486 1.00 0.00 C ATOM 2552 O GLY B 29 1.371 -10.554 -14.688 1.00 0.00 O ATOM 0 H GLY B 29 1.460 -9.080 -16.983 1.00 0.00 H new ATOM 0 HA2 GLY B 29 3.585 -9.753 -16.235 1.00 0.00 H new ATOM 0 HA3 GLY B 29 3.677 -8.350 -15.189 1.00 0.00 H new ATOM 2556 N SER B 30 2.951 -9.786 -13.318 1.00 0.00 N ATOM 2557 CA SER B 30 2.432 -10.532 -12.216 1.00 0.00 C ATOM 2558 C SER B 30 1.435 -9.701 -11.423 1.00 0.00 C ATOM 2559 O SER B 30 0.879 -10.180 -10.424 1.00 0.00 O ATOM 2560 CB SER B 30 3.548 -10.993 -11.328 1.00 0.00 C ATOM 2561 OG SER B 30 4.609 -11.538 -12.102 1.00 0.00 O ATOM 0 H SER B 30 3.759 -9.201 -13.105 1.00 0.00 H new ATOM 0 HA SER B 30 1.912 -11.406 -12.609 1.00 0.00 H new ATOM 0 HB2 SER B 30 3.916 -10.157 -10.733 1.00 0.00 H new ATOM 0 HB3 SER B 30 3.178 -11.743 -10.629 1.00 0.00 H new ATOM 0 HG SER B 30 5.293 -10.851 -12.249 1.00 0.00 H new ATOM 2567 N GLU B 31 1.209 -8.454 -11.841 1.00 0.00 N ATOM 2568 CA GLU B 31 0.204 -7.664 -11.183 1.00 0.00 C ATOM 2569 C GLU B 31 -1.187 -8.167 -11.572 1.00 0.00 C ATOM 2570 O GLU B 31 -1.359 -8.844 -12.607 1.00 0.00 O ATOM 2571 CB GLU B 31 0.355 -6.175 -11.460 1.00 0.00 C ATOM 2572 CG GLU B 31 1.696 -5.591 -11.052 1.00 0.00 C ATOM 2573 CD GLU B 31 2.609 -5.367 -12.231 1.00 0.00 C ATOM 2574 OE1 GLU B 31 2.542 -4.263 -12.826 1.00 0.00 O ATOM 2575 OE2 GLU B 31 3.401 -6.268 -12.572 1.00 0.00 O1- ATOM 0 H GLU B 31 1.698 -7.993 -12.608 1.00 0.00 H new ATOM 0 HA GLU B 31 0.338 -7.784 -10.108 1.00 0.00 H new ATOM 0 HB2 GLU B 31 0.206 -6.000 -12.525 1.00 0.00 H new ATOM 0 HB3 GLU B 31 -0.435 -5.639 -10.935 1.00 0.00 H new ATOM 0 HG2 GLU B 31 1.535 -4.645 -10.536 1.00 0.00 H new ATOM 0 HG3 GLU B 31 2.181 -6.262 -10.343 1.00 0.00 H new ATOM 2582 N GLN B 32 -2.159 -7.836 -10.772 1.00 0.00 N ATOM 2583 CA GLN B 32 -3.486 -8.336 -10.915 1.00 0.00 C ATOM 2584 C GLN B 32 -4.449 -7.213 -10.713 1.00 0.00 C ATOM 2585 O GLN B 32 -4.413 -6.527 -9.698 1.00 0.00 O ATOM 2586 CB GLN B 32 -3.695 -9.506 -9.901 1.00 0.00 C ATOM 2587 CG GLN B 32 -5.141 -9.872 -9.474 1.00 0.00 C ATOM 2588 CD GLN B 32 -6.111 -10.178 -10.596 1.00 0.00 C ATOM 2589 OE1 GLN B 32 -6.214 -11.304 -11.063 1.00 0.00 O ATOM 2590 NE2 GLN B 32 -6.899 -9.200 -10.952 1.00 0.00 N ATOM 0 H GLN B 32 -2.043 -7.196 -9.986 1.00 0.00 H new ATOM 0 HA GLN B 32 -3.658 -8.736 -11.914 1.00 0.00 H new ATOM 0 HB2 GLN B 32 -3.241 -10.400 -10.329 1.00 0.00 H new ATOM 0 HB3 GLN B 32 -3.135 -9.265 -8.998 1.00 0.00 H new ATOM 0 HG2 GLN B 32 -5.095 -10.739 -8.815 1.00 0.00 H new ATOM 0 HG3 GLN B 32 -5.545 -9.047 -8.887 1.00 0.00 H new ATOM 0 HE21 GLN B 32 -6.782 -8.274 -10.540 1.00 0.00 H new ATOM 0 HE22 GLN B 32 -7.632 -9.361 -11.642 1.00 0.00 H new ATOM 2599 N GLY B 33 -5.215 -6.938 -11.718 1.00 0.00 N ATOM 2600 CA GLY B 33 -6.243 -6.002 -11.550 1.00 0.00 C ATOM 2601 C GLY B 33 -7.381 -6.161 -12.517 1.00 0.00 C ATOM 2602 O GLY B 33 -8.296 -6.971 -12.319 1.00 0.00 O ATOM 0 H GLY B 33 -5.139 -7.350 -12.648 1.00 0.00 H new ATOM 0 HA2 GLY B 33 -6.630 -6.082 -10.534 1.00 0.00 H new ATOM 0 HA3 GLY B 33 -5.828 -5.000 -11.655 1.00 0.00 H new ATOM 2606 N GLY B 34 -7.293 -5.413 -13.558 1.00 0.00 N ATOM 2607 CA GLY B 34 -8.361 -5.278 -14.510 1.00 0.00 C ATOM 2608 C GLY B 34 -9.363 -4.302 -13.955 1.00 0.00 C ATOM 2609 O GLY B 34 -9.129 -3.735 -12.892 1.00 0.00 O ATOM 0 H GLY B 34 -6.465 -4.863 -13.785 1.00 0.00 H new ATOM 0 HA2 GLY B 34 -7.976 -4.925 -15.467 1.00 0.00 H new ATOM 0 HA3 GLY B 34 -8.832 -6.244 -14.693 1.00 0.00 H new ATOM 2613 N VAL B 35 -10.432 -4.056 -14.627 1.00 0.00 N ATOM 2614 CA VAL B 35 -11.443 -3.262 -14.044 1.00 0.00 C ATOM 2615 C VAL B 35 -12.288 -4.180 -13.170 1.00 0.00 C ATOM 2616 O VAL B 35 -13.115 -4.977 -13.618 1.00 0.00 O ATOM 2617 CB VAL B 35 -12.243 -2.462 -15.076 1.00 0.00 C ATOM 2618 CG1 VAL B 35 -12.742 -3.361 -16.140 1.00 0.00 C ATOM 2619 CG2 VAL B 35 -13.374 -1.728 -14.421 1.00 0.00 C ATOM 0 H VAL B 35 -10.624 -4.391 -15.571 1.00 0.00 H new ATOM 0 HA VAL B 35 -11.005 -2.482 -13.421 1.00 0.00 H new ATOM 0 HB VAL B 35 -11.584 -1.721 -15.529 1.00 0.00 H new ATOM 0 HG11 VAL B 35 -13.310 -2.782 -16.869 1.00 0.00 H new ATOM 0 HG12 VAL B 35 -11.898 -3.841 -16.636 1.00 0.00 H new ATOM 0 HG13 VAL B 35 -13.386 -4.123 -15.700 1.00 0.00 H new ATOM 0 HG21 VAL B 35 -13.928 -1.167 -15.174 1.00 0.00 H new ATOM 0 HG22 VAL B 35 -14.040 -2.443 -13.938 1.00 0.00 H new ATOM 0 HG23 VAL B 35 -12.977 -1.040 -13.675 1.00 0.00 H new ATOM 2629 N ARG B 36 -11.994 -4.105 -11.950 1.00 0.00 N ATOM 2630 CA ARG B 36 -12.463 -5.020 -10.974 1.00 0.00 C ATOM 2631 C ARG B 36 -12.797 -4.233 -9.704 1.00 0.00 C ATOM 2632 O ARG B 36 -12.277 -3.126 -9.527 1.00 0.00 O ATOM 2633 CB ARG B 36 -11.292 -5.982 -10.712 1.00 0.00 C ATOM 2634 CG ARG B 36 -11.673 -7.359 -10.254 1.00 0.00 C ATOM 2635 CD ARG B 36 -10.435 -8.222 -10.048 1.00 0.00 C ATOM 2636 NE ARG B 36 -10.758 -9.645 -9.877 1.00 0.00 N ATOM 2637 CZ ARG B 36 -9.993 -10.549 -9.241 1.00 0.00 C ATOM 2638 NH1 ARG B 36 -8.934 -10.151 -8.517 1.00 0.00 N1+ ATOM 2639 NH2 ARG B 36 -10.321 -11.841 -9.298 1.00 0.00 N ATOM 0 H ARG B 36 -11.392 -3.376 -11.568 1.00 0.00 H new ATOM 0 HA ARG B 36 -13.353 -5.564 -11.291 1.00 0.00 H new ATOM 0 HB2 ARG B 36 -10.708 -6.072 -11.628 1.00 0.00 H new ATOM 0 HB3 ARG B 36 -10.640 -5.536 -9.961 1.00 0.00 H new ATOM 0 HG2 ARG B 36 -12.236 -7.295 -9.323 1.00 0.00 H new ATOM 0 HG3 ARG B 36 -12.328 -7.824 -10.991 1.00 0.00 H new ATOM 0 HD2 ARG B 36 -9.769 -8.105 -10.903 1.00 0.00 H new ATOM 0 HD3 ARG B 36 -9.893 -7.869 -9.171 1.00 0.00 H new ATOM 0 HE ARG B 36 -11.637 -9.975 -10.275 1.00 0.00 H new ATOM 0 HH11 ARG B 36 -8.707 -9.159 -8.448 1.00 0.00 H new ATOM 0 HH12 ARG B 36 -8.357 -10.841 -8.036 1.00 0.00 H new ATOM 0 HH21 ARG B 36 -11.146 -12.135 -9.821 1.00 0.00 H new ATOM 0 HH22 ARG B 36 -9.747 -12.535 -8.819 1.00 0.00 H new ATOM 2653 N PRO B 37 -13.716 -4.728 -8.851 1.00 0.00 N ATOM 2654 CA PRO B 37 -14.010 -4.093 -7.565 1.00 0.00 C ATOM 2655 C PRO B 37 -12.820 -4.155 -6.592 1.00 0.00 C ATOM 2656 O PRO B 37 -12.112 -5.173 -6.501 1.00 0.00 O ATOM 2657 CB PRO B 37 -15.216 -4.886 -7.029 1.00 0.00 C ATOM 2658 CG PRO B 37 -15.767 -5.586 -8.225 1.00 0.00 C ATOM 2659 CD PRO B 37 -14.586 -5.897 -9.080 1.00 0.00 C ATOM 0 HA PRO B 37 -14.216 -3.028 -7.675 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -14.913 -5.595 -6.259 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -15.957 -4.225 -6.580 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -16.296 -6.495 -7.939 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -16.481 -4.956 -8.755 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -14.103 -6.828 -8.783 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -14.860 -6.001 -10.130 1.00 0.00 H new ATOM 2667 N VAL B 38 -12.602 -3.063 -5.905 1.00 0.00 N ATOM 2668 CA VAL B 38 -11.529 -2.913 -4.945 1.00 0.00 C ATOM 2669 C VAL B 38 -12.095 -2.453 -3.598 1.00 0.00 C ATOM 2670 O VAL B 38 -13.240 -1.964 -3.527 1.00 0.00 O ATOM 2671 CB VAL B 38 -10.492 -1.851 -5.418 1.00 0.00 C ATOM 2672 CG1 VAL B 38 -9.745 -2.281 -6.670 1.00 0.00 C ATOM 2673 CG2 VAL B 38 -11.147 -0.503 -5.649 1.00 0.00 C ATOM 0 H VAL B 38 -13.180 -2.228 -5.998 1.00 0.00 H new ATOM 0 HA VAL B 38 -11.038 -3.881 -4.849 1.00 0.00 H new ATOM 0 HB VAL B 38 -9.765 -1.760 -4.611 1.00 0.00 H new ATOM 0 HG11 VAL B 38 -9.036 -1.504 -6.955 1.00 0.00 H new ATOM 0 HG12 VAL B 38 -9.208 -3.208 -6.473 1.00 0.00 H new ATOM 0 HG13 VAL B 38 -10.456 -2.439 -7.481 1.00 0.00 H new ATOM 0 HG21 VAL B 38 -10.396 0.215 -5.978 1.00 0.00 H new ATOM 0 HG22 VAL B 38 -11.917 -0.599 -6.414 1.00 0.00 H new ATOM 0 HG23 VAL B 38 -11.600 -0.155 -4.721 1.00 0.00 H new ATOM 2683 N VAL B 39 -11.308 -2.604 -2.549 1.00 0.00 N ATOM 2684 CA VAL B 39 -11.703 -2.154 -1.216 1.00 0.00 C ATOM 2685 C VAL B 39 -10.938 -0.884 -0.834 1.00 0.00 C ATOM 2686 O VAL B 39 -9.719 -0.790 -1.051 1.00 0.00 O ATOM 2687 CB VAL B 39 -11.517 -3.260 -0.116 1.00 0.00 C ATOM 2688 CG1 VAL B 39 -12.419 -4.433 -0.391 1.00 0.00 C ATOM 2689 CG2 VAL B 39 -10.076 -3.734 -0.030 1.00 0.00 C ATOM 0 H VAL B 39 -10.385 -3.037 -2.589 1.00 0.00 H new ATOM 0 HA VAL B 39 -12.770 -1.935 -1.261 1.00 0.00 H new ATOM 0 HB VAL B 39 -11.784 -2.812 0.841 1.00 0.00 H new ATOM 0 HG11 VAL B 39 -12.277 -5.190 0.381 1.00 0.00 H new ATOM 0 HG12 VAL B 39 -13.458 -4.102 -0.388 1.00 0.00 H new ATOM 0 HG13 VAL B 39 -12.176 -4.858 -1.365 1.00 0.00 H new ATOM 0 HG21 VAL B 39 -9.990 -4.498 0.742 1.00 0.00 H new ATOM 0 HG22 VAL B 39 -9.773 -4.152 -0.990 1.00 0.00 H new ATOM 0 HG23 VAL B 39 -9.430 -2.892 0.219 1.00 0.00 H new ATOM 2699 N ILE B 40 -11.649 0.093 -0.306 1.00 0.00 N ATOM 2700 CA ILE B 40 -11.069 1.350 0.094 1.00 0.00 C ATOM 2701 C ILE B 40 -10.620 1.222 1.529 1.00 0.00 C ATOM 2702 O ILE B 40 -11.453 1.115 2.435 1.00 0.00 O ATOM 2703 CB ILE B 40 -12.112 2.494 0.014 1.00 0.00 C ATOM 2704 CG1 ILE B 40 -12.866 2.486 -1.329 1.00 0.00 C ATOM 2705 CG2 ILE B 40 -11.456 3.844 0.254 1.00 0.00 C ATOM 2706 CD1 ILE B 40 -12.020 2.671 -2.565 1.00 0.00 C ATOM 0 H ILE B 40 -12.654 0.031 -0.143 1.00 0.00 H new ATOM 0 HA ILE B 40 -10.237 1.584 -0.571 1.00 0.00 H new ATOM 0 HB ILE B 40 -12.844 2.321 0.803 1.00 0.00 H new ATOM 0 HG12 ILE B 40 -13.400 1.540 -1.417 1.00 0.00 H new ATOM 0 HG13 ILE B 40 -13.617 3.275 -1.306 1.00 0.00 H new ATOM 0 HG21 ILE B 40 -12.208 4.630 0.193 1.00 0.00 H new ATOM 0 HG22 ILE B 40 -10.999 3.856 1.243 1.00 0.00 H new ATOM 0 HG23 ILE B 40 -10.690 4.016 -0.502 1.00 0.00 H new ATOM 0 HD11 ILE B 40 -12.657 2.648 -3.449 1.00 0.00 H new ATOM 0 HD12 ILE B 40 -11.505 3.631 -2.513 1.00 0.00 H new ATOM 0 HD13 ILE B 40 -11.285 1.868 -2.627 1.00 0.00 H new ATOM 2718 N ILE B 41 -9.331 1.203 1.739 1.00 0.00 N ATOM 2719 CA ILE B 41 -8.803 1.042 3.095 1.00 0.00 C ATOM 2720 C ILE B 41 -8.265 2.352 3.612 1.00 0.00 C ATOM 2721 O ILE B 41 -7.909 2.457 4.749 1.00 0.00 O ATOM 2722 CB ILE B 41 -7.666 -0.071 3.183 1.00 0.00 C ATOM 2723 CG1 ILE B 41 -6.177 0.474 3.141 1.00 0.00 C ATOM 2724 CG2 ILE B 41 -7.864 -1.146 2.131 1.00 0.00 C ATOM 2725 CD1 ILE B 41 -5.772 1.351 1.954 1.00 0.00 C ATOM 0 H ILE B 41 -8.624 1.295 1.009 1.00 0.00 H new ATOM 0 HA ILE B 41 -9.637 0.713 3.715 1.00 0.00 H new ATOM 0 HB ILE B 41 -7.788 -0.499 4.178 1.00 0.00 H new ATOM 0 HG12 ILE B 41 -6.003 1.044 4.054 1.00 0.00 H new ATOM 0 HG13 ILE B 41 -5.505 -0.384 3.168 1.00 0.00 H new ATOM 0 HG21 ILE B 41 -7.072 -1.890 2.218 1.00 0.00 H new ATOM 0 HG22 ILE B 41 -8.831 -1.626 2.279 1.00 0.00 H new ATOM 0 HG23 ILE B 41 -7.831 -0.695 1.139 1.00 0.00 H new ATOM 0 HD11 ILE B 41 -4.729 1.649 2.061 1.00 0.00 H new ATOM 0 HD12 ILE B 41 -5.896 0.790 1.028 1.00 0.00 H new ATOM 0 HD13 ILE B 41 -6.402 2.240 1.927 1.00 0.00 H new ATOM 2737 N GLN B 42 -8.204 3.334 2.729 1.00 0.00 N ATOM 2738 CA GLN B 42 -7.521 4.572 2.990 1.00 0.00 C ATOM 2739 C GLN B 42 -8.121 5.403 4.118 1.00 0.00 C ATOM 2740 O GLN B 42 -9.207 5.132 4.628 1.00 0.00 O ATOM 2741 CB GLN B 42 -7.480 5.378 1.737 1.00 0.00 C ATOM 2742 CG GLN B 42 -8.808 6.002 1.364 1.00 0.00 C ATOM 2743 CD GLN B 42 -8.633 7.227 0.537 1.00 0.00 C ATOM 2744 OE1 GLN B 42 -8.651 7.200 -0.665 1.00 0.00 O ATOM 2745 NE2 GLN B 42 -8.385 8.280 1.213 1.00 0.00 N ATOM 0 H GLN B 42 -8.634 3.286 1.805 1.00 0.00 H new ATOM 0 HA GLN B 42 -6.519 4.304 3.326 1.00 0.00 H new ATOM 0 HB2 GLN B 42 -6.737 6.168 1.849 1.00 0.00 H new ATOM 0 HB3 GLN B 42 -7.146 4.741 0.918 1.00 0.00 H new ATOM 0 HG2 GLN B 42 -9.409 5.276 0.815 1.00 0.00 H new ATOM 0 HG3 GLN B 42 -9.359 6.252 2.271 1.00 0.00 H new ATOM 0 HE21 GLN B 42 -8.383 8.243 2.232 1.00 0.00 H new ATOM 0 HE22 GLN B 42 -8.188 9.159 0.734 1.00 0.00 H new ATOM 2754 N ASN B 43 -7.380 6.415 4.494 1.00 0.00 N ATOM 2755 CA ASN B 43 -7.794 7.350 5.532 1.00 0.00 C ATOM 2756 C ASN B 43 -9.008 8.136 5.113 1.00 0.00 C ATOM 2757 O ASN B 43 -9.443 8.105 3.952 1.00 0.00 O ATOM 2758 CB ASN B 43 -6.670 8.334 5.920 1.00 0.00 C ATOM 2759 CG ASN B 43 -6.411 9.450 4.925 1.00 0.00 C ATOM 2760 OD1 ASN B 43 -6.681 9.324 3.745 1.00 0.00 O ATOM 2761 ND2 ASN B 43 -5.859 10.536 5.401 1.00 0.00 N ATOM 0 H ASN B 43 -6.466 6.622 4.092 1.00 0.00 H new ATOM 0 HA ASN B 43 -8.037 6.740 6.402 1.00 0.00 H new ATOM 0 HB2 ASN B 43 -6.917 8.779 6.884 1.00 0.00 H new ATOM 0 HB3 ASN B 43 -5.747 7.770 6.056 1.00 0.00 H new ATOM 0 HD21 ASN B 43 -5.641 11.313 4.777 1.00 0.00 H new ATOM 0 HD22 ASN B 43 -5.647 10.606 6.396 1.00 0.00 H new ATOM 2768 N ASP B 44 -9.496 8.874 6.030 1.00 0.00 N ATOM 2769 CA ASP B 44 -10.703 9.664 5.815 1.00 0.00 C ATOM 2770 C ASP B 44 -10.462 10.870 4.912 1.00 0.00 C ATOM 2771 O ASP B 44 -11.233 11.144 4.004 1.00 0.00 O ATOM 2772 CB ASP B 44 -11.292 10.145 7.152 1.00 0.00 C ATOM 2773 CG ASP B 44 -12.463 11.109 6.978 1.00 0.00 C ATOM 2774 OD1 ASP B 44 -12.229 12.355 6.878 1.00 0.00 O1- ATOM 2775 OD2 ASP B 44 -13.629 10.663 6.948 1.00 0.00 O ATOM 0 H ASP B 44 -9.091 8.968 6.962 1.00 0.00 H new ATOM 0 HA ASP B 44 -11.412 9.004 5.315 1.00 0.00 H new ATOM 0 HB2 ASP B 44 -11.623 9.281 7.728 1.00 0.00 H new ATOM 0 HB3 ASP B 44 -10.509 10.634 7.732 1.00 0.00 H new ATOM 2780 N THR B 45 -9.414 11.589 5.172 1.00 0.00 N ATOM 2781 CA THR B 45 -9.210 12.859 4.536 1.00 0.00 C ATOM 2782 C THR B 45 -8.476 12.793 3.188 1.00 0.00 C ATOM 2783 O THR B 45 -8.595 13.711 2.390 1.00 0.00 O ATOM 2784 CB THR B 45 -8.594 13.888 5.508 1.00 0.00 C ATOM 2785 OG1 THR B 45 -9.328 13.801 6.753 1.00 0.00 O ATOM 2786 CG2 THR B 45 -8.742 15.323 4.953 1.00 0.00 C ATOM 0 H THR B 45 -8.679 11.317 5.826 1.00 0.00 H new ATOM 0 HA THR B 45 -10.206 13.214 4.271 1.00 0.00 H new ATOM 0 HB THR B 45 -7.534 13.675 5.644 1.00 0.00 H new ATOM 0 HG1 THR B 45 -8.960 14.443 7.395 1.00 0.00 H new ATOM 0 HG21 THR B 45 -8.301 16.032 5.654 1.00 0.00 H new ATOM 0 HG22 THR B 45 -8.231 15.396 3.993 1.00 0.00 H new ATOM 0 HG23 THR B 45 -9.799 15.554 4.820 1.00 0.00 H new ATOM 2794 N GLY B 46 -7.731 11.722 2.938 1.00 0.00 N ATOM 2795 CA GLY B 46 -6.955 11.591 1.695 1.00 0.00 C ATOM 2796 C GLY B 46 -7.805 11.760 0.478 1.00 0.00 C ATOM 2797 O GLY B 46 -7.415 12.396 -0.456 1.00 0.00 O ATOM 0 H GLY B 46 -7.643 10.929 3.574 1.00 0.00 H new ATOM 0 HA2 GLY B 46 -6.159 12.335 1.686 1.00 0.00 H new ATOM 0 HA3 GLY B 46 -6.477 10.612 1.669 1.00 0.00 H new ATOM 2801 N ASN B 47 -9.018 11.285 0.557 1.00 0.00 N ATOM 2802 CA ASN B 47 -9.963 11.405 -0.547 1.00 0.00 C ATOM 2803 C ASN B 47 -10.335 12.887 -0.846 1.00 0.00 C ATOM 2804 O ASN B 47 -10.831 13.208 -1.919 1.00 0.00 O ATOM 2805 CB ASN B 47 -11.175 10.450 -0.375 1.00 0.00 C ATOM 2806 CG ASN B 47 -12.007 10.674 0.879 1.00 0.00 C ATOM 2807 OD1 ASN B 47 -12.242 11.793 1.296 1.00 0.00 O ATOM 2808 ND2 ASN B 47 -12.399 9.605 1.522 1.00 0.00 N ATOM 0 H ASN B 47 -9.388 10.805 1.377 1.00 0.00 H new ATOM 0 HA ASN B 47 -9.464 11.063 -1.454 1.00 0.00 H new ATOM 0 HB2 ASN B 47 -11.824 10.553 -1.245 1.00 0.00 H new ATOM 0 HB3 ASN B 47 -10.809 9.423 -0.370 1.00 0.00 H new ATOM 0 HD21 ASN B 47 -12.916 9.697 2.397 1.00 0.00 H new ATOM 0 HD22 ASN B 47 -12.188 8.679 1.149 1.00 0.00 H new ATOM 2815 N LYS B 48 -10.095 13.777 0.127 1.00 0.00 N ATOM 2816 CA LYS B 48 -10.276 15.219 -0.051 1.00 0.00 C ATOM 2817 C LYS B 48 -9.044 15.813 -0.746 1.00 0.00 C ATOM 2818 O LYS B 48 -9.138 16.356 -1.855 1.00 0.00 O ATOM 2819 CB LYS B 48 -10.407 15.984 1.299 1.00 0.00 C ATOM 2820 CG LYS B 48 -11.688 15.855 2.123 1.00 0.00 C ATOM 2821 CD LYS B 48 -11.965 14.451 2.587 1.00 0.00 C ATOM 2822 CE LYS B 48 -12.490 14.436 4.006 1.00 0.00 C ATOM 2823 NZ LYS B 48 -13.091 13.131 4.364 1.00 0.00 N1+ ATOM 0 H LYS B 48 -9.770 13.515 1.058 1.00 0.00 H new ATOM 0 HA LYS B 48 -11.191 15.335 -0.632 1.00 0.00 H new ATOM 0 HB2 LYS B 48 -9.579 15.668 1.934 1.00 0.00 H new ATOM 0 HB3 LYS B 48 -10.261 17.043 1.088 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -11.619 16.509 2.992 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -12.531 16.205 1.527 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -12.691 13.983 1.923 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -11.052 13.859 2.528 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -11.676 14.661 4.695 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -13.235 15.223 4.125 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 -13.065 13.008 5.396 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 -14.078 13.102 4.037 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 -12.553 12.365 3.911 1.00 0.00 H new ATOM 2837 N TYR B 49 -7.883 15.701 -0.078 1.00 0.00 N ATOM 2838 CA TYR B 49 -6.677 16.380 -0.541 1.00 0.00 C ATOM 2839 C TYR B 49 -5.893 15.632 -1.614 1.00 0.00 C ATOM 2840 O TYR B 49 -5.310 16.253 -2.498 1.00 0.00 O ATOM 2841 CB TYR B 49 -5.739 16.839 0.608 1.00 0.00 C ATOM 2842 CG TYR B 49 -5.355 15.770 1.590 1.00 0.00 C ATOM 2843 CD1 TYR B 49 -4.293 14.900 1.362 1.00 0.00 C ATOM 2844 CD2 TYR B 49 -6.070 15.629 2.737 1.00 0.00 C ATOM 2845 CE1 TYR B 49 -3.981 13.910 2.276 1.00 0.00 C ATOM 2846 CE2 TYR B 49 -5.771 14.663 3.652 1.00 0.00 C ATOM 2847 CZ TYR B 49 -4.732 13.796 3.421 1.00 0.00 C ATOM 2848 OH TYR B 49 -4.453 12.807 4.335 1.00 0.00 O ATOM 0 H TYR B 49 -7.762 15.152 0.773 1.00 0.00 H new ATOM 0 HA TYR B 49 -7.073 17.275 -1.021 1.00 0.00 H new ATOM 0 HB2 TYR B 49 -4.830 17.250 0.170 1.00 0.00 H new ATOM 0 HB3 TYR B 49 -6.226 17.649 1.150 1.00 0.00 H new ATOM 0 HD1 TYR B 49 -3.706 14.999 0.461 1.00 0.00 H new ATOM 0 HD2 TYR B 49 -6.895 16.299 2.929 1.00 0.00 H new ATOM 0 HE1 TYR B 49 -3.158 13.235 2.092 1.00 0.00 H new ATOM 0 HE2 TYR B 49 -6.352 14.580 4.559 1.00 0.00 H new ATOM 0 HH TYR B 49 -4.703 13.111 5.233 1.00 0.00 H new ATOM 2858 N SER B 50 -5.876 14.330 -1.547 1.00 0.00 N ATOM 2859 CA SER B 50 -5.131 13.545 -2.483 1.00 0.00 C ATOM 2860 C SER B 50 -5.977 13.291 -3.720 1.00 0.00 C ATOM 2861 O SER B 50 -7.205 13.144 -3.628 1.00 0.00 O ATOM 2862 CB SER B 50 -4.723 12.191 -1.854 1.00 0.00 C ATOM 2863 OG SER B 50 -3.954 12.368 -0.665 1.00 0.00 O ATOM 0 H SER B 50 -6.377 13.787 -0.844 1.00 0.00 H new ATOM 0 HA SER B 50 -4.229 14.092 -2.757 1.00 0.00 H new ATOM 0 HB2 SER B 50 -5.618 11.613 -1.625 1.00 0.00 H new ATOM 0 HB3 SER B 50 -4.147 11.614 -2.577 1.00 0.00 H new ATOM 0 HG SER B 50 -3.590 11.504 -0.379 1.00 0.00 H new ATOM 2869 N PRO B 51 -5.372 13.326 -4.908 1.00 0.00 N ATOM 2870 CA PRO B 51 -6.051 12.893 -6.107 1.00 0.00 C ATOM 2871 C PRO B 51 -6.070 11.371 -6.137 1.00 0.00 C ATOM 2872 O PRO B 51 -6.900 10.757 -6.798 1.00 0.00 O ATOM 2873 CB PRO B 51 -5.174 13.437 -7.258 1.00 0.00 C ATOM 2874 CG PRO B 51 -4.151 14.316 -6.608 1.00 0.00 C ATOM 2875 CD PRO B 51 -4.020 13.836 -5.194 1.00 0.00 C ATOM 0 HA PRO B 51 -7.081 13.243 -6.173 1.00 0.00 H new ATOM 0 HB2 PRO B 51 -4.699 12.623 -7.807 1.00 0.00 H new ATOM 0 HB3 PRO B 51 -5.773 13.998 -7.975 1.00 0.00 H new ATOM 0 HG2 PRO B 51 -3.196 14.253 -7.130 1.00 0.00 H new ATOM 0 HG3 PRO B 51 -4.461 15.360 -6.637 1.00 0.00 H new ATOM 0 HD2 PRO B 51 -3.263 13.058 -5.097 1.00 0.00 H new ATOM 0 HD3 PRO B 51 -3.737 14.641 -4.516 1.00 0.00 H new ATOM 2883 N THR B 52 -5.170 10.797 -5.369 1.00 0.00 N ATOM 2884 CA THR B 52 -4.957 9.403 -5.279 1.00 0.00 C ATOM 2885 C THR B 52 -5.808 8.761 -4.186 1.00 0.00 C ATOM 2886 O THR B 52 -6.206 9.412 -3.223 1.00 0.00 O ATOM 2887 CB THR B 52 -3.468 9.145 -5.003 1.00 0.00 C ATOM 2888 OG1 THR B 52 -2.996 10.094 -4.036 1.00 0.00 O ATOM 2889 CG2 THR B 52 -2.626 9.245 -6.271 1.00 0.00 C ATOM 0 H THR B 52 -4.545 11.333 -4.767 1.00 0.00 H new ATOM 0 HA THR B 52 -5.254 8.950 -6.225 1.00 0.00 H new ATOM 0 HB THR B 52 -3.368 8.129 -4.621 1.00 0.00 H new ATOM 0 HG1 THR B 52 -3.230 9.787 -3.135 1.00 0.00 H new ATOM 0 HG21 THR B 52 -1.580 9.056 -6.029 1.00 0.00 H new ATOM 0 HG22 THR B 52 -2.970 8.507 -6.996 1.00 0.00 H new ATOM 0 HG23 THR B 52 -2.725 10.244 -6.696 1.00 0.00 H new ATOM 2897 N VAL B 53 -6.135 7.522 -4.413 1.00 0.00 N ATOM 2898 CA VAL B 53 -6.816 6.668 -3.496 1.00 0.00 C ATOM 2899 C VAL B 53 -6.015 5.367 -3.500 1.00 0.00 C ATOM 2900 O VAL B 53 -5.549 4.920 -4.554 1.00 0.00 O ATOM 2901 CB VAL B 53 -8.284 6.383 -4.016 1.00 0.00 C ATOM 2902 CG1 VAL B 53 -9.068 5.412 -3.135 1.00 0.00 C ATOM 2903 CG2 VAL B 53 -9.066 7.671 -4.161 1.00 0.00 C ATOM 0 H VAL B 53 -5.919 7.058 -5.295 1.00 0.00 H new ATOM 0 HA VAL B 53 -6.892 7.109 -2.502 1.00 0.00 H new ATOM 0 HB VAL B 53 -8.161 5.908 -4.989 1.00 0.00 H new ATOM 0 HG11 VAL B 53 -10.064 5.265 -3.553 1.00 0.00 H new ATOM 0 HG12 VAL B 53 -8.547 4.456 -3.094 1.00 0.00 H new ATOM 0 HG13 VAL B 53 -9.154 5.822 -2.129 1.00 0.00 H new ATOM 0 HG21 VAL B 53 -10.071 7.448 -4.520 1.00 0.00 H new ATOM 0 HG22 VAL B 53 -9.128 8.170 -3.194 1.00 0.00 H new ATOM 0 HG23 VAL B 53 -8.563 8.324 -4.874 1.00 0.00 H new ATOM 2913 N ILE B 54 -5.848 4.783 -2.375 1.00 0.00 N ATOM 2914 CA ILE B 54 -5.150 3.535 -2.259 1.00 0.00 C ATOM 2915 C ILE B 54 -6.124 2.426 -1.879 1.00 0.00 C ATOM 2916 O ILE B 54 -6.908 2.554 -0.919 1.00 0.00 O ATOM 2917 CB ILE B 54 -3.925 3.630 -1.286 1.00 0.00 C ATOM 2918 CG1 ILE B 54 -3.225 2.261 -1.169 1.00 0.00 C ATOM 2919 CG2 ILE B 54 -4.309 4.199 0.100 1.00 0.00 C ATOM 2920 CD1 ILE B 54 -1.945 2.285 -0.371 1.00 0.00 C ATOM 0 H ILE B 54 -6.192 5.153 -1.489 1.00 0.00 H new ATOM 0 HA ILE B 54 -4.726 3.285 -3.232 1.00 0.00 H new ATOM 0 HB ILE B 54 -3.220 4.341 -1.716 1.00 0.00 H new ATOM 0 HG12 ILE B 54 -3.913 1.552 -0.709 1.00 0.00 H new ATOM 0 HG13 ILE B 54 -3.008 1.890 -2.171 1.00 0.00 H new ATOM 0 HG21 ILE B 54 -3.423 4.243 0.733 1.00 0.00 H new ATOM 0 HG22 ILE B 54 -4.720 5.202 -0.019 1.00 0.00 H new ATOM 0 HG23 ILE B 54 -5.055 3.554 0.564 1.00 0.00 H new ATOM 0 HD11 ILE B 54 -1.518 1.283 -0.338 1.00 0.00 H new ATOM 0 HD12 ILE B 54 -1.236 2.966 -0.841 1.00 0.00 H new ATOM 0 HD13 ILE B 54 -2.155 2.623 0.644 1.00 0.00 H new ATOM 2932 N VAL B 55 -6.121 1.367 -2.664 1.00 0.00 N ATOM 2933 CA VAL B 55 -7.056 0.289 -2.497 1.00 0.00 C ATOM 2934 C VAL B 55 -6.342 -1.061 -2.498 1.00 0.00 C ATOM 2935 O VAL B 55 -5.149 -1.142 -2.771 1.00 0.00 O ATOM 2936 CB VAL B 55 -8.098 0.296 -3.648 1.00 0.00 C ATOM 2937 CG1 VAL B 55 -8.848 1.616 -3.698 1.00 0.00 C ATOM 2938 CG2 VAL B 55 -7.427 0.020 -4.989 1.00 0.00 C ATOM 0 H VAL B 55 -5.466 1.236 -3.435 1.00 0.00 H new ATOM 0 HA VAL B 55 -7.555 0.433 -1.539 1.00 0.00 H new ATOM 0 HB VAL B 55 -8.816 -0.499 -3.449 1.00 0.00 H new ATOM 0 HG11 VAL B 55 -9.571 1.593 -4.513 1.00 0.00 H new ATOM 0 HG12 VAL B 55 -9.370 1.774 -2.754 1.00 0.00 H new ATOM 0 HG13 VAL B 55 -8.142 2.430 -3.862 1.00 0.00 H new ATOM 0 HG21 VAL B 55 -8.177 0.030 -5.780 1.00 0.00 H new ATOM 0 HG22 VAL B 55 -6.680 0.789 -5.187 1.00 0.00 H new ATOM 0 HG23 VAL B 55 -6.943 -0.956 -4.960 1.00 0.00 H new ATOM 2948 N ALA B 56 -7.084 -2.101 -2.215 1.00 0.00 N ATOM 2949 CA ALA B 56 -6.591 -3.451 -2.250 1.00 0.00 C ATOM 2950 C ALA B 56 -7.548 -4.269 -3.114 1.00 0.00 C ATOM 2951 O ALA B 56 -8.763 -4.000 -3.120 1.00 0.00 O ATOM 2952 CB ALA B 56 -6.508 -4.033 -0.835 1.00 0.00 C ATOM 0 H ALA B 56 -8.066 -2.030 -1.949 1.00 0.00 H new ATOM 0 HA ALA B 56 -5.585 -3.477 -2.670 1.00 0.00 H new ATOM 0 HB1 ALA B 56 -6.133 -5.055 -0.883 1.00 0.00 H new ATOM 0 HB2 ALA B 56 -5.833 -3.427 -0.231 1.00 0.00 H new ATOM 0 HB3 ALA B 56 -7.500 -4.032 -0.382 1.00 0.00 H new ATOM 2958 N ALA B 57 -7.014 -5.204 -3.860 1.00 0.00 N ATOM 2959 CA ALA B 57 -7.797 -6.031 -4.766 1.00 0.00 C ATOM 2960 C ALA B 57 -8.625 -7.128 -4.106 1.00 0.00 C ATOM 2961 O ALA B 57 -8.167 -7.863 -3.209 1.00 0.00 O ATOM 2962 CB ALA B 57 -6.926 -6.601 -5.870 1.00 0.00 C ATOM 0 H ALA B 57 -6.017 -5.420 -3.861 1.00 0.00 H new ATOM 0 HA ALA B 57 -8.534 -5.349 -5.190 1.00 0.00 H new ATOM 0 HB1 ALA B 57 -7.535 -7.215 -6.533 1.00 0.00 H new ATOM 0 HB2 ALA B 57 -6.479 -5.785 -6.439 1.00 0.00 H new ATOM 0 HB3 ALA B 57 -6.137 -7.212 -5.432 1.00 0.00 H new ATOM 2968 N ILE B 58 -9.855 -7.201 -4.577 1.00 0.00 N ATOM 2969 CA ILE B 58 -10.805 -8.222 -4.241 1.00 0.00 C ATOM 2970 C ILE B 58 -10.634 -9.327 -5.258 1.00 0.00 C ATOM 2971 O ILE B 58 -10.743 -9.084 -6.455 1.00 0.00 O ATOM 2972 CB ILE B 58 -12.267 -7.685 -4.338 1.00 0.00 C ATOM 2973 CG1 ILE B 58 -12.497 -6.523 -3.360 1.00 0.00 C ATOM 2974 CG2 ILE B 58 -13.286 -8.804 -4.128 1.00 0.00 C ATOM 2975 CD1 ILE B 58 -13.901 -5.949 -3.389 1.00 0.00 C ATOM 0 H ILE B 58 -10.227 -6.515 -5.233 1.00 0.00 H new ATOM 0 HA ILE B 58 -10.635 -8.564 -3.220 1.00 0.00 H new ATOM 0 HB ILE B 58 -12.412 -7.299 -5.347 1.00 0.00 H new ATOM 0 HG12 ILE B 58 -12.279 -6.866 -2.349 1.00 0.00 H new ATOM 0 HG13 ILE B 58 -11.787 -5.727 -3.587 1.00 0.00 H new ATOM 0 HG21 ILE B 58 -14.294 -8.396 -4.202 1.00 0.00 H new ATOM 0 HG22 ILE B 58 -13.148 -9.570 -4.891 1.00 0.00 H new ATOM 0 HG23 ILE B 58 -13.144 -9.245 -3.141 1.00 0.00 H new ATOM 0 HD11 ILE B 58 -13.976 -5.134 -2.669 1.00 0.00 H new ATOM 0 HD12 ILE B 58 -14.119 -5.572 -4.388 1.00 0.00 H new ATOM 0 HD13 ILE B 58 -14.618 -6.728 -3.131 1.00 0.00 H new ATOM 2987 N THR B 59 -10.357 -10.494 -4.800 1.00 0.00 N ATOM 2988 CA THR B 59 -10.131 -11.610 -5.650 1.00 0.00 C ATOM 2989 C THR B 59 -11.081 -12.747 -5.307 1.00 0.00 C ATOM 2990 O THR B 59 -11.099 -13.249 -4.193 1.00 0.00 O ATOM 2991 CB THR B 59 -8.656 -12.075 -5.534 1.00 0.00 C ATOM 2992 OG1 THR B 59 -7.795 -11.001 -5.962 1.00 0.00 O ATOM 2993 CG2 THR B 59 -8.377 -13.308 -6.387 1.00 0.00 C ATOM 0 H THR B 59 -10.279 -10.706 -3.805 1.00 0.00 H new ATOM 0 HA THR B 59 -10.323 -11.310 -6.680 1.00 0.00 H new ATOM 0 HB THR B 59 -8.465 -12.339 -4.494 1.00 0.00 H new ATOM 0 HG1 THR B 59 -6.859 -11.284 -5.891 1.00 0.00 H new ATOM 0 HG21 THR B 59 -7.332 -13.599 -6.275 1.00 0.00 H new ATOM 0 HG22 THR B 59 -9.018 -14.127 -6.063 1.00 0.00 H new ATOM 0 HG23 THR B 59 -8.580 -13.080 -7.433 1.00 0.00 H new ATOM 3001 N GLY B 60 -11.906 -13.084 -6.240 1.00 0.00 N ATOM 3002 CA GLY B 60 -12.747 -14.209 -6.093 1.00 0.00 C ATOM 3003 C GLY B 60 -12.135 -15.377 -6.811 1.00 0.00 C ATOM 3004 O GLY B 60 -11.136 -15.201 -7.527 1.00 0.00 O ATOM 0 H GLY B 60 -12.012 -12.584 -7.123 1.00 0.00 H new ATOM 0 HA2 GLY B 60 -12.879 -14.444 -5.037 1.00 0.00 H new ATOM 0 HA3 GLY B 60 -13.736 -13.995 -6.498 1.00 0.00 H new ATOM 3119 N ILE B 67 -3.614 -17.804 5.987 1.00 0.00 N ATOM 3120 CA ILE B 67 -2.368 -17.120 5.980 1.00 0.00 C ATOM 3121 C ILE B 67 -2.707 -15.650 6.232 1.00 0.00 C ATOM 3122 O ILE B 67 -3.625 -15.128 5.605 1.00 0.00 O ATOM 3123 CB ILE B 67 -1.615 -17.300 4.613 1.00 0.00 C ATOM 3124 CG1 ILE B 67 -0.341 -16.428 4.561 1.00 0.00 C ATOM 3125 CG2 ILE B 67 -2.528 -17.042 3.417 1.00 0.00 C ATOM 3126 CD1 ILE B 67 0.364 -16.430 3.226 1.00 0.00 C ATOM 0 HA ILE B 67 -1.696 -17.517 6.741 1.00 0.00 H new ATOM 0 HB ILE B 67 -1.304 -18.343 4.548 1.00 0.00 H new ATOM 0 HG12 ILE B 67 -0.607 -15.402 4.816 1.00 0.00 H new ATOM 0 HG13 ILE B 67 0.354 -16.776 5.325 1.00 0.00 H new ATOM 0 HG21 ILE B 67 -1.965 -17.178 2.494 1.00 0.00 H new ATOM 0 HG22 ILE B 67 -3.363 -17.742 3.439 1.00 0.00 H new ATOM 0 HG23 ILE B 67 -2.908 -16.022 3.463 1.00 0.00 H new ATOM 0 HD11 ILE B 67 1.247 -15.793 3.280 1.00 0.00 H new ATOM 0 HD12 ILE B 67 0.666 -17.447 2.975 1.00 0.00 H new ATOM 0 HD13 ILE B 67 -0.310 -16.052 2.458 1.00 0.00 H new ATOM 3138 N PRO B 68 -2.006 -14.980 7.158 1.00 0.00 N ATOM 3139 CA PRO B 68 -2.323 -13.595 7.591 1.00 0.00 C ATOM 3140 C PRO B 68 -2.433 -12.533 6.475 1.00 0.00 C ATOM 3141 O PRO B 68 -3.026 -11.479 6.692 1.00 0.00 O ATOM 3142 CB PRO B 68 -1.166 -13.240 8.535 1.00 0.00 C ATOM 3143 CG PRO B 68 -0.126 -14.274 8.301 1.00 0.00 C ATOM 3144 CD PRO B 68 -0.858 -15.512 7.908 1.00 0.00 C ATOM 0 HA PRO B 68 -3.319 -13.580 8.034 1.00 0.00 H new ATOM 0 HB2 PRO B 68 -0.781 -12.242 8.324 1.00 0.00 H new ATOM 0 HB3 PRO B 68 -1.494 -13.242 9.575 1.00 0.00 H new ATOM 0 HG2 PRO B 68 0.564 -13.963 7.516 1.00 0.00 H new ATOM 0 HG3 PRO B 68 0.468 -14.441 9.200 1.00 0.00 H new ATOM 0 HD2 PRO B 68 -0.242 -16.170 7.294 1.00 0.00 H new ATOM 0 HD3 PRO B 68 -1.174 -16.090 8.777 1.00 0.00 H new ATOM 3152 N THR B 69 -1.897 -12.806 5.306 1.00 0.00 N ATOM 3153 CA THR B 69 -1.885 -11.825 4.247 1.00 0.00 C ATOM 3154 C THR B 69 -3.133 -11.951 3.336 1.00 0.00 C ATOM 3155 O THR B 69 -3.484 -11.013 2.605 1.00 0.00 O ATOM 3156 CB THR B 69 -0.596 -11.976 3.411 1.00 0.00 C ATOM 3157 OG1 THR B 69 -0.553 -13.294 2.838 1.00 0.00 O ATOM 3158 CG2 THR B 69 0.637 -11.817 4.289 1.00 0.00 C ATOM 0 H THR B 69 -1.465 -13.698 5.066 1.00 0.00 H new ATOM 0 HA THR B 69 -1.910 -10.835 4.703 1.00 0.00 H new ATOM 0 HB THR B 69 -0.601 -11.208 2.637 1.00 0.00 H new ATOM 0 HG1 THR B 69 0.264 -13.393 2.305 1.00 0.00 H new ATOM 0 HG21 THR B 69 1.534 -11.927 3.680 1.00 0.00 H new ATOM 0 HG22 THR B 69 0.630 -10.829 4.750 1.00 0.00 H new ATOM 0 HG23 THR B 69 0.631 -12.581 5.067 1.00 0.00 H new ATOM 3166 N HIS B 70 -3.797 -13.104 3.374 1.00 0.00 N ATOM 3167 CA HIS B 70 -4.974 -13.322 2.540 1.00 0.00 C ATOM 3168 C HIS B 70 -6.189 -13.358 3.445 1.00 0.00 C ATOM 3169 O HIS B 70 -6.199 -14.089 4.433 1.00 0.00 O ATOM 3170 CB HIS B 70 -4.847 -14.662 1.768 1.00 0.00 C ATOM 3171 CG HIS B 70 -3.672 -14.761 0.818 1.00 0.00 C ATOM 3172 ND1 HIS B 70 -3.346 -15.909 0.145 1.00 0.00 N ATOM 3173 CD2 HIS B 70 -2.742 -13.839 0.448 1.00 0.00 C ATOM 3174 CE1 HIS B 70 -2.259 -15.671 -0.590 1.00 0.00 C ATOM 3175 NE2 HIS B 70 -1.849 -14.421 -0.444 1.00 0.00 N ATOM 0 H HIS B 70 -3.543 -13.894 3.967 1.00 0.00 H new ATOM 0 HA HIS B 70 -5.069 -12.519 1.809 1.00 0.00 H new ATOM 0 HB2 HIS B 70 -4.774 -15.473 2.493 1.00 0.00 H new ATOM 0 HB3 HIS B 70 -5.764 -14.822 1.201 1.00 0.00 H new ATOM 0 HD2 HIS B 70 -2.704 -12.816 0.793 1.00 0.00 H new ATOM 0 HE1 HIS B 70 -1.777 -16.402 -1.222 1.00 0.00 H new ATOM 0 HE2 HIS B 70 -1.047 -13.978 -0.892 1.00 0.00 H new ATOM 3183 N VAL B 71 -7.203 -12.585 3.132 1.00 0.00 N ATOM 3184 CA VAL B 71 -8.374 -12.512 3.980 1.00 0.00 C ATOM 3185 C VAL B 71 -9.608 -13.006 3.241 1.00 0.00 C ATOM 3186 O VAL B 71 -9.846 -12.604 2.105 1.00 0.00 O ATOM 3187 CB VAL B 71 -8.598 -11.051 4.441 1.00 0.00 C ATOM 3188 CG1 VAL B 71 -9.798 -10.937 5.362 1.00 0.00 C ATOM 3189 CG2 VAL B 71 -7.350 -10.523 5.126 1.00 0.00 C ATOM 0 H VAL B 71 -7.243 -11.998 2.299 1.00 0.00 H new ATOM 0 HA VAL B 71 -8.209 -13.150 4.848 1.00 0.00 H new ATOM 0 HB VAL B 71 -8.802 -10.446 3.558 1.00 0.00 H new ATOM 0 HG11 VAL B 71 -9.926 -9.898 5.666 1.00 0.00 H new ATOM 0 HG12 VAL B 71 -10.692 -11.274 4.838 1.00 0.00 H new ATOM 0 HG13 VAL B 71 -9.639 -11.557 6.245 1.00 0.00 H new ATOM 0 HG21 VAL B 71 -7.518 -9.495 5.446 1.00 0.00 H new ATOM 0 HG22 VAL B 71 -7.123 -11.141 5.995 1.00 0.00 H new ATOM 0 HG23 VAL B 71 -6.512 -10.554 4.430 1.00 0.00 H new ATOM 3199 N GLU B 72 -10.378 -13.872 3.870 1.00 0.00 N ATOM 3200 CA GLU B 72 -11.603 -14.361 3.273 1.00 0.00 C ATOM 3201 C GLU B 72 -12.817 -13.739 3.968 1.00 0.00 C ATOM 3202 O GLU B 72 -12.910 -13.715 5.209 1.00 0.00 O ATOM 3203 CB GLU B 72 -11.675 -15.896 3.259 1.00 0.00 C ATOM 3204 CG GLU B 72 -11.628 -16.556 4.622 1.00 0.00 C ATOM 3205 CD GLU B 72 -11.764 -18.049 4.532 1.00 0.00 C ATOM 3206 OE1 GLU B 72 -12.871 -18.539 4.226 1.00 0.00 O ATOM 3207 OE2 GLU B 72 -10.768 -18.769 4.782 1.00 0.00 O1- ATOM 0 H GLU B 72 -10.176 -14.251 4.795 1.00 0.00 H new ATOM 0 HA GLU B 72 -11.611 -14.050 2.228 1.00 0.00 H new ATOM 0 HB2 GLU B 72 -12.596 -16.196 2.759 1.00 0.00 H new ATOM 0 HB3 GLU B 72 -10.848 -16.277 2.660 1.00 0.00 H new ATOM 0 HG2 GLU B 72 -10.687 -16.307 5.113 1.00 0.00 H new ATOM 0 HG3 GLU B 72 -12.428 -16.157 5.245 1.00 0.00 H new ATOM 3214 N ILE B 73 -13.714 -13.230 3.173 1.00 0.00 N ATOM 3215 CA ILE B 73 -14.882 -12.533 3.642 1.00 0.00 C ATOM 3216 C ILE B 73 -16.142 -13.127 3.084 1.00 0.00 C ATOM 3217 O ILE B 73 -16.132 -13.748 2.003 1.00 0.00 O ATOM 3218 CB ILE B 73 -14.873 -11.021 3.331 1.00 0.00 C ATOM 3219 CG1 ILE B 73 -13.765 -10.565 2.327 1.00 0.00 C ATOM 3220 CG2 ILE B 73 -14.771 -10.273 4.620 1.00 0.00 C ATOM 3221 CD1 ILE B 73 -12.364 -10.390 2.913 1.00 0.00 C ATOM 0 H ILE B 73 -13.654 -13.288 2.156 1.00 0.00 H new ATOM 0 HA ILE B 73 -14.855 -12.652 4.725 1.00 0.00 H new ATOM 0 HB ILE B 73 -15.808 -10.794 2.819 1.00 0.00 H new ATOM 0 HG12 ILE B 73 -13.711 -11.295 1.519 1.00 0.00 H new ATOM 0 HG13 ILE B 73 -14.072 -9.619 1.882 1.00 0.00 H new ATOM 0 HG21 ILE B 73 -14.763 -9.202 4.419 1.00 0.00 H new ATOM 0 HG22 ILE B 73 -15.625 -10.518 5.251 1.00 0.00 H new ATOM 0 HG23 ILE B 73 -13.850 -10.553 5.131 1.00 0.00 H new ATOM 0 HD11 ILE B 73 -11.678 -10.072 2.128 1.00 0.00 H new ATOM 0 HD12 ILE B 73 -12.390 -9.635 3.699 1.00 0.00 H new ATOM 0 HD13 ILE B 73 -12.023 -11.337 3.331 1.00 0.00 H new ATOM 3233 N GLU B 74 -17.225 -12.935 3.812 1.00 0.00 N ATOM 3234 CA GLU B 74 -18.515 -13.473 3.437 1.00 0.00 C ATOM 3235 C GLU B 74 -19.079 -12.816 2.203 1.00 0.00 C ATOM 3236 O GLU B 74 -19.094 -11.582 2.073 1.00 0.00 O ATOM 3237 CB GLU B 74 -19.591 -13.340 4.538 1.00 0.00 C ATOM 3238 CG GLU B 74 -19.300 -13.967 5.857 1.00 0.00 C ATOM 3239 CD GLU B 74 -18.560 -13.040 6.779 1.00 0.00 C ATOM 3240 OE1 GLU B 74 -17.379 -12.730 6.545 1.00 0.00 O ATOM 3241 OE2 GLU B 74 -19.174 -12.561 7.755 1.00 0.00 O1- ATOM 0 H GLU B 74 -17.234 -12.401 4.681 1.00 0.00 H new ATOM 0 HA GLU B 74 -18.304 -14.527 3.256 1.00 0.00 H new ATOM 0 HB2 GLU B 74 -19.776 -12.278 4.703 1.00 0.00 H new ATOM 0 HB3 GLU B 74 -20.518 -13.770 4.158 1.00 0.00 H new ATOM 0 HG2 GLU B 74 -20.236 -14.272 6.326 1.00 0.00 H new ATOM 0 HG3 GLU B 74 -18.711 -14.871 5.705 1.00 0.00 H new ATOM 3248 N LYS B 75 -19.606 -13.661 1.354 1.00 0.00 N ATOM 3249 CA LYS B 75 -20.373 -13.304 0.173 1.00 0.00 C ATOM 3250 C LYS B 75 -21.564 -12.454 0.583 1.00 0.00 C ATOM 3251 O LYS B 75 -21.982 -11.562 -0.117 1.00 0.00 O ATOM 3252 CB LYS B 75 -20.883 -14.614 -0.390 1.00 0.00 C ATOM 3253 CG LYS B 75 -21.826 -14.540 -1.560 1.00 0.00 C ATOM 3254 CD LYS B 75 -22.143 -15.941 -2.032 1.00 0.00 C ATOM 3255 CE LYS B 75 -23.293 -15.982 -3.019 1.00 0.00 C ATOM 3256 NZ LYS B 75 -24.558 -15.493 -2.442 1.00 0.00 N1+ ATOM 0 H LYS B 75 -19.510 -14.670 1.468 1.00 0.00 H new ATOM 0 HA LYS B 75 -19.773 -12.746 -0.546 1.00 0.00 H new ATOM 0 HB2 LYS B 75 -20.021 -15.212 -0.688 1.00 0.00 H new ATOM 0 HB3 LYS B 75 -21.383 -15.155 0.413 1.00 0.00 H new ATOM 0 HG2 LYS B 75 -22.742 -14.024 -1.272 1.00 0.00 H new ATOM 0 HG3 LYS B 75 -21.377 -13.964 -2.369 1.00 0.00 H new ATOM 0 HD2 LYS B 75 -21.256 -16.373 -2.496 1.00 0.00 H new ATOM 0 HD3 LYS B 75 -22.387 -16.563 -1.171 1.00 0.00 H new ATOM 0 HE2 LYS B 75 -23.039 -15.379 -3.891 1.00 0.00 H new ATOM 0 HE3 LYS B 75 -23.430 -17.005 -3.368 1.00 0.00 H new ATOM 0 HZ1 LYS B 75 -25.354 -15.816 -3.027 1.00 0.00 H new ATOM 0 HZ2 LYS B 75 -24.665 -15.864 -1.476 1.00 0.00 H new ATOM 0 HZ3 LYS B 75 -24.548 -14.453 -2.415 1.00 0.00 H new ATOM 3270 N LYS B 76 -22.063 -12.780 1.741 1.00 0.00 N ATOM 3271 CA LYS B 76 -23.224 -12.177 2.360 1.00 0.00 C ATOM 3272 C LYS B 76 -23.124 -10.652 2.520 1.00 0.00 C ATOM 3273 O LYS B 76 -23.986 -9.929 2.042 1.00 0.00 O ATOM 3274 CB LYS B 76 -23.364 -12.784 3.740 1.00 0.00 C ATOM 3275 CG LYS B 76 -23.613 -14.271 3.770 1.00 0.00 C ATOM 3276 CD LYS B 76 -23.339 -14.795 5.159 1.00 0.00 C ATOM 3277 CE LYS B 76 -23.893 -16.188 5.377 1.00 0.00 C ATOM 3278 NZ LYS B 76 -25.366 -16.213 5.290 1.00 0.00 N1+ ATOM 0 H LYS B 76 -21.652 -13.515 2.317 1.00 0.00 H new ATOM 0 HA LYS B 76 -24.079 -12.370 1.712 1.00 0.00 H new ATOM 0 HB2 LYS B 76 -22.456 -12.573 4.305 1.00 0.00 H new ATOM 0 HB3 LYS B 76 -24.184 -12.285 4.257 1.00 0.00 H new ATOM 0 HG2 LYS B 76 -24.643 -14.485 3.485 1.00 0.00 H new ATOM 0 HG3 LYS B 76 -22.971 -14.773 3.046 1.00 0.00 H new ATOM 0 HD2 LYS B 76 -22.263 -14.805 5.334 1.00 0.00 H new ATOM 0 HD3 LYS B 76 -23.775 -14.116 5.892 1.00 0.00 H new ATOM 0 HE2 LYS B 76 -23.474 -16.866 4.634 1.00 0.00 H new ATOM 0 HE3 LYS B 76 -23.581 -16.554 6.355 1.00 0.00 H new ATOM 0 HZ1 LYS B 76 -25.726 -17.074 5.749 1.00 0.00 H new ATOM 0 HZ2 LYS B 76 -25.756 -15.376 5.769 1.00 0.00 H new ATOM 0 HZ3 LYS B 76 -25.655 -16.206 4.291 1.00 0.00 H new ATOM 3292 N LYS B 77 -22.060 -10.157 3.133 1.00 0.00 N ATOM 3293 CA LYS B 77 -22.003 -8.718 3.425 1.00 0.00 C ATOM 3294 C LYS B 77 -21.379 -7.960 2.286 1.00 0.00 C ATOM 3295 O LYS B 77 -21.748 -6.827 1.987 1.00 0.00 O ATOM 3296 CB LYS B 77 -21.274 -8.435 4.750 1.00 0.00 C ATOM 3297 CG LYS B 77 -21.261 -6.958 5.152 1.00 0.00 C ATOM 3298 CD LYS B 77 -20.593 -6.718 6.509 1.00 0.00 C ATOM 3299 CE LYS B 77 -21.366 -7.350 7.679 1.00 0.00 C ATOM 3300 NZ LYS B 77 -22.723 -6.784 7.836 1.00 0.00 N1+ ATOM 0 H LYS B 77 -21.249 -10.699 3.432 1.00 0.00 H new ATOM 0 HA LYS B 77 -23.028 -8.367 3.540 1.00 0.00 H new ATOM 0 HB2 LYS B 77 -21.748 -9.013 5.544 1.00 0.00 H new ATOM 0 HB3 LYS B 77 -20.246 -8.788 4.669 1.00 0.00 H new ATOM 0 HG2 LYS B 77 -20.738 -6.383 4.388 1.00 0.00 H new ATOM 0 HG3 LYS B 77 -22.285 -6.586 5.186 1.00 0.00 H new ATOM 0 HD2 LYS B 77 -19.582 -7.124 6.487 1.00 0.00 H new ATOM 0 HD3 LYS B 77 -20.502 -5.645 6.678 1.00 0.00 H new ATOM 0 HE2 LYS B 77 -21.441 -8.426 7.521 1.00 0.00 H new ATOM 0 HE3 LYS B 77 -20.806 -7.202 8.602 1.00 0.00 H new ATOM 0 HZ1 LYS B 77 -23.143 -7.129 8.723 1.00 0.00 H new ATOM 0 HZ2 LYS B 77 -22.665 -5.746 7.862 1.00 0.00 H new ATOM 0 HZ3 LYS B 77 -23.317 -7.078 7.034 1.00 0.00 H new ATOM 3314 N TYR B 78 -20.479 -8.601 1.624 1.00 0.00 N ATOM 3315 CA TYR B 78 -19.795 -8.021 0.497 1.00 0.00 C ATOM 3316 C TYR B 78 -20.682 -8.134 -0.768 1.00 0.00 C ATOM 3317 O TYR B 78 -20.372 -7.578 -1.800 1.00 0.00 O ATOM 3318 CB TYR B 78 -18.420 -8.716 0.349 1.00 0.00 C ATOM 3319 CG TYR B 78 -17.345 -8.216 1.286 1.00 0.00 C ATOM 3320 CD1 TYR B 78 -17.526 -8.179 2.670 1.00 0.00 C ATOM 3321 CD2 TYR B 78 -16.127 -7.795 0.778 1.00 0.00 C ATOM 3322 CE1 TYR B 78 -16.526 -7.752 3.495 1.00 0.00 C ATOM 3323 CE2 TYR B 78 -15.116 -7.373 1.607 1.00 0.00 C ATOM 3324 CZ TYR B 78 -15.318 -7.356 2.961 1.00 0.00 C ATOM 3325 OH TYR B 78 -14.306 -6.950 3.797 1.00 0.00 O ATOM 0 H TYR B 78 -20.187 -9.553 1.844 1.00 0.00 H new ATOM 0 HA TYR B 78 -19.612 -6.957 0.646 1.00 0.00 H new ATOM 0 HB2 TYR B 78 -18.552 -9.786 0.510 1.00 0.00 H new ATOM 0 HB3 TYR B 78 -18.074 -8.588 -0.677 1.00 0.00 H new ATOM 0 HD1 TYR B 78 -18.469 -8.492 3.093 1.00 0.00 H new ATOM 0 HD2 TYR B 78 -15.969 -7.799 -0.290 1.00 0.00 H new ATOM 0 HE1 TYR B 78 -16.681 -7.724 4.564 1.00 0.00 H new ATOM 0 HE2 TYR B 78 -14.169 -7.057 1.194 1.00 0.00 H new ATOM 0 HH TYR B 78 -13.521 -6.704 3.265 1.00 0.00 H new ATOM 3335 N LYS B 79 -21.817 -8.830 -0.611 1.00 0.00 N ATOM 3336 CA LYS B 79 -22.880 -9.025 -1.619 1.00 0.00 C ATOM 3337 C LYS B 79 -22.394 -9.503 -2.997 1.00 0.00 C ATOM 3338 O LYS B 79 -22.959 -9.128 -4.034 1.00 0.00 O ATOM 3339 CB LYS B 79 -23.859 -7.811 -1.711 1.00 0.00 C ATOM 3340 CG LYS B 79 -23.246 -6.480 -2.143 1.00 0.00 C ATOM 3341 CD LYS B 79 -24.258 -5.338 -2.114 1.00 0.00 C ATOM 3342 CE LYS B 79 -25.402 -5.553 -3.096 1.00 0.00 C ATOM 3343 NZ LYS B 79 -26.385 -4.444 -3.060 1.00 0.00 N1+ ATOM 0 H LYS B 79 -22.034 -9.299 0.268 1.00 0.00 H new ATOM 0 HA LYS B 79 -23.455 -9.867 -1.234 1.00 0.00 H new ATOM 0 HB2 LYS B 79 -24.654 -8.065 -2.412 1.00 0.00 H new ATOM 0 HB3 LYS B 79 -24.325 -7.673 -0.736 1.00 0.00 H new ATOM 0 HG2 LYS B 79 -22.410 -6.238 -1.487 1.00 0.00 H new ATOM 0 HG3 LYS B 79 -22.842 -6.579 -3.151 1.00 0.00 H new ATOM 0 HD2 LYS B 79 -24.661 -5.239 -1.106 1.00 0.00 H new ATOM 0 HD3 LYS B 79 -23.752 -4.401 -2.349 1.00 0.00 H new ATOM 0 HE2 LYS B 79 -25.000 -5.648 -4.105 1.00 0.00 H new ATOM 0 HE3 LYS B 79 -25.906 -6.491 -2.864 1.00 0.00 H new ATOM 0 HZ1 LYS B 79 -27.146 -4.632 -3.744 1.00 0.00 H new ATOM 0 HZ2 LYS B 79 -26.789 -4.369 -2.105 1.00 0.00 H new ATOM 0 HZ3 LYS B 79 -25.911 -3.552 -3.306 1.00 0.00 H new ATOM 3357 N LEU B 80 -21.405 -10.378 -3.009 1.00 0.00 N ATOM 3358 CA LEU B 80 -20.937 -10.941 -4.270 1.00 0.00 C ATOM 3359 C LEU B 80 -21.704 -12.178 -4.624 1.00 0.00 C ATOM 3360 O LEU B 80 -22.624 -12.613 -3.924 1.00 0.00 O ATOM 3361 CB LEU B 80 -19.427 -11.288 -4.285 1.00 0.00 C ATOM 3362 CG LEU B 80 -18.402 -10.183 -4.516 1.00 0.00 C ATOM 3363 CD1 LEU B 80 -18.295 -9.284 -3.335 1.00 0.00 C ATOM 3364 CD2 LEU B 80 -17.055 -10.797 -4.819 1.00 0.00 C ATOM 0 H LEU B 80 -20.916 -10.712 -2.179 1.00 0.00 H new ATOM 0 HA LEU B 80 -21.105 -10.153 -5.004 1.00 0.00 H new ATOM 0 HB2 LEU B 80 -19.191 -11.757 -3.330 1.00 0.00 H new ATOM 0 HB3 LEU B 80 -19.273 -12.042 -5.057 1.00 0.00 H new ATOM 0 HG LEU B 80 -18.733 -9.583 -5.364 1.00 0.00 H new ATOM 0 HD11 LEU B 80 -17.556 -8.508 -3.534 1.00 0.00 H new ATOM 0 HD12 LEU B 80 -19.263 -8.822 -3.141 1.00 0.00 H new ATOM 0 HD13 LEU B 80 -17.988 -9.863 -2.464 1.00 0.00 H new ATOM 0 HD21 LEU B 80 -16.323 -10.006 -4.984 1.00 0.00 H new ATOM 0 HD22 LEU B 80 -16.739 -11.414 -3.978 1.00 0.00 H new ATOM 0 HD23 LEU B 80 -17.130 -11.414 -5.714 1.00 0.00 H new ATOM 3376 N ASP B 81 -21.303 -12.739 -5.713 1.00 0.00 N ATOM 3377 CA ASP B 81 -21.882 -13.968 -6.232 1.00 0.00 C ATOM 3378 C ASP B 81 -21.112 -15.167 -5.681 1.00 0.00 C ATOM 3379 O ASP B 81 -21.494 -16.323 -5.887 1.00 0.00 O ATOM 3380 CB ASP B 81 -21.833 -13.985 -7.771 1.00 0.00 C ATOM 3381 CG ASP B 81 -20.420 -14.040 -8.322 1.00 0.00 C ATOM 3382 OD1 ASP B 81 -19.746 -12.997 -8.397 1.00 0.00 O ATOM 3383 OD2 ASP B 81 -19.953 -15.121 -8.688 1.00 0.00 O1- ATOM 0 H ASP B 81 -20.551 -12.363 -6.291 1.00 0.00 H new ATOM 0 HA ASP B 81 -22.924 -14.023 -5.917 1.00 0.00 H new ATOM 0 HB2 ASP B 81 -22.393 -14.846 -8.137 1.00 0.00 H new ATOM 0 HB3 ASP B 81 -22.331 -13.095 -8.154 1.00 0.00 H new ATOM 3388 N LYS B 82 -20.054 -14.880 -4.955 1.00 0.00 N ATOM 3389 CA LYS B 82 -19.182 -15.874 -4.401 1.00 0.00 C ATOM 3390 C LYS B 82 -18.476 -15.257 -3.200 1.00 0.00 C ATOM 3391 O LYS B 82 -18.561 -14.041 -3.019 1.00 0.00 O ATOM 3392 CB LYS B 82 -18.152 -16.288 -5.470 1.00 0.00 C ATOM 3393 CG LYS B 82 -17.279 -15.125 -5.983 1.00 0.00 C ATOM 3394 CD LYS B 82 -16.179 -15.558 -6.972 1.00 0.00 C ATOM 3395 CE LYS B 82 -16.660 -15.779 -8.416 1.00 0.00 C ATOM 3396 NZ LYS B 82 -17.271 -14.564 -8.998 1.00 0.00 N1+ ATOM 0 H LYS B 82 -19.776 -13.924 -4.732 1.00 0.00 H new ATOM 0 HA LYS B 82 -19.739 -16.758 -4.090 1.00 0.00 H new ATOM 0 HB2 LYS B 82 -17.504 -17.060 -5.056 1.00 0.00 H new ATOM 0 HB3 LYS B 82 -18.679 -16.733 -6.314 1.00 0.00 H new ATOM 0 HG2 LYS B 82 -17.920 -14.389 -6.468 1.00 0.00 H new ATOM 0 HG3 LYS B 82 -16.813 -14.630 -5.131 1.00 0.00 H new ATOM 0 HD2 LYS B 82 -15.396 -14.800 -6.977 1.00 0.00 H new ATOM 0 HD3 LYS B 82 -15.727 -16.481 -6.609 1.00 0.00 H new ATOM 0 HE2 LYS B 82 -15.817 -16.090 -9.033 1.00 0.00 H new ATOM 0 HE3 LYS B 82 -17.386 -16.592 -8.434 1.00 0.00 H new ATOM 0 HZ1 LYS B 82 -18.271 -14.749 -9.216 1.00 0.00 H new ATOM 0 HZ2 LYS B 82 -17.204 -13.781 -8.317 1.00 0.00 H new ATOM 0 HZ3 LYS B 82 -16.768 -14.307 -9.871 1.00 0.00 H new ATOM 3410 N ASP B 83 -17.856 -16.079 -2.356 1.00 0.00 N ATOM 3411 CA ASP B 83 -17.007 -15.570 -1.250 1.00 0.00 C ATOM 3412 C ASP B 83 -15.935 -14.624 -1.777 1.00 0.00 C ATOM 3413 O ASP B 83 -15.508 -14.719 -2.941 1.00 0.00 O ATOM 3414 CB ASP B 83 -16.352 -16.709 -0.429 1.00 0.00 C ATOM 3415 CG ASP B 83 -15.544 -17.687 -1.261 1.00 0.00 C ATOM 3416 OD1 ASP B 83 -14.340 -17.471 -1.487 1.00 0.00 O1- ATOM 3417 OD2 ASP B 83 -16.124 -18.712 -1.710 1.00 0.00 O ATOM 0 H ASP B 83 -17.917 -17.096 -2.405 1.00 0.00 H new ATOM 0 HA ASP B 83 -17.670 -15.023 -0.579 1.00 0.00 H new ATOM 0 HB2 ASP B 83 -15.702 -16.269 0.328 1.00 0.00 H new ATOM 0 HB3 ASP B 83 -17.132 -17.256 0.100 1.00 0.00 H new ATOM 3422 N SER B 84 -15.520 -13.716 -0.955 1.00 0.00 N ATOM 3423 CA SER B 84 -14.594 -12.706 -1.359 1.00 0.00 C ATOM 3424 C SER B 84 -13.255 -12.916 -0.669 1.00 0.00 C ATOM 3425 O SER B 84 -13.214 -13.163 0.526 1.00 0.00 O ATOM 3426 CB SER B 84 -15.189 -11.366 -0.957 1.00 0.00 C ATOM 3427 OG SER B 84 -16.509 -11.254 -1.447 1.00 0.00 O ATOM 0 H SER B 84 -15.814 -13.653 0.020 1.00 0.00 H new ATOM 0 HA SER B 84 -14.423 -12.745 -2.435 1.00 0.00 H new ATOM 0 HB2 SER B 84 -15.187 -11.269 0.129 1.00 0.00 H new ATOM 0 HB3 SER B 84 -14.577 -10.555 -1.351 1.00 0.00 H new ATOM 0 HG SER B 84 -17.060 -10.771 -0.796 1.00 0.00 H new ATOM 3433 N VAL B 85 -12.180 -12.886 -1.412 1.00 0.00 N ATOM 3434 CA VAL B 85 -10.874 -12.958 -0.812 1.00 0.00 C ATOM 3435 C VAL B 85 -10.152 -11.669 -1.141 1.00 0.00 C ATOM 3436 O VAL B 85 -10.042 -11.284 -2.289 1.00 0.00 O ATOM 3437 CB VAL B 85 -10.051 -14.123 -1.368 1.00 0.00 C ATOM 3438 CG1 VAL B 85 -8.812 -14.398 -0.520 1.00 0.00 C ATOM 3439 CG2 VAL B 85 -10.891 -15.367 -1.562 1.00 0.00 C ATOM 0 H VAL B 85 -12.182 -12.813 -2.429 1.00 0.00 H new ATOM 0 HA VAL B 85 -10.989 -13.109 0.261 1.00 0.00 H new ATOM 0 HB VAL B 85 -9.700 -13.822 -2.355 1.00 0.00 H new ATOM 0 HG11 VAL B 85 -8.256 -15.232 -0.948 1.00 0.00 H new ATOM 0 HG12 VAL B 85 -8.179 -13.511 -0.502 1.00 0.00 H new ATOM 0 HG13 VAL B 85 -9.115 -14.648 0.497 1.00 0.00 H new ATOM 0 HG21 VAL B 85 -10.268 -16.169 -1.958 1.00 0.00 H new ATOM 0 HG22 VAL B 85 -11.313 -15.674 -0.605 1.00 0.00 H new ATOM 0 HG23 VAL B 85 -11.698 -15.155 -2.263 1.00 0.00 H new ATOM 3449 N ILE B 86 -9.708 -11.004 -0.158 1.00 0.00 N ATOM 3450 CA ILE B 86 -9.008 -9.742 -0.337 1.00 0.00 C ATOM 3451 C ILE B 86 -7.593 -9.939 0.016 1.00 0.00 C ATOM 3452 O ILE B 86 -7.251 -10.480 1.080 1.00 0.00 O ATOM 3453 CB ILE B 86 -9.669 -8.483 0.395 1.00 0.00 C ATOM 3454 CG1 ILE B 86 -10.914 -7.964 -0.347 1.00 0.00 C ATOM 3455 CG2 ILE B 86 -8.688 -7.328 0.521 1.00 0.00 C ATOM 3456 CD1 ILE B 86 -12.019 -8.951 -0.545 1.00 0.00 C ATOM 0 H ILE B 86 -9.805 -11.296 0.815 1.00 0.00 H new ATOM 0 HA ILE B 86 -9.094 -9.467 -1.388 1.00 0.00 H new ATOM 0 HB ILE B 86 -9.957 -8.840 1.384 1.00 0.00 H new ATOM 0 HG12 ILE B 86 -11.310 -7.110 0.203 1.00 0.00 H new ATOM 0 HG13 ILE B 86 -10.603 -7.596 -1.325 1.00 0.00 H new ATOM 0 HG21 ILE B 86 -9.174 -6.491 1.023 1.00 0.00 H new ATOM 0 HG22 ILE B 86 -7.823 -7.647 1.102 1.00 0.00 H new ATOM 0 HG23 ILE B 86 -8.364 -7.016 -0.472 1.00 0.00 H new ATOM 0 HD11 ILE B 86 -12.842 -8.474 -1.078 1.00 0.00 H new ATOM 0 HD12 ILE B 86 -11.652 -9.797 -1.127 1.00 0.00 H new ATOM 0 HD13 ILE B 86 -12.371 -9.303 0.425 1.00 0.00 H new ATOM 3468 N LEU B 87 -6.784 -9.571 -0.895 1.00 0.00 N ATOM 3469 CA LEU B 87 -5.367 -9.800 -0.771 1.00 0.00 C ATOM 3470 C LEU B 87 -4.630 -8.573 -0.281 1.00 0.00 C ATOM 3471 O LEU B 87 -4.366 -7.638 -1.036 1.00 0.00 O ATOM 3472 CB LEU B 87 -4.777 -10.367 -2.078 1.00 0.00 C ATOM 3473 CG LEU B 87 -5.438 -11.668 -2.598 1.00 0.00 C ATOM 3474 CD1 LEU B 87 -4.719 -12.209 -3.816 1.00 0.00 C ATOM 3475 CD2 LEU B 87 -5.498 -12.731 -1.521 1.00 0.00 C ATOM 0 H LEU B 87 -7.065 -9.101 -1.756 1.00 0.00 H new ATOM 0 HA LEU B 87 -5.224 -10.559 -0.002 1.00 0.00 H new ATOM 0 HB2 LEU B 87 -4.857 -9.605 -2.853 1.00 0.00 H new ATOM 0 HB3 LEU B 87 -3.714 -10.556 -1.925 1.00 0.00 H new ATOM 0 HG LEU B 87 -6.457 -11.409 -2.885 1.00 0.00 H new ATOM 0 HD11 LEU B 87 -5.210 -13.122 -4.153 1.00 0.00 H new ATOM 0 HD12 LEU B 87 -4.746 -11.467 -4.614 1.00 0.00 H new ATOM 0 HD13 LEU B 87 -3.683 -12.428 -3.559 1.00 0.00 H new ATOM 0 HD21 LEU B 87 -5.968 -13.629 -1.922 1.00 0.00 H new ATOM 0 HD22 LEU B 87 -4.488 -12.968 -1.187 1.00 0.00 H new ATOM 0 HD23 LEU B 87 -6.082 -12.362 -0.678 1.00 0.00 H new ATOM 3487 N LEU B 88 -4.290 -8.590 0.992 1.00 0.00 N ATOM 3488 CA LEU B 88 -3.573 -7.490 1.637 1.00 0.00 C ATOM 3489 C LEU B 88 -2.115 -7.656 1.385 1.00 0.00 C ATOM 3490 O LEU B 88 -1.368 -8.071 2.249 1.00 0.00 O ATOM 3491 CB LEU B 88 -3.851 -7.387 3.160 1.00 0.00 C ATOM 3492 CG LEU B 88 -5.231 -6.873 3.593 1.00 0.00 C ATOM 3493 CD1 LEU B 88 -5.457 -5.479 3.089 1.00 0.00 C ATOM 3494 CD2 LEU B 88 -6.329 -7.790 3.141 1.00 0.00 C ATOM 0 H LEU B 88 -4.501 -9.367 1.618 1.00 0.00 H new ATOM 0 HA LEU B 88 -3.935 -6.558 1.203 1.00 0.00 H new ATOM 0 HB2 LEU B 88 -3.708 -8.376 3.596 1.00 0.00 H new ATOM 0 HB3 LEU B 88 -3.096 -6.733 3.597 1.00 0.00 H new ATOM 0 HG LEU B 88 -5.251 -6.854 4.683 1.00 0.00 H new ATOM 0 HD11 LEU B 88 -6.441 -5.132 3.406 1.00 0.00 H new ATOM 0 HD12 LEU B 88 -4.691 -4.817 3.494 1.00 0.00 H new ATOM 0 HD13 LEU B 88 -5.404 -5.473 2.000 1.00 0.00 H new ATOM 0 HD21 LEU B 88 -7.291 -7.394 3.466 1.00 0.00 H new ATOM 0 HD22 LEU B 88 -6.316 -7.865 2.054 1.00 0.00 H new ATOM 0 HD23 LEU B 88 -6.179 -8.779 3.575 1.00 0.00 H new ATOM 3506 N GLU B 89 -1.767 -7.404 0.161 1.00 0.00 N ATOM 3507 CA GLU B 89 -0.437 -7.586 -0.388 1.00 0.00 C ATOM 3508 C GLU B 89 -0.507 -7.127 -1.823 1.00 0.00 C ATOM 3509 O GLU B 89 0.250 -6.275 -2.271 1.00 0.00 O ATOM 3510 CB GLU B 89 -0.092 -9.091 -0.265 1.00 0.00 C ATOM 3511 CG GLU B 89 0.955 -9.682 -1.203 1.00 0.00 C ATOM 3512 CD GLU B 89 2.369 -9.257 -0.935 1.00 0.00 C ATOM 3513 OE1 GLU B 89 2.989 -9.828 -0.020 1.00 0.00 O ATOM 3514 OE2 GLU B 89 2.894 -8.448 -1.713 1.00 0.00 O1- ATOM 0 H GLU B 89 -2.430 -7.047 -0.527 1.00 0.00 H new ATOM 0 HA GLU B 89 0.338 -7.019 0.128 1.00 0.00 H new ATOM 0 HB2 GLU B 89 0.241 -9.271 0.757 1.00 0.00 H new ATOM 0 HB3 GLU B 89 -1.015 -9.654 -0.404 1.00 0.00 H new ATOM 0 HG2 GLU B 89 0.902 -10.769 -1.141 1.00 0.00 H new ATOM 0 HG3 GLU B 89 0.698 -9.408 -2.226 1.00 0.00 H new ATOM 3521 N GLN B 90 -1.510 -7.616 -2.496 1.00 0.00 N ATOM 3522 CA GLN B 90 -1.744 -7.282 -3.872 1.00 0.00 C ATOM 3523 C GLN B 90 -2.696 -6.086 -3.880 1.00 0.00 C ATOM 3524 O GLN B 90 -3.926 -6.237 -3.889 1.00 0.00 O ATOM 3525 CB GLN B 90 -2.361 -8.493 -4.562 1.00 0.00 C ATOM 3526 CG GLN B 90 -2.214 -8.574 -6.077 1.00 0.00 C ATOM 3527 CD GLN B 90 -3.050 -7.573 -6.820 1.00 0.00 C ATOM 3528 OE1 GLN B 90 -4.191 -7.835 -7.129 1.00 0.00 O ATOM 3529 NE2 GLN B 90 -2.481 -6.446 -7.155 1.00 0.00 N ATOM 0 H GLN B 90 -2.193 -8.263 -2.102 1.00 0.00 H new ATOM 0 HA GLN B 90 -0.828 -7.023 -4.403 1.00 0.00 H new ATOM 0 HB2 GLN B 90 -1.919 -9.391 -4.130 1.00 0.00 H new ATOM 0 HB3 GLN B 90 -3.424 -8.514 -4.323 1.00 0.00 H new ATOM 0 HG2 GLN B 90 -1.167 -8.425 -6.340 1.00 0.00 H new ATOM 0 HG3 GLN B 90 -2.486 -9.577 -6.406 1.00 0.00 H new ATOM 0 HE21 GLN B 90 -1.518 -6.259 -6.877 1.00 0.00 H new ATOM 0 HE22 GLN B 90 -3.000 -5.753 -7.694 1.00 0.00 H new ATOM 3538 N ILE B 91 -2.133 -4.909 -3.770 1.00 0.00 N ATOM 3539 CA ILE B 91 -2.924 -3.712 -3.666 1.00 0.00 C ATOM 3540 C ILE B 91 -2.588 -2.734 -4.780 1.00 0.00 C ATOM 3541 O ILE B 91 -1.727 -3.017 -5.635 1.00 0.00 O ATOM 3542 CB ILE B 91 -2.835 -3.086 -2.213 1.00 0.00 C ATOM 3543 CG1 ILE B 91 -1.481 -2.550 -1.820 1.00 0.00 C ATOM 3544 CG2 ILE B 91 -3.193 -4.121 -1.233 1.00 0.00 C ATOM 3545 CD1 ILE B 91 -1.189 -1.192 -2.354 1.00 0.00 C ATOM 0 H ILE B 91 -1.125 -4.755 -3.750 1.00 0.00 H new ATOM 0 HA ILE B 91 -3.973 -3.974 -3.808 1.00 0.00 H new ATOM 0 HB ILE B 91 -3.518 -2.236 -2.225 1.00 0.00 H new ATOM 0 HG12 ILE B 91 -1.414 -2.524 -0.732 1.00 0.00 H new ATOM 0 HG13 ILE B 91 -0.713 -3.240 -2.170 1.00 0.00 H new ATOM 0 HG21 ILE B 91 -3.136 -3.705 -0.227 1.00 0.00 H new ATOM 0 HG22 ILE B 91 -4.208 -4.469 -1.425 1.00 0.00 H new ATOM 0 HG23 ILE B 91 -2.500 -4.958 -1.319 1.00 0.00 H new ATOM 0 HD11 ILE B 91 -0.198 -0.878 -2.027 1.00 0.00 H new ATOM 0 HD12 ILE B 91 -1.222 -1.215 -3.443 1.00 0.00 H new ATOM 0 HD13 ILE B 91 -1.933 -0.487 -1.983 1.00 0.00 H new ATOM 3557 N ARG B 92 -3.262 -1.617 -4.795 1.00 0.00 N ATOM 3558 CA ARG B 92 -3.108 -0.660 -5.864 1.00 0.00 C ATOM 3559 C ARG B 92 -3.410 0.788 -5.403 1.00 0.00 C ATOM 3560 O ARG B 92 -4.263 1.010 -4.573 1.00 0.00 O ATOM 3561 CB ARG B 92 -4.088 -1.084 -6.935 1.00 0.00 C ATOM 3562 CG ARG B 92 -4.214 -0.207 -8.138 1.00 0.00 C ATOM 3563 CD ARG B 92 -2.993 -0.229 -9.077 1.00 0.00 C ATOM 3564 NE ARG B 92 -3.331 0.358 -10.405 1.00 0.00 N ATOM 3565 CZ ARG B 92 -2.810 1.478 -10.967 1.00 0.00 C ATOM 3566 NH1 ARG B 92 -1.842 2.146 -10.380 1.00 0.00 N1+ ATOM 3567 NH2 ARG B 92 -3.295 1.920 -12.128 1.00 0.00 N ATOM 0 H ARG B 92 -3.929 -1.343 -4.074 1.00 0.00 H new ATOM 0 HA ARG B 92 -2.078 -0.650 -6.222 1.00 0.00 H new ATOM 0 HB2 ARG B 92 -3.807 -2.081 -7.273 1.00 0.00 H new ATOM 0 HB3 ARG B 92 -5.073 -1.169 -6.476 1.00 0.00 H new ATOM 0 HG2 ARG B 92 -5.096 -0.511 -8.702 1.00 0.00 H new ATOM 0 HG3 ARG B 92 -4.384 0.818 -7.808 1.00 0.00 H new ATOM 0 HD2 ARG B 92 -2.173 0.330 -8.626 1.00 0.00 H new ATOM 0 HD3 ARG B 92 -2.647 -1.255 -9.206 1.00 0.00 H new ATOM 0 HE ARG B 92 -4.033 -0.138 -10.953 1.00 0.00 H new ATOM 0 HH11 ARG B 92 -1.470 1.825 -9.486 1.00 0.00 H new ATOM 0 HH12 ARG B 92 -1.463 2.986 -10.818 1.00 0.00 H new ATOM 0 HH21 ARG B 92 -4.053 1.417 -12.589 1.00 0.00 H new ATOM 0 HH22 ARG B 92 -2.908 2.761 -12.555 1.00 0.00 H new ATOM 3581 N THR B 93 -2.709 1.741 -5.980 1.00 0.00 N ATOM 3582 CA THR B 93 -2.923 3.147 -5.729 1.00 0.00 C ATOM 3583 C THR B 93 -3.396 3.792 -7.054 1.00 0.00 C ATOM 3584 O THR B 93 -2.697 3.722 -8.070 1.00 0.00 O ATOM 3585 CB THR B 93 -1.630 3.837 -5.171 1.00 0.00 C ATOM 3586 OG1 THR B 93 -1.230 3.185 -3.965 1.00 0.00 O ATOM 3587 CG2 THR B 93 -1.892 5.299 -4.875 1.00 0.00 C ATOM 0 H THR B 93 -1.961 1.555 -6.648 1.00 0.00 H new ATOM 0 HA THR B 93 -3.684 3.280 -4.960 1.00 0.00 H new ATOM 0 HB THR B 93 -0.843 3.762 -5.921 1.00 0.00 H new ATOM 0 HG1 THR B 93 -1.077 3.855 -3.266 1.00 0.00 H new ATOM 0 HG21 THR B 93 -0.983 5.761 -4.489 1.00 0.00 H new ATOM 0 HG22 THR B 93 -2.196 5.807 -5.790 1.00 0.00 H new ATOM 0 HG23 THR B 93 -2.686 5.383 -4.133 1.00 0.00 H new ATOM 3595 N LEU B 94 -4.584 4.355 -7.028 1.00 0.00 N ATOM 3596 CA LEU B 94 -5.307 4.862 -8.196 1.00 0.00 C ATOM 3597 C LEU B 94 -5.808 6.247 -7.938 1.00 0.00 C ATOM 3598 O LEU B 94 -6.181 6.531 -6.838 1.00 0.00 O ATOM 3599 CB LEU B 94 -6.538 3.980 -8.326 1.00 0.00 C ATOM 3600 CG LEU B 94 -6.247 2.550 -8.641 1.00 0.00 C ATOM 3601 CD1 LEU B 94 -7.386 1.663 -8.243 1.00 0.00 C ATOM 3602 CD2 LEU B 94 -5.948 2.399 -10.096 1.00 0.00 C ATOM 0 H LEU B 94 -5.103 4.482 -6.159 1.00 0.00 H new ATOM 0 HA LEU B 94 -4.661 4.862 -9.074 1.00 0.00 H new ATOM 0 HB2 LEU B 94 -7.102 4.026 -7.394 1.00 0.00 H new ATOM 0 HB3 LEU B 94 -7.180 4.387 -9.107 1.00 0.00 H new ATOM 0 HG LEU B 94 -5.373 2.244 -8.065 1.00 0.00 H new ATOM 0 HD11 LEU B 94 -7.143 0.628 -8.485 1.00 0.00 H new ATOM 0 HD12 LEU B 94 -7.560 1.753 -7.171 1.00 0.00 H new ATOM 0 HD13 LEU B 94 -8.285 1.961 -8.783 1.00 0.00 H new ATOM 0 HD21 LEU B 94 -5.737 1.353 -10.317 1.00 0.00 H new ATOM 0 HD22 LEU B 94 -6.808 2.727 -10.680 1.00 0.00 H new ATOM 0 HD23 LEU B 94 -5.081 3.007 -10.354 1.00 0.00 H new ATOM 3614 N ASP B 95 -5.816 7.129 -8.920 1.00 0.00 N ATOM 3615 CA ASP B 95 -6.502 8.394 -8.673 1.00 0.00 C ATOM 3616 C ASP B 95 -8.013 8.213 -8.763 1.00 0.00 C ATOM 3617 O ASP B 95 -8.496 7.308 -9.440 1.00 0.00 O ATOM 3618 CB ASP B 95 -6.024 9.573 -9.519 1.00 0.00 C ATOM 3619 CG ASP B 95 -6.728 9.739 -10.832 1.00 0.00 C ATOM 3620 OD1 ASP B 95 -7.804 10.367 -10.878 1.00 0.00 O1- ATOM 3621 OD2 ASP B 95 -6.197 9.318 -11.855 1.00 0.00 O ATOM 0 H ASP B 95 -5.388 7.014 -9.839 1.00 0.00 H new ATOM 0 HA ASP B 95 -6.230 8.672 -7.655 1.00 0.00 H new ATOM 0 HB2 ASP B 95 -6.146 10.489 -8.940 1.00 0.00 H new ATOM 0 HB3 ASP B 95 -4.957 9.456 -9.709 1.00 0.00 H new ATOM 3626 N LYS B 96 -8.727 9.058 -8.040 1.00 0.00 N ATOM 3627 CA LYS B 96 -10.201 9.059 -7.889 1.00 0.00 C ATOM 3628 C LYS B 96 -11.000 8.803 -9.178 1.00 0.00 C ATOM 3629 O LYS B 96 -12.104 8.270 -9.104 1.00 0.00 O ATOM 3630 CB LYS B 96 -10.652 10.379 -7.251 1.00 0.00 C ATOM 3631 CG LYS B 96 -10.019 10.648 -5.886 1.00 0.00 C ATOM 3632 CD LYS B 96 -10.509 11.938 -5.233 1.00 0.00 C ATOM 3633 CE LYS B 96 -11.971 11.848 -4.825 1.00 0.00 C ATOM 3634 NZ LYS B 96 -12.425 13.057 -4.102 1.00 0.00 N1+ ATOM 0 H LYS B 96 -8.286 9.808 -7.508 1.00 0.00 H new ATOM 0 HA LYS B 96 -10.424 8.208 -7.246 1.00 0.00 H new ATOM 0 HB2 LYS B 96 -10.406 11.200 -7.924 1.00 0.00 H new ATOM 0 HB3 LYS B 96 -11.737 10.369 -7.143 1.00 0.00 H new ATOM 0 HG2 LYS B 96 -10.234 9.810 -5.223 1.00 0.00 H new ATOM 0 HG3 LYS B 96 -8.936 10.696 -5.999 1.00 0.00 H new ATOM 0 HD2 LYS B 96 -9.900 12.154 -4.355 1.00 0.00 H new ATOM 0 HD3 LYS B 96 -10.376 12.769 -5.926 1.00 0.00 H new ATOM 0 HE2 LYS B 96 -12.586 11.706 -5.713 1.00 0.00 H new ATOM 0 HE3 LYS B 96 -12.117 10.972 -4.193 1.00 0.00 H new ATOM 0 HZ1 LYS B 96 -13.464 13.062 -4.052 1.00 0.00 H new ATOM 0 HZ2 LYS B 96 -12.032 13.054 -3.139 1.00 0.00 H new ATOM 0 HZ3 LYS B 96 -12.099 13.906 -4.606 1.00 0.00 H new ATOM 3648 N LYS B 97 -10.458 9.143 -10.343 1.00 0.00 N ATOM 3649 CA LYS B 97 -11.195 8.930 -11.597 1.00 0.00 C ATOM 3650 C LYS B 97 -11.328 7.449 -11.924 1.00 0.00 C ATOM 3651 O LYS B 97 -12.193 7.053 -12.699 1.00 0.00 O ATOM 3652 CB LYS B 97 -10.551 9.634 -12.780 1.00 0.00 C ATOM 3653 CG LYS B 97 -9.249 9.017 -13.291 1.00 0.00 C ATOM 3654 CD LYS B 97 -8.777 9.689 -14.579 1.00 0.00 C ATOM 3655 CE LYS B 97 -8.493 11.170 -14.386 1.00 0.00 C ATOM 3656 NZ LYS B 97 -7.389 11.403 -13.446 1.00 0.00 N1+ ATOM 0 H LYS B 97 -9.533 9.558 -10.452 1.00 0.00 H new ATOM 0 HA LYS B 97 -12.183 9.360 -11.432 1.00 0.00 H new ATOM 0 HB2 LYS B 97 -11.268 9.655 -13.601 1.00 0.00 H new ATOM 0 HB3 LYS B 97 -10.356 10.669 -12.501 1.00 0.00 H new ATOM 0 HG2 LYS B 97 -8.477 9.110 -12.527 1.00 0.00 H new ATOM 0 HG3 LYS B 97 -9.395 7.951 -13.468 1.00 0.00 H new ATOM 0 HD2 LYS B 97 -7.875 9.192 -14.936 1.00 0.00 H new ATOM 0 HD3 LYS B 97 -9.537 9.564 -15.351 1.00 0.00 H new ATOM 0 HE2 LYS B 97 -8.250 11.621 -15.348 1.00 0.00 H new ATOM 0 HE3 LYS B 97 -9.392 11.666 -14.019 1.00 0.00 H new ATOM 0 HZ1 LYS B 97 -7.050 12.381 -13.545 1.00 0.00 H new ATOM 0 HZ2 LYS B 97 -7.723 11.249 -12.473 1.00 0.00 H new ATOM 0 HZ3 LYS B 97 -6.611 10.744 -13.654 1.00 0.00 H new ATOM 3670 N ARG B 98 -10.448 6.659 -11.359 1.00 0.00 N ATOM 3671 CA ARG B 98 -10.441 5.209 -11.566 1.00 0.00 C ATOM 3672 C ARG B 98 -11.649 4.575 -10.880 1.00 0.00 C ATOM 3673 O ARG B 98 -12.210 3.598 -11.370 1.00 0.00 O ATOM 3674 CB ARG B 98 -9.163 4.586 -11.005 1.00 0.00 C ATOM 3675 CG ARG B 98 -7.860 5.099 -11.609 1.00 0.00 C ATOM 3676 CD ARG B 98 -7.713 4.746 -13.070 1.00 0.00 C ATOM 3677 NE ARG B 98 -6.365 5.042 -13.540 1.00 0.00 N ATOM 3678 CZ ARG B 98 -5.892 4.767 -14.753 1.00 0.00 C ATOM 3679 NH1 ARG B 98 -6.607 4.081 -15.628 1.00 0.00 N1+ ATOM 3680 NH2 ARG B 98 -4.668 5.121 -15.066 1.00 0.00 N ATOM 0 H ARG B 98 -9.710 6.992 -10.739 1.00 0.00 H new ATOM 0 HA ARG B 98 -10.486 5.022 -12.639 1.00 0.00 H new ATOM 0 HB2 ARG B 98 -9.137 4.760 -9.929 1.00 0.00 H new ATOM 0 HB3 ARG B 98 -9.211 3.507 -11.152 1.00 0.00 H new ATOM 0 HG2 ARG B 98 -7.814 6.182 -11.495 1.00 0.00 H new ATOM 0 HG3 ARG B 98 -7.019 4.684 -11.053 1.00 0.00 H new ATOM 0 HD2 ARG B 98 -7.930 3.688 -13.217 1.00 0.00 H new ATOM 0 HD3 ARG B 98 -8.440 5.306 -13.659 1.00 0.00 H new ATOM 0 HE ARG B 98 -5.731 5.498 -12.884 1.00 0.00 H new ATOM 0 HH11 ARG B 98 -7.540 3.752 -15.378 1.00 0.00 H new ATOM 0 HH12 ARG B 98 -6.226 3.881 -16.553 1.00 0.00 H new ATOM 0 HH21 ARG B 98 -4.086 5.604 -14.381 1.00 0.00 H new ATOM 0 HH22 ARG B 98 -4.299 4.914 -15.994 1.00 0.00 H new ATOM 3694 N LEU B 99 -12.006 5.136 -9.739 1.00 0.00 N ATOM 3695 CA LEU B 99 -13.151 4.722 -8.953 1.00 0.00 C ATOM 3696 C LEU B 99 -14.424 5.087 -9.641 1.00 0.00 C ATOM 3697 O LEU B 99 -14.736 6.257 -9.851 1.00 0.00 O ATOM 3698 CB LEU B 99 -13.080 5.320 -7.550 1.00 0.00 C ATOM 3699 CG LEU B 99 -12.110 4.636 -6.582 1.00 0.00 C ATOM 3700 CD1 LEU B 99 -10.624 4.786 -6.915 1.00 0.00 C ATOM 3701 CD2 LEU B 99 -12.427 4.996 -5.160 1.00 0.00 C ATOM 0 H LEU B 99 -11.493 5.913 -9.323 1.00 0.00 H new ATOM 0 HA LEU B 99 -13.132 3.637 -8.854 1.00 0.00 H new ATOM 0 HB2 LEU B 99 -12.798 6.369 -7.637 1.00 0.00 H new ATOM 0 HB3 LEU B 99 -14.078 5.294 -7.113 1.00 0.00 H new ATOM 0 HG LEU B 99 -12.282 3.568 -6.715 1.00 0.00 H new ATOM 0 HD11 LEU B 99 -10.029 4.264 -6.166 1.00 0.00 H new ATOM 0 HD12 LEU B 99 -10.426 4.358 -7.898 1.00 0.00 H new ATOM 0 HD13 LEU B 99 -10.357 5.843 -6.919 1.00 0.00 H new ATOM 0 HD21 LEU B 99 -11.724 4.497 -4.493 1.00 0.00 H new ATOM 0 HD22 LEU B 99 -12.346 6.075 -5.031 1.00 0.00 H new ATOM 0 HD23 LEU B 99 -13.442 4.677 -4.921 1.00 0.00 H new ATOM 3713 N LYS B 100 -15.128 4.075 -10.016 1.00 0.00 N ATOM 3714 CA LYS B 100 -16.330 4.207 -10.787 1.00 0.00 C ATOM 3715 C LYS B 100 -17.599 4.227 -9.959 1.00 0.00 C ATOM 3716 O LYS B 100 -18.280 5.250 -9.880 1.00 0.00 O ATOM 3717 CB LYS B 100 -16.400 3.093 -11.820 1.00 0.00 C ATOM 3718 CG LYS B 100 -15.412 3.260 -12.957 1.00 0.00 C ATOM 3719 CD LYS B 100 -15.525 2.141 -13.975 1.00 0.00 C ATOM 3720 CE LYS B 100 -14.670 2.429 -15.201 1.00 0.00 C ATOM 3721 NZ LYS B 100 -15.092 3.675 -15.881 1.00 0.00 N1+ ATOM 0 H LYS B 100 -14.885 3.110 -9.794 1.00 0.00 H new ATOM 0 HA LYS B 100 -16.276 5.181 -11.273 1.00 0.00 H new ATOM 0 HB2 LYS B 100 -16.216 2.139 -11.327 1.00 0.00 H new ATOM 0 HB3 LYS B 100 -17.409 3.051 -12.229 1.00 0.00 H new ATOM 0 HG2 LYS B 100 -15.584 4.217 -13.449 1.00 0.00 H new ATOM 0 HG3 LYS B 100 -14.399 3.285 -12.556 1.00 0.00 H new ATOM 0 HD2 LYS B 100 -15.212 1.200 -13.522 1.00 0.00 H new ATOM 0 HD3 LYS B 100 -16.566 2.020 -14.274 1.00 0.00 H new ATOM 0 HE2 LYS B 100 -13.624 2.512 -14.904 1.00 0.00 H new ATOM 0 HE3 LYS B 100 -14.738 1.593 -15.897 1.00 0.00 H new ATOM 0 HZ1 LYS B 100 -14.772 3.656 -16.870 1.00 0.00 H new ATOM 0 HZ2 LYS B 100 -16.129 3.751 -15.854 1.00 0.00 H new ATOM 0 HZ3 LYS B 100 -14.672 4.494 -15.397 1.00 0.00 H new ATOM 3735 N GLU B 101 -17.895 3.128 -9.316 1.00 0.00 N ATOM 3736 CA GLU B 101 -19.157 2.952 -8.685 1.00 0.00 C ATOM 3737 C GLU B 101 -19.083 1.958 -7.545 1.00 0.00 C ATOM 3738 O GLU B 101 -18.353 0.959 -7.598 1.00 0.00 O ATOM 3739 CB GLU B 101 -20.217 2.568 -9.726 1.00 0.00 C ATOM 3740 CG GLU B 101 -19.886 1.333 -10.549 1.00 0.00 C ATOM 3741 CD GLU B 101 -20.822 1.151 -11.708 1.00 0.00 C ATOM 3742 OE1 GLU B 101 -21.880 0.523 -11.549 1.00 0.00 O ATOM 3743 OE2 GLU B 101 -20.521 1.650 -12.812 1.00 0.00 O1- ATOM 0 H GLU B 101 -17.261 2.335 -9.220 1.00 0.00 H new ATOM 0 HA GLU B 101 -19.455 3.900 -8.238 1.00 0.00 H new ATOM 0 HB2 GLU B 101 -21.165 2.403 -9.214 1.00 0.00 H new ATOM 0 HB3 GLU B 101 -20.363 3.410 -10.403 1.00 0.00 H new ATOM 0 HG2 GLU B 101 -18.864 1.410 -10.919 1.00 0.00 H new ATOM 0 HG3 GLU B 101 -19.928 0.451 -9.909 1.00 0.00 H new ATOM 3750 N LYS B 102 -19.777 2.325 -6.521 1.00 0.00 N ATOM 3751 CA LYS B 102 -19.926 1.628 -5.256 1.00 0.00 C ATOM 3752 C LYS B 102 -20.630 0.297 -5.431 1.00 0.00 C ATOM 3753 O LYS B 102 -21.755 0.241 -5.935 1.00 0.00 O ATOM 3754 CB LYS B 102 -20.750 2.498 -4.281 1.00 0.00 C ATOM 3755 CG LYS B 102 -20.764 1.972 -2.844 1.00 0.00 C ATOM 3756 CD LYS B 102 -21.736 2.742 -1.940 1.00 0.00 C ATOM 3757 CE LYS B 102 -21.400 4.235 -1.792 1.00 0.00 C ATOM 3758 NZ LYS B 102 -20.074 4.475 -1.175 1.00 0.00 N1+ ATOM 0 H LYS B 102 -20.308 3.196 -6.534 1.00 0.00 H new ATOM 0 HA LYS B 102 -18.928 1.444 -4.859 1.00 0.00 H new ATOM 0 HB2 LYS B 102 -20.347 3.511 -4.283 1.00 0.00 H new ATOM 0 HB3 LYS B 102 -21.776 2.562 -4.644 1.00 0.00 H new ATOM 0 HG2 LYS B 102 -21.039 0.917 -2.850 1.00 0.00 H new ATOM 0 HG3 LYS B 102 -19.759 2.037 -2.428 1.00 0.00 H new ATOM 0 HD2 LYS B 102 -22.745 2.645 -2.342 1.00 0.00 H new ATOM 0 HD3 LYS B 102 -21.741 2.281 -0.952 1.00 0.00 H new ATOM 0 HE2 LYS B 102 -21.427 4.706 -2.774 1.00 0.00 H new ATOM 0 HE3 LYS B 102 -22.168 4.716 -1.186 1.00 0.00 H new ATOM 0 HZ1 LYS B 102 -20.146 5.254 -0.489 1.00 0.00 H new ATOM 0 HZ2 LYS B 102 -19.757 3.613 -0.688 1.00 0.00 H new ATOM 0 HZ3 LYS B 102 -19.388 4.727 -1.914 1.00 0.00 H new ATOM 3772 N LEU B 103 -19.970 -0.760 -5.043 1.00 0.00 N ATOM 3773 CA LEU B 103 -20.576 -2.080 -5.030 1.00 0.00 C ATOM 3774 C LEU B 103 -21.157 -2.295 -3.696 1.00 0.00 C ATOM 3775 O LEU B 103 -22.362 -2.418 -3.517 1.00 0.00 O ATOM 3776 CB LEU B 103 -19.527 -3.172 -5.144 1.00 0.00 C ATOM 3777 CG LEU B 103 -18.855 -3.457 -6.411 1.00 0.00 C ATOM 3778 CD1 LEU B 103 -19.885 -3.831 -7.399 1.00 0.00 C ATOM 3779 CD2 LEU B 103 -18.034 -2.294 -6.870 1.00 0.00 C ATOM 0 H LEU B 103 -19.001 -0.740 -4.727 1.00 0.00 H new ATOM 0 HA LEU B 103 -21.289 -2.123 -5.853 1.00 0.00 H new ATOM 0 HB2 LEU B 103 -18.748 -2.940 -4.418 1.00 0.00 H new ATOM 0 HB3 LEU B 103 -19.999 -4.100 -4.820 1.00 0.00 H new ATOM 0 HG LEU B 103 -18.155 -4.283 -6.285 1.00 0.00 H new ATOM 0 HD11 LEU B 103 -19.410 -4.049 -8.355 1.00 0.00 H new ATOM 0 HD12 LEU B 103 -20.420 -4.714 -7.050 1.00 0.00 H new ATOM 0 HD13 LEU B 103 -20.587 -3.006 -7.523 1.00 0.00 H new ATOM 0 HD21 LEU B 103 -17.549 -2.541 -7.814 1.00 0.00 H new ATOM 0 HD22 LEU B 103 -18.679 -1.426 -7.009 1.00 0.00 H new ATOM 0 HD23 LEU B 103 -17.275 -2.066 -6.121 1.00 0.00 H new ATOM 3791 N THR B 104 -20.277 -2.298 -2.748 1.00 0.00 N ATOM 3792 CA THR B 104 -20.662 -2.620 -1.414 1.00 0.00 C ATOM 3793 C THR B 104 -19.798 -1.884 -0.376 1.00 0.00 C ATOM 3794 O THR B 104 -19.206 -0.840 -0.669 1.00 0.00 O ATOM 3795 CB THR B 104 -20.652 -4.186 -1.201 1.00 0.00 C ATOM 3796 OG1 THR B 104 -21.336 -4.547 0.009 1.00 0.00 O ATOM 3797 CG2 THR B 104 -19.244 -4.759 -1.138 1.00 0.00 C ATOM 0 H THR B 104 -19.288 -2.081 -2.873 1.00 0.00 H new ATOM 0 HA THR B 104 -21.683 -2.271 -1.260 1.00 0.00 H new ATOM 0 HB THR B 104 -21.164 -4.605 -2.067 1.00 0.00 H new ATOM 0 HG1 THR B 104 -21.153 -5.486 0.220 1.00 0.00 H new ATOM 0 HG21 THR B 104 -19.296 -5.838 -0.991 1.00 0.00 H new ATOM 0 HG22 THR B 104 -18.722 -4.545 -2.071 1.00 0.00 H new ATOM 0 HG23 THR B 104 -18.703 -4.305 -0.307 1.00 0.00 H new ATOM 3805 N TYR B 105 -19.741 -2.458 0.798 1.00 0.00 N ATOM 3806 CA TYR B 105 -19.176 -1.890 1.985 1.00 0.00 C ATOM 3807 C TYR B 105 -18.889 -2.971 2.980 1.00 0.00 C ATOM 3808 O TYR B 105 -19.589 -3.989 3.031 1.00 0.00 O ATOM 3809 CB TYR B 105 -20.040 -0.751 2.582 1.00 0.00 C ATOM 3810 CG TYR B 105 -21.525 -1.017 2.678 1.00 0.00 C ATOM 3811 CD1 TYR B 105 -22.074 -1.723 3.739 1.00 0.00 C ATOM 3812 CD2 TYR B 105 -22.378 -0.531 1.703 1.00 0.00 C ATOM 3813 CE1 TYR B 105 -23.437 -1.942 3.816 1.00 0.00 C ATOM 3814 CE2 TYR B 105 -23.739 -0.740 1.772 1.00 0.00 C ATOM 3815 CZ TYR B 105 -24.264 -1.446 2.831 1.00 0.00 C ATOM 3816 OH TYR B 105 -25.628 -1.653 2.909 1.00 0.00 O ATOM 0 H TYR B 105 -20.113 -3.395 0.955 1.00 0.00 H new ATOM 0 HA TYR B 105 -18.234 -1.415 1.711 1.00 0.00 H new ATOM 0 HB2 TYR B 105 -19.667 -0.527 3.581 1.00 0.00 H new ATOM 0 HB3 TYR B 105 -19.891 0.144 1.978 1.00 0.00 H new ATOM 0 HD1 TYR B 105 -21.428 -2.107 4.515 1.00 0.00 H new ATOM 0 HD2 TYR B 105 -21.969 0.023 0.871 1.00 0.00 H new ATOM 0 HE1 TYR B 105 -23.852 -2.499 4.643 1.00 0.00 H new ATOM 0 HE2 TYR B 105 -24.389 -0.353 1.001 1.00 0.00 H new ATOM 0 HH TYR B 105 -26.066 -1.238 2.137 1.00 0.00 H new ATOM 3826 N LEU B 106 -17.857 -2.788 3.711 1.00 0.00 N ATOM 3827 CA LEU B 106 -17.459 -3.714 4.718 1.00 0.00 C ATOM 3828 C LEU B 106 -17.397 -3.030 6.064 1.00 0.00 C ATOM 3829 O LEU B 106 -17.103 -1.825 6.162 1.00 0.00 O ATOM 3830 CB LEU B 106 -16.125 -4.382 4.375 1.00 0.00 C ATOM 3831 CG LEU B 106 -14.875 -3.502 4.334 1.00 0.00 C ATOM 3832 CD1 LEU B 106 -13.873 -3.994 5.365 1.00 0.00 C ATOM 3833 CD2 LEU B 106 -14.242 -3.516 2.945 1.00 0.00 C ATOM 0 H LEU B 106 -17.247 -1.975 3.630 1.00 0.00 H new ATOM 0 HA LEU B 106 -18.209 -4.503 4.766 1.00 0.00 H new ATOM 0 HB2 LEU B 106 -15.952 -5.176 5.102 1.00 0.00 H new ATOM 0 HB3 LEU B 106 -16.230 -4.859 3.401 1.00 0.00 H new ATOM 0 HG LEU B 106 -15.165 -2.477 4.565 1.00 0.00 H new ATOM 0 HD11 LEU B 106 -12.982 -3.366 5.335 1.00 0.00 H new ATOM 0 HD12 LEU B 106 -14.319 -3.944 6.358 1.00 0.00 H new ATOM 0 HD13 LEU B 106 -13.598 -5.025 5.142 1.00 0.00 H new ATOM 0 HD21 LEU B 106 -13.355 -2.882 2.943 1.00 0.00 H new ATOM 0 HD22 LEU B 106 -13.960 -4.536 2.684 1.00 0.00 H new ATOM 0 HD23 LEU B 106 -14.958 -3.140 2.215 1.00 0.00 H new ATOM 3845 N SER B 107 -17.670 -3.785 7.078 1.00 0.00 N ATOM 3846 CA SER B 107 -17.722 -3.297 8.431 1.00 0.00 C ATOM 3847 C SER B 107 -16.323 -3.190 9.093 1.00 0.00 C ATOM 3848 O SER B 107 -15.362 -3.855 8.676 1.00 0.00 O ATOM 3849 CB SER B 107 -18.648 -4.221 9.202 1.00 0.00 C ATOM 3850 OG SER B 107 -18.414 -5.572 8.817 1.00 0.00 O ATOM 0 H SER B 107 -17.869 -4.782 6.994 1.00 0.00 H new ATOM 0 HA SER B 107 -18.103 -2.276 8.438 1.00 0.00 H new ATOM 0 HB2 SER B 107 -18.483 -4.105 10.273 1.00 0.00 H new ATOM 0 HB3 SER B 107 -19.687 -3.953 9.009 1.00 0.00 H new ATOM 0 HG SER B 107 -19.013 -6.164 9.319 1.00 0.00 H new ATOM 3856 N ASP B 108 -16.235 -2.356 10.128 1.00 0.00 N ATOM 3857 CA ASP B 108 -14.989 -2.098 10.904 1.00 0.00 C ATOM 3858 C ASP B 108 -14.407 -3.379 11.495 1.00 0.00 C ATOM 3859 O ASP B 108 -13.203 -3.628 11.444 1.00 0.00 O ATOM 3860 CB ASP B 108 -15.278 -1.098 12.027 1.00 0.00 C ATOM 3861 CG ASP B 108 -14.121 -0.934 12.983 1.00 0.00 C ATOM 3862 OD1 ASP B 108 -13.063 -0.405 12.587 1.00 0.00 O ATOM 3863 OD2 ASP B 108 -14.268 -1.299 14.166 1.00 0.00 O1- ATOM 0 H ASP B 108 -17.035 -1.823 10.470 1.00 0.00 H new ATOM 0 HA ASP B 108 -14.251 -1.686 10.216 1.00 0.00 H new ATOM 0 HB2 ASP B 108 -15.521 -0.130 11.590 1.00 0.00 H new ATOM 0 HB3 ASP B 108 -16.157 -1.427 12.582 1.00 0.00 H new ATOM 3868 N ASP B 109 -15.280 -4.186 12.010 1.00 0.00 N ATOM 3869 CA ASP B 109 -14.966 -5.504 12.586 1.00 0.00 C ATOM 3870 C ASP B 109 -14.468 -6.472 11.519 1.00 0.00 C ATOM 3871 O ASP B 109 -14.082 -7.543 11.822 1.00 0.00 O ATOM 3872 CB ASP B 109 -16.151 -6.064 13.380 1.00 0.00 C ATOM 3873 CG ASP B 109 -15.872 -7.406 14.043 1.00 0.00 C ATOM 3874 OD1 ASP B 109 -15.135 -7.435 15.059 1.00 0.00 O1- ATOM 3875 OD2 ASP B 109 -16.376 -8.451 13.549 1.00 0.00 O ATOM 0 H ASP B 109 -16.274 -3.959 12.054 1.00 0.00 H new ATOM 0 HA ASP B 109 -14.149 -5.374 13.296 1.00 0.00 H new ATOM 0 HB2 ASP B 109 -16.435 -5.343 14.147 1.00 0.00 H new ATOM 0 HB3 ASP B 109 -17.005 -6.171 12.712 1.00 0.00 H new ATOM 3880 N LYS B 110 -14.683 -6.178 10.278 1.00 0.00 N ATOM 3881 CA LYS B 110 -14.046 -6.922 9.222 1.00 0.00 C ATOM 3882 C LYS B 110 -12.736 -6.271 8.866 1.00 0.00 C ATOM 3883 O LYS B 110 -11.741 -6.936 8.544 1.00 0.00 O ATOM 3884 CB LYS B 110 -14.953 -7.132 8.028 1.00 0.00 C ATOM 3885 CG LYS B 110 -16.131 -7.999 8.385 1.00 0.00 C ATOM 3886 CD LYS B 110 -16.940 -8.400 7.188 1.00 0.00 C ATOM 3887 CE LYS B 110 -18.033 -9.367 7.599 1.00 0.00 C ATOM 3888 NZ LYS B 110 -17.487 -10.560 8.290 1.00 0.00 N1+ ATOM 0 H LYS B 110 -15.296 -5.426 9.962 1.00 0.00 H new ATOM 0 HA LYS B 110 -13.833 -7.928 9.584 1.00 0.00 H new ATOM 0 HB2 LYS B 110 -15.306 -6.168 7.662 1.00 0.00 H new ATOM 0 HB3 LYS B 110 -14.390 -7.595 7.217 1.00 0.00 H new ATOM 0 HG2 LYS B 110 -15.776 -8.895 8.895 1.00 0.00 H new ATOM 0 HG3 LYS B 110 -16.770 -7.464 9.088 1.00 0.00 H new ATOM 0 HD2 LYS B 110 -17.380 -7.517 6.724 1.00 0.00 H new ATOM 0 HD3 LYS B 110 -16.295 -8.864 6.442 1.00 0.00 H new ATOM 0 HE2 LYS B 110 -18.739 -8.859 8.256 1.00 0.00 H new ATOM 0 HE3 LYS B 110 -18.589 -9.682 6.716 1.00 0.00 H new ATOM 0 HZ1 LYS B 110 -18.259 -11.227 8.494 1.00 0.00 H new ATOM 0 HZ2 LYS B 110 -16.782 -11.022 7.681 1.00 0.00 H new ATOM 0 HZ3 LYS B 110 -17.037 -10.269 9.181 1.00 0.00 H new ATOM 3902 N MET B 111 -12.715 -4.963 8.972 1.00 0.00 N ATOM 3903 CA MET B 111 -11.583 -4.191 8.656 1.00 0.00 C ATOM 3904 C MET B 111 -10.365 -4.390 9.518 1.00 0.00 C ATOM 3905 O MET B 111 -9.239 -4.194 9.075 1.00 0.00 O ATOM 3906 CB MET B 111 -11.947 -2.778 8.390 1.00 0.00 C ATOM 3907 CG MET B 111 -10.798 -1.886 8.095 1.00 0.00 C ATOM 3908 SD MET B 111 -11.306 -0.332 7.384 1.00 0.00 S ATOM 3909 CE MET B 111 -12.107 -0.953 5.935 1.00 0.00 C ATOM 0 H MET B 111 -13.513 -4.413 9.289 1.00 0.00 H new ATOM 0 HA MET B 111 -11.216 -4.604 7.716 1.00 0.00 H new ATOM 0 HB2 MET B 111 -12.638 -2.748 7.548 1.00 0.00 H new ATOM 0 HB3 MET B 111 -12.481 -2.386 9.255 1.00 0.00 H new ATOM 0 HG2 MET B 111 -10.243 -1.697 9.014 1.00 0.00 H new ATOM 0 HG3 MET B 111 -10.117 -2.390 7.409 1.00 0.00 H new ATOM 0 HE1 MET B 111 -12.180 -0.159 5.191 1.00 0.00 H new ATOM 0 HE2 MET B 111 -11.528 -1.781 5.526 1.00 0.00 H new ATOM 0 HE3 MET B 111 -13.107 -1.302 6.193 1.00 0.00 H new ATOM 3919 N LYS B 112 -10.580 -4.811 10.673 1.00 0.00 N ATOM 3920 CA LYS B 112 -9.544 -5.162 11.558 1.00 0.00 C ATOM 3921 C LYS B 112 -8.644 -6.255 11.021 1.00 0.00 C ATOM 3922 O LYS B 112 -7.633 -6.518 11.596 1.00 0.00 O ATOM 3923 CB LYS B 112 -10.043 -5.477 12.970 1.00 0.00 C ATOM 3924 CG LYS B 112 -11.358 -6.164 13.218 1.00 0.00 C ATOM 3925 CD LYS B 112 -11.358 -7.660 12.894 1.00 0.00 C ATOM 3926 CE LYS B 112 -11.385 -7.955 11.399 1.00 0.00 C ATOM 3927 NZ LYS B 112 -12.049 -9.274 11.107 1.00 0.00 N1+ ATOM 0 H LYS B 112 -11.515 -4.932 11.062 1.00 0.00 H new ATOM 0 HA LYS B 112 -8.927 -4.267 11.638 1.00 0.00 H new ATOM 0 HB2 LYS B 112 -9.275 -6.088 13.445 1.00 0.00 H new ATOM 0 HB3 LYS B 112 -10.077 -4.530 13.509 1.00 0.00 H new ATOM 0 HG2 LYS B 112 -11.633 -6.031 14.264 1.00 0.00 H new ATOM 0 HG3 LYS B 112 -12.128 -5.675 12.622 1.00 0.00 H new ATOM 0 HD2 LYS B 112 -10.471 -8.119 13.332 1.00 0.00 H new ATOM 0 HD3 LYS B 112 -12.224 -8.126 13.365 1.00 0.00 H new ATOM 0 HE2 LYS B 112 -11.915 -7.157 10.879 1.00 0.00 H new ATOM 0 HE3 LYS B 112 -10.366 -7.966 11.011 1.00 0.00 H new ATOM 0 HZ1 LYS B 112 -12.050 -9.443 10.081 1.00 0.00 H new ATOM 0 HZ2 LYS B 112 -11.528 -10.038 11.583 1.00 0.00 H new ATOM 0 HZ3 LYS B 112 -13.029 -9.254 11.455 1.00 0.00 H new ATOM 3941 N GLU B 113 -9.049 -6.953 9.960 1.00 0.00 N ATOM 3942 CA GLU B 113 -8.139 -7.859 9.352 1.00 0.00 C ATOM 3943 C GLU B 113 -7.401 -7.087 8.403 1.00 0.00 C ATOM 3944 O GLU B 113 -6.246 -6.971 8.491 1.00 0.00 O ATOM 3945 CB GLU B 113 -8.776 -9.016 8.659 1.00 0.00 C ATOM 3946 CG GLU B 113 -9.517 -9.927 9.551 1.00 0.00 C ATOM 3947 CD GLU B 113 -10.094 -11.123 8.849 1.00 0.00 C ATOM 3948 OE1 GLU B 113 -9.367 -12.084 8.566 1.00 0.00 O1- ATOM 3949 OE2 GLU B 113 -11.299 -11.109 8.587 1.00 0.00 O ATOM 0 H GLU B 113 -9.973 -6.897 9.532 1.00 0.00 H new ATOM 0 HA GLU B 113 -7.525 -8.307 10.133 1.00 0.00 H new ATOM 0 HB2 GLU B 113 -9.458 -8.637 7.898 1.00 0.00 H new ATOM 0 HB3 GLU B 113 -8.003 -9.584 8.140 1.00 0.00 H new ATOM 0 HG2 GLU B 113 -8.850 -10.268 10.343 1.00 0.00 H new ATOM 0 HG3 GLU B 113 -10.324 -9.374 10.031 1.00 0.00 H new ATOM 3956 N VAL B 114 -8.154 -6.460 7.571 1.00 0.00 N ATOM 3957 CA VAL B 114 -7.689 -5.670 6.493 1.00 0.00 C ATOM 3958 C VAL B 114 -6.544 -4.667 6.885 1.00 0.00 C ATOM 3959 O VAL B 114 -5.483 -4.701 6.277 1.00 0.00 O ATOM 3960 CB VAL B 114 -8.917 -5.005 5.828 1.00 0.00 C ATOM 3961 CG1 VAL B 114 -8.583 -3.690 5.247 1.00 0.00 C ATOM 3962 CG2 VAL B 114 -9.501 -5.932 4.766 1.00 0.00 C ATOM 0 H VAL B 114 -9.172 -6.488 7.631 1.00 0.00 H new ATOM 0 HA VAL B 114 -7.194 -6.310 5.763 1.00 0.00 H new ATOM 0 HB VAL B 114 -9.665 -4.833 6.602 1.00 0.00 H new ATOM 0 HG11 VAL B 114 -9.473 -3.257 4.790 1.00 0.00 H new ATOM 0 HG12 VAL B 114 -8.219 -3.027 6.032 1.00 0.00 H new ATOM 0 HG13 VAL B 114 -7.809 -3.813 4.489 1.00 0.00 H new ATOM 0 HG21 VAL B 114 -10.365 -5.456 4.303 1.00 0.00 H new ATOM 0 HG22 VAL B 114 -8.747 -6.134 4.005 1.00 0.00 H new ATOM 0 HG23 VAL B 114 -9.808 -6.869 5.230 1.00 0.00 H new ATOM 3972 N ASP B 115 -6.742 -3.844 7.915 1.00 0.00 N ATOM 3973 CA ASP B 115 -5.662 -2.893 8.364 1.00 0.00 C ATOM 3974 C ASP B 115 -4.442 -3.650 8.881 1.00 0.00 C ATOM 3975 O ASP B 115 -3.300 -3.421 8.506 1.00 0.00 O ATOM 3976 CB ASP B 115 -6.136 -2.032 9.544 1.00 0.00 C ATOM 3977 CG ASP B 115 -7.137 -0.956 9.232 1.00 0.00 C ATOM 3978 OD1 ASP B 115 -6.759 0.087 8.679 1.00 0.00 O ATOM 3979 OD2 ASP B 115 -8.301 -1.104 9.637 1.00 0.00 O1- ATOM 0 H ASP B 115 -7.605 -3.797 8.456 1.00 0.00 H new ATOM 0 HA ASP B 115 -5.419 -2.284 7.493 1.00 0.00 H new ATOM 0 HB2 ASP B 115 -6.569 -2.692 10.295 1.00 0.00 H new ATOM 0 HB3 ASP B 115 -5.262 -1.564 9.997 1.00 0.00 H new ATOM 3984 N ASN B 116 -4.737 -4.564 9.709 1.00 0.00 N ATOM 3985 CA ASN B 116 -3.823 -5.326 10.507 1.00 0.00 C ATOM 3986 C ASN B 116 -3.027 -6.329 9.693 1.00 0.00 C ATOM 3987 O ASN B 116 -1.830 -6.499 9.920 1.00 0.00 O ATOM 3988 CB ASN B 116 -4.773 -5.948 11.396 1.00 0.00 C ATOM 3989 CG ASN B 116 -4.425 -7.094 12.215 1.00 0.00 C ATOM 3990 OD1 ASN B 116 -3.321 -7.298 12.725 1.00 0.00 O ATOM 3991 ND2 ASN B 116 -5.413 -7.890 12.245 1.00 0.00 N ATOM 0 H ASN B 116 -5.706 -4.837 9.874 1.00 0.00 H new ATOM 0 HA ASN B 116 -3.034 -4.753 10.994 1.00 0.00 H new ATOM 0 HB2 ASN B 116 -5.123 -5.171 12.076 1.00 0.00 H new ATOM 0 HB3 ASN B 116 -5.626 -6.245 10.786 1.00 0.00 H new ATOM 0 HD21 ASN B 116 -5.330 -8.788 12.722 1.00 0.00 H new ATOM 0 HD22 ASN B 116 -6.290 -7.632 11.792 1.00 0.00 H new ATOM 3998 N ALA B 117 -3.687 -6.949 8.737 1.00 0.00 N ATOM 3999 CA ALA B 117 -3.094 -7.905 7.823 1.00 0.00 C ATOM 4000 C ALA B 117 -2.049 -7.216 7.033 1.00 0.00 C ATOM 4001 O ALA B 117 -0.967 -7.731 6.798 1.00 0.00 O ATOM 4002 CB ALA B 117 -4.148 -8.433 6.863 1.00 0.00 C ATOM 0 H ALA B 117 -4.682 -6.797 8.569 1.00 0.00 H new ATOM 0 HA ALA B 117 -2.672 -8.733 8.392 1.00 0.00 H new ATOM 0 HB1 ALA B 117 -3.692 -9.150 6.181 1.00 0.00 H new ATOM 0 HB2 ALA B 117 -4.942 -8.923 7.427 1.00 0.00 H new ATOM 0 HB3 ALA B 117 -4.567 -7.605 6.292 1.00 0.00 H new ATOM 4008 N LEU B 118 -2.365 -5.998 6.705 1.00 0.00 N ATOM 4009 CA LEU B 118 -1.599 -5.183 5.920 1.00 0.00 C ATOM 4010 C LEU B 118 -0.327 -4.788 6.674 1.00 0.00 C ATOM 4011 O LEU B 118 0.733 -4.713 6.091 1.00 0.00 O ATOM 4012 CB LEU B 118 -2.462 -4.000 5.606 1.00 0.00 C ATOM 4013 CG LEU B 118 -1.909 -2.990 4.701 1.00 0.00 C ATOM 4014 CD1 LEU B 118 -2.369 -3.248 3.274 1.00 0.00 C ATOM 4015 CD2 LEU B 118 -2.290 -1.627 5.170 1.00 0.00 C ATOM 0 H LEU B 118 -3.228 -5.554 7.018 1.00 0.00 H new ATOM 0 HA LEU B 118 -1.271 -5.667 5.000 1.00 0.00 H new ATOM 0 HB2 LEU B 118 -3.394 -4.366 5.175 1.00 0.00 H new ATOM 0 HB3 LEU B 118 -2.717 -3.509 6.545 1.00 0.00 H new ATOM 0 HG LEU B 118 -0.821 -3.054 4.707 1.00 0.00 H new ATOM 0 HD11 LEU B 118 -1.950 -2.489 2.614 1.00 0.00 H new ATOM 0 HD12 LEU B 118 -2.030 -4.234 2.955 1.00 0.00 H new ATOM 0 HD13 LEU B 118 -3.457 -3.206 3.229 1.00 0.00 H new ATOM 0 HD21 LEU B 118 -1.876 -0.880 4.493 1.00 0.00 H new ATOM 0 HD22 LEU B 118 -3.376 -1.539 5.187 1.00 0.00 H new ATOM 0 HD23 LEU B 118 -1.897 -1.464 6.174 1.00 0.00 H new ATOM 4027 N MET B 119 -0.427 -4.581 7.984 1.00 0.00 N ATOM 4028 CA MET B 119 0.714 -4.272 8.782 1.00 0.00 C ATOM 4029 C MET B 119 1.633 -5.468 8.897 1.00 0.00 C ATOM 4030 O MET B 119 2.779 -5.325 9.277 1.00 0.00 O ATOM 4031 CB MET B 119 0.265 -3.901 10.137 1.00 0.00 C ATOM 4032 CG MET B 119 -0.630 -2.690 10.182 1.00 0.00 C ATOM 4033 SD MET B 119 -1.392 -2.471 11.777 1.00 0.00 S ATOM 4034 CE MET B 119 0.057 -2.716 12.755 1.00 0.00 C ATOM 0 H MET B 119 -1.304 -4.627 8.503 1.00 0.00 H new ATOM 0 HA MET B 119 1.254 -3.451 8.309 1.00 0.00 H new ATOM 0 HB2 MET B 119 -0.265 -4.747 10.576 1.00 0.00 H new ATOM 0 HB3 MET B 119 1.140 -3.715 10.759 1.00 0.00 H new ATOM 0 HG2 MET B 119 -0.048 -1.802 9.935 1.00 0.00 H new ATOM 0 HG3 MET B 119 -1.405 -2.785 9.422 1.00 0.00 H new ATOM 0 HE1 MET B 119 -0.088 -2.270 13.739 1.00 0.00 H new ATOM 0 HE2 MET B 119 0.245 -3.784 12.865 1.00 0.00 H new ATOM 0 HE3 MET B 119 0.910 -2.246 12.266 1.00 0.00 H new ATOM 4044 N ILE B 120 1.117 -6.639 8.639 1.00 0.00 N ATOM 4045 CA ILE B 120 1.922 -7.826 8.650 1.00 0.00 C ATOM 4046 C ILE B 120 2.630 -7.932 7.335 1.00 0.00 C ATOM 4047 O ILE B 120 3.848 -7.972 7.299 1.00 0.00 O ATOM 4048 CB ILE B 120 1.083 -9.074 8.811 1.00 0.00 C ATOM 4049 CG1 ILE B 120 0.180 -8.960 10.017 1.00 0.00 C ATOM 4050 CG2 ILE B 120 2.005 -10.265 8.939 1.00 0.00 C ATOM 4051 CD1 ILE B 120 -0.859 -10.021 10.037 1.00 0.00 C ATOM 0 H ILE B 120 0.134 -6.795 8.417 1.00 0.00 H new ATOM 0 HA ILE B 120 2.614 -7.752 9.489 1.00 0.00 H new ATOM 0 HB ILE B 120 0.445 -9.201 7.937 1.00 0.00 H new ATOM 0 HG12 ILE B 120 0.779 -9.022 10.925 1.00 0.00 H new ATOM 0 HG13 ILE B 120 -0.301 -7.982 10.019 1.00 0.00 H new ATOM 0 HG21 ILE B 120 1.413 -11.173 9.056 1.00 0.00 H new ATOM 0 HG22 ILE B 120 2.621 -10.346 8.043 1.00 0.00 H new ATOM 0 HG23 ILE B 120 2.647 -10.136 9.810 1.00 0.00 H new ATOM 0 HD11 ILE B 120 -1.485 -9.900 10.921 1.00 0.00 H new ATOM 0 HD12 ILE B 120 -1.476 -9.943 9.142 1.00 0.00 H new ATOM 0 HD13 ILE B 120 -0.379 -10.999 10.063 1.00 0.00 H new ATOM 4063 N SER B 121 1.847 -7.974 6.260 1.00 0.00 N ATOM 4064 CA SER B 121 2.371 -8.036 4.897 1.00 0.00 C ATOM 4065 C SER B 121 3.405 -6.914 4.637 1.00 0.00 C ATOM 4066 O SER B 121 4.465 -7.126 4.058 1.00 0.00 O ATOM 4067 CB SER B 121 1.208 -7.875 3.955 1.00 0.00 C ATOM 4068 OG SER B 121 0.159 -8.754 4.304 1.00 0.00 O ATOM 0 H SER B 121 0.828 -7.966 6.309 1.00 0.00 H new ATOM 0 HA SER B 121 2.876 -8.990 4.746 1.00 0.00 H new ATOM 0 HB2 SER B 121 0.851 -6.845 3.982 1.00 0.00 H new ATOM 0 HB3 SER B 121 1.531 -8.073 2.933 1.00 0.00 H new ATOM 0 HG SER B 121 -0.467 -8.831 3.554 1.00 0.00 H new ATOM 4074 N LEU B 122 3.083 -5.727 5.067 1.00 0.00 N ATOM 4075 CA LEU B 122 3.947 -4.614 4.921 1.00 0.00 C ATOM 4076 C LEU B 122 4.963 -4.489 6.088 1.00 0.00 C ATOM 4077 O LEU B 122 5.792 -3.613 6.086 1.00 0.00 O ATOM 4078 CB LEU B 122 3.124 -3.346 4.717 1.00 0.00 C ATOM 4079 CG LEU B 122 2.411 -3.173 3.347 1.00 0.00 C ATOM 4080 CD1 LEU B 122 1.365 -4.268 3.017 1.00 0.00 C ATOM 4081 CD2 LEU B 122 1.815 -1.785 3.231 1.00 0.00 C ATOM 0 H LEU B 122 2.201 -5.513 5.533 1.00 0.00 H new ATOM 0 HA LEU B 122 4.558 -4.770 4.032 1.00 0.00 H new ATOM 0 HB2 LEU B 122 2.366 -3.306 5.499 1.00 0.00 H new ATOM 0 HB3 LEU B 122 3.781 -2.489 4.866 1.00 0.00 H new ATOM 0 HG LEU B 122 3.188 -3.298 2.593 1.00 0.00 H new ATOM 0 HD11 LEU B 122 0.920 -4.064 2.043 1.00 0.00 H new ATOM 0 HD12 LEU B 122 1.853 -5.243 2.997 1.00 0.00 H new ATOM 0 HD13 LEU B 122 0.586 -4.268 3.779 1.00 0.00 H new ATOM 0 HD21 LEU B 122 1.320 -1.681 2.266 1.00 0.00 H new ATOM 0 HD22 LEU B 122 1.089 -1.633 4.030 1.00 0.00 H new ATOM 0 HD23 LEU B 122 2.607 -1.041 3.314 1.00 0.00 H new ATOM 4093 N GLY B 123 4.884 -5.384 7.073 1.00 0.00 N ATOM 4094 CA GLY B 123 5.872 -5.446 8.133 1.00 0.00 C ATOM 4095 C GLY B 123 5.895 -4.294 9.106 1.00 0.00 C ATOM 4096 O GLY B 123 6.875 -4.148 9.826 1.00 0.00 O ATOM 0 H GLY B 123 4.139 -6.076 7.153 1.00 0.00 H new ATOM 0 HA2 GLY B 123 5.709 -6.364 8.697 1.00 0.00 H new ATOM 0 HA3 GLY B 123 6.858 -5.524 7.675 1.00 0.00 H new ATOM 4100 N LEU B 124 4.835 -3.493 9.174 1.00 0.00 N ATOM 4101 CA LEU B 124 4.817 -2.408 10.111 1.00 0.00 C ATOM 4102 C LEU B 124 4.744 -2.978 11.468 1.00 0.00 C ATOM 4103 O LEU B 124 5.585 -2.687 12.340 1.00 0.00 O ATOM 4104 CB LEU B 124 3.631 -1.462 9.895 1.00 0.00 C ATOM 4105 CG LEU B 124 3.636 -0.589 8.637 1.00 0.00 C ATOM 4106 CD1 LEU B 124 3.519 -1.371 7.363 1.00 0.00 C ATOM 4107 CD2 LEU B 124 2.560 0.425 8.712 1.00 0.00 C ATOM 0 H LEU B 124 3.999 -3.583 8.597 1.00 0.00 H new ATOM 0 HA LEU B 124 5.724 -1.820 9.970 1.00 0.00 H new ATOM 0 HB2 LEU B 124 2.721 -2.062 9.883 1.00 0.00 H new ATOM 0 HB3 LEU B 124 3.566 -0.803 10.760 1.00 0.00 H new ATOM 0 HG LEU B 124 4.609 -0.099 8.610 1.00 0.00 H new ATOM 0 HD11 LEU B 124 3.529 -0.687 6.514 1.00 0.00 H new ATOM 0 HD12 LEU B 124 4.358 -2.062 7.282 1.00 0.00 H new ATOM 0 HD13 LEU B 124 2.585 -1.933 7.365 1.00 0.00 H new ATOM 0 HD21 LEU B 124 2.575 1.039 7.811 1.00 0.00 H new ATOM 0 HD22 LEU B 124 1.595 -0.074 8.795 1.00 0.00 H new ATOM 0 HD23 LEU B 124 2.717 1.058 9.585 1.00 0.00 H new ATOM 4119 N ASN B 125 3.795 -3.891 11.595 1.00 0.00 N ATOM 4120 CA ASN B 125 3.444 -4.542 12.813 1.00 0.00 C ATOM 4121 C ASN B 125 3.515 -3.545 13.990 1.00 0.00 C ATOM 4122 O ASN B 125 3.022 -2.417 13.879 1.00 0.00 O ATOM 4123 CB ASN B 125 4.352 -5.749 12.984 1.00 0.00 C ATOM 4124 CG ASN B 125 3.679 -6.781 13.790 1.00 0.00 C ATOM 4125 OD1 ASN B 125 3.845 -6.852 15.005 1.00 0.00 O ATOM 4126 ND2 ASN B 125 2.860 -7.547 13.127 1.00 0.00 N ATOM 0 H ASN B 125 3.231 -4.202 10.804 1.00 0.00 H new ATOM 0 HA ASN B 125 2.414 -4.899 12.790 1.00 0.00 H new ATOM 0 HB2 ASN B 125 4.617 -6.155 12.008 1.00 0.00 H new ATOM 0 HB3 ASN B 125 5.282 -5.448 13.467 1.00 0.00 H new ATOM 0 HD21 ASN B 125 2.313 -8.254 13.618 1.00 0.00 H new ATOM 0 HD22 ASN B 125 2.766 -7.440 12.117 1.00 0.00 H new