USER MOD reduce.3.24.130724 H: found=0, std=0, add=1049, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1051 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 71 GLN : amide:sc= 0.699 K(o=7.9,f=6) USER MOD Set 1.2: A 75 THR OG1 : rot 66:sc= 3.02 USER MOD Set 1.3: A 82 MET CE :methyl -171:sc= -0.115 (180deg=-0.391) USER MOD Set 1.4: B 66 GLN : amide:sc= 1.05 K(o=7.9,f=-1.1) USER MOD Set 1.5: B 69 ASN : amide:sc= 1.22 K(o=7.9,f=0.33!) USER MOD Set 1.6: B 71 GLN : amide:sc= 1.29 K(o=7.9,f=-1.3!) USER MOD Set 1.7: B 75 THR OG1 : rot -55:sc= 0.717 USER MOD Set 2.1: B 31 LYS NZ :NH3+ -150:sc= 0.311 (180deg=-0.397!) USER MOD Set 2.2: B 35 LYS NZ :NH3+ -149:sc= 0.471 (180deg=-3!) USER MOD Set 3.1: B 19 TYR OH : rot 34:sc= 2.35 USER MOD Set 3.2: B 40 LYS NZ :NH3+ 159:sc= 1.74 (180deg=-0.94!) USER MOD Set 4.1: B 18 LYS NZ :NH3+ 172:sc= 0.769 (180deg=0.626) USER MOD Set 4.2: B 20 SER OG : rot -117:sc= 1.17 USER MOD Set 5.1: A 17 HIS : no HD1:sc= -1.57 K(o=-0.27,f=-2.8) USER MOD Set 5.2: A 20 SER OG : rot 0:sc= 1.3 USER MOD Single : A 18 LYS NZ :NH3+ -155:sc= 2.37 (180deg=0.996) USER MOD Single : A 19 TYR OH : rot 158:sc= 1.18 USER MOD Single : A 26 LYS NZ :NH3+ -117:sc= 3.18 (180deg=1.72) USER MOD Single : A 27 HIS : no HE2:sc= 0.291 K(o=0.29,f=-2.9!) USER MOD Single : A 28 THR OG1 : rot 177:sc= 1.17 USER MOD Single : A 30 SER OG : rot -17:sc= 1.22 USER MOD Single : A 31 LYS NZ :NH3+ 173:sc= 2.62 (180deg=2.11) USER MOD Single : A 32 LYS NZ :NH3+ 142:sc= 1.28 (180deg=0.199!) USER MOD Single : A 35 LYS NZ :NH3+ 169:sc= 3.38 (180deg=2.74) USER MOD Single : A 39 GLN : amide:sc= -0.0115 X(o=-0.011,f=-0.44) USER MOD Single : A 40 LYS NZ :NH3+ 163:sc= 2.48 (180deg=2.34) USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 63 ASN : amide:sc= -0.0204 X(o=-0.02,f=-0.035) USER MOD Single : A 64 LYS NZ :NH3+ -174:sc= 1.83 (180deg=1.72) USER MOD Single : A 66 GLN : amide:sc= -1.78 K(o=-1.8,f=-9.4!) USER MOD Single : A 69 ASN : amide:sc= 1.92 K(o=1.9,f=-1.3) USER MOD Single : A 73 TYR OH : rot 141:sc= 0.561 USER MOD Single : A 84 TYR OH : rot 126:sc= 1.09 USER MOD Single : A 85 ASN : amide:sc= 1.06 K(o=1.1,f=-0.076) USER MOD Single : B 17 HIS : no HD1:sc= -2.02 K(o=-2,f=-4.3!) USER MOD Single : B 26 LYS NZ :NH3+ -160:sc= 1.25 (180deg=0.931) USER MOD Single : B 27 HIS : no HD1:sc= -0.0912 X(o=-0.091,f=0) USER MOD Single : B 28 THR OG1 : rot 30:sc= 0.514 USER MOD Single : B 30 SER OG : rot 84:sc= 1.23 USER MOD Single : B 32 LYS NZ :NH3+ -141:sc= 1.81 (180deg=-2.43!) USER MOD Single : B 39 GLN : amide:sc= 0.129 X(o=0.13,f=-0.31) USER MOD Single : B 43 THR OG1 : rot -96:sc= 0.151 USER MOD Single : B 63 ASN : amide:sc= 0.583 K(o=0.58,f=-0.53) USER MOD Single : B 64 LYS NZ :NH3+ 161:sc= 1.2 (180deg=0.0562) USER MOD Single : B 73 TYR OH : rot 135:sc= 0.897 USER MOD Single : B 82 MET CE :methyl -156:sc= -0.0728 (180deg=-0.738) USER MOD Single : B 84 TYR OH : rot 43:sc= 1.24 USER MOD Single : B 85 ASN : amide:sc= 0.439 X(o=0.44,f=0) USER MOD ----------------------------------------------------------------- ATOM 113 N ILE A 9 -1.550 -3.971 -6.084 1.00 0.00 N ATOM 114 CA ILE A 9 -1.084 -2.830 -5.308 1.00 0.00 C ATOM 115 C ILE A 9 -0.020 -3.289 -4.305 1.00 0.00 C ATOM 116 O ILE A 9 1.056 -2.703 -4.250 1.00 0.00 O ATOM 117 CB ILE A 9 -2.279 -2.085 -4.682 1.00 0.00 C ATOM 118 CG1 ILE A 9 -3.129 -1.381 -5.758 1.00 0.00 C ATOM 119 CG2 ILE A 9 -1.847 -1.082 -3.604 1.00 0.00 C ATOM 120 CD1 ILE A 9 -2.440 -0.196 -6.449 1.00 0.00 C ATOM 0 HA ILE A 9 -0.595 -2.099 -5.952 1.00 0.00 H new ATOM 0 HB ILE A 9 -2.891 -2.844 -4.195 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -3.409 -2.113 -6.516 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -4.052 -1.029 -5.298 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -2.727 -0.585 -3.196 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -1.325 -1.609 -2.805 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -1.182 -0.339 -4.044 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -3.114 0.235 -7.189 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -2.185 0.560 -5.706 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -1.531 -0.541 -6.943 1.00 0.00 H new ATOM 132 N GLY A 10 -0.276 -4.379 -3.579 1.00 0.00 N ATOM 133 CA GLY A 10 0.693 -5.079 -2.746 1.00 0.00 C ATOM 134 C GLY A 10 2.039 -5.219 -3.454 1.00 0.00 C ATOM 135 O GLY A 10 3.071 -4.823 -2.917 1.00 0.00 O ATOM 0 H GLY A 10 -1.200 -4.811 -3.557 1.00 0.00 H new ATOM 0 HA2 GLY A 10 0.828 -4.538 -1.809 1.00 0.00 H new ATOM 0 HA3 GLY A 10 0.310 -6.067 -2.491 1.00 0.00 H new ATOM 139 N LEU A 11 2.045 -5.752 -4.677 1.00 0.00 N ATOM 140 CA LEU A 11 3.278 -5.876 -5.439 1.00 0.00 C ATOM 141 C LEU A 11 3.900 -4.502 -5.721 1.00 0.00 C ATOM 142 O LEU A 11 5.087 -4.318 -5.471 1.00 0.00 O ATOM 143 CB LEU A 11 3.064 -6.726 -6.700 1.00 0.00 C ATOM 144 CG LEU A 11 4.369 -7.061 -7.447 1.00 0.00 C ATOM 145 CD1 LEU A 11 5.448 -7.670 -6.541 1.00 0.00 C ATOM 146 CD2 LEU A 11 4.061 -8.068 -8.561 1.00 0.00 C ATOM 0 H LEU A 11 1.214 -6.101 -5.154 1.00 0.00 H new ATOM 0 HA LEU A 11 4.009 -6.413 -4.834 1.00 0.00 H new ATOM 0 HB2 LEU A 11 2.566 -7.655 -6.422 1.00 0.00 H new ATOM 0 HB3 LEU A 11 2.394 -6.195 -7.376 1.00 0.00 H new ATOM 0 HG LEU A 11 4.757 -6.121 -7.839 1.00 0.00 H new ATOM 0 HD11 LEU A 11 6.340 -7.882 -7.130 1.00 0.00 H new ATOM 0 HD12 LEU A 11 5.696 -6.966 -5.747 1.00 0.00 H new ATOM 0 HD13 LEU A 11 5.075 -8.595 -6.102 1.00 0.00 H new ATOM 0 HD21 LEU A 11 4.979 -8.311 -9.096 1.00 0.00 H new ATOM 0 HD22 LEU A 11 3.643 -8.976 -8.126 1.00 0.00 H new ATOM 0 HD23 LEU A 11 3.341 -7.634 -9.255 1.00 0.00 H new ATOM 158 N LEU A 12 3.125 -3.513 -6.184 1.00 0.00 N ATOM 159 CA LEU A 12 3.623 -2.142 -6.363 1.00 0.00 C ATOM 160 C LEU A 12 4.227 -1.574 -5.070 1.00 0.00 C ATOM 161 O LEU A 12 5.185 -0.796 -5.129 1.00 0.00 O ATOM 162 CB LEU A 12 2.529 -1.209 -6.909 1.00 0.00 C ATOM 163 CG LEU A 12 2.351 -1.210 -8.439 1.00 0.00 C ATOM 164 CD1 LEU A 12 3.610 -0.730 -9.169 1.00 0.00 C ATOM 165 CD2 LEU A 12 1.907 -2.563 -8.998 1.00 0.00 C ATOM 0 H LEU A 12 2.146 -3.637 -6.443 1.00 0.00 H new ATOM 0 HA LEU A 12 4.422 -2.195 -7.103 1.00 0.00 H new ATOM 0 HB2 LEU A 12 1.579 -1.486 -6.451 1.00 0.00 H new ATOM 0 HB3 LEU A 12 2.752 -0.191 -6.589 1.00 0.00 H new ATOM 0 HG LEU A 12 1.546 -0.500 -8.628 1.00 0.00 H new ATOM 0 HD11 LEU A 12 3.436 -0.748 -10.245 1.00 0.00 H new ATOM 0 HD12 LEU A 12 3.846 0.287 -8.857 1.00 0.00 H new ATOM 0 HD13 LEU A 12 4.445 -1.387 -8.925 1.00 0.00 H new ATOM 0 HD21 LEU A 12 1.801 -2.492 -10.081 1.00 0.00 H new ATOM 0 HD22 LEU A 12 2.653 -3.320 -8.755 1.00 0.00 H new ATOM 0 HD23 LEU A 12 0.950 -2.842 -8.557 1.00 0.00 H new ATOM 177 N ILE A 13 3.686 -1.952 -3.909 1.00 0.00 N ATOM 178 CA ILE A 13 4.233 -1.585 -2.610 1.00 0.00 C ATOM 179 C ILE A 13 5.557 -2.327 -2.383 1.00 0.00 C ATOM 180 O ILE A 13 6.536 -1.716 -1.960 1.00 0.00 O ATOM 181 CB ILE A 13 3.211 -1.807 -1.483 1.00 0.00 C ATOM 182 CG1 ILE A 13 1.969 -0.931 -1.731 1.00 0.00 C ATOM 183 CG2 ILE A 13 3.834 -1.441 -0.124 1.00 0.00 C ATOM 184 CD1 ILE A 13 0.748 -1.466 -0.977 1.00 0.00 C ATOM 0 H ILE A 13 2.846 -2.528 -3.849 1.00 0.00 H new ATOM 0 HA ILE A 13 4.449 -0.517 -2.597 1.00 0.00 H new ATOM 0 HB ILE A 13 2.921 -2.858 -1.471 1.00 0.00 H new ATOM 0 HG12 ILE A 13 2.174 0.092 -1.415 1.00 0.00 H new ATOM 0 HG13 ILE A 13 1.753 -0.897 -2.799 1.00 0.00 H new ATOM 0 HG21 ILE A 13 3.102 -1.602 0.667 1.00 0.00 H new ATOM 0 HG22 ILE A 13 4.707 -2.068 0.057 1.00 0.00 H new ATOM 0 HG23 ILE A 13 4.135 -0.393 -0.132 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -0.111 -0.825 -1.174 1.00 0.00 H new ATOM 0 HD12 ILE A 13 0.529 -2.480 -1.313 1.00 0.00 H new ATOM 0 HD13 ILE A 13 0.956 -1.475 0.093 1.00 0.00 H new ATOM 196 N GLY A 14 5.594 -3.626 -2.696 1.00 0.00 N ATOM 197 CA GLY A 14 6.794 -4.460 -2.694 1.00 0.00 C ATOM 198 C GLY A 14 7.881 -3.900 -3.615 1.00 0.00 C ATOM 199 O GLY A 14 9.080 -4.056 -3.365 1.00 0.00 O ATOM 0 H GLY A 14 4.757 -4.142 -2.967 1.00 0.00 H new ATOM 0 HA2 GLY A 14 7.182 -4.535 -1.678 1.00 0.00 H new ATOM 0 HA3 GLY A 14 6.534 -5.470 -3.011 1.00 0.00 H new ATOM 203 N ILE A 15 7.486 -3.243 -4.704 1.00 0.00 N ATOM 204 CA ILE A 15 8.423 -2.470 -5.492 1.00 0.00 C ATOM 205 C ILE A 15 8.867 -1.275 -4.639 1.00 0.00 C ATOM 206 O ILE A 15 10.029 -1.243 -4.228 1.00 0.00 O ATOM 207 CB ILE A 15 7.853 -2.114 -6.869 1.00 0.00 C ATOM 208 CG1 ILE A 15 7.521 -3.349 -7.725 1.00 0.00 C ATOM 209 CG2 ILE A 15 8.835 -1.204 -7.618 1.00 0.00 C ATOM 210 CD1 ILE A 15 8.631 -4.400 -7.841 1.00 0.00 C ATOM 0 H ILE A 15 6.528 -3.235 -5.053 1.00 0.00 H new ATOM 0 HA ILE A 15 9.312 -3.052 -5.738 1.00 0.00 H new ATOM 0 HB ILE A 15 6.912 -1.592 -6.697 1.00 0.00 H new ATOM 0 HG12 ILE A 15 6.635 -3.828 -7.309 1.00 0.00 H new ATOM 0 HG13 ILE A 15 7.259 -3.012 -8.728 1.00 0.00 H new ATOM 0 HG21 ILE A 15 8.425 -0.954 -8.597 1.00 0.00 H new ATOM 0 HG22 ILE A 15 8.992 -0.290 -7.046 1.00 0.00 H new ATOM 0 HG23 ILE A 15 9.786 -1.721 -7.745 1.00 0.00 H new ATOM 0 HD11 ILE A 15 8.288 -5.224 -8.466 1.00 0.00 H new ATOM 0 HD12 ILE A 15 9.515 -3.948 -8.291 1.00 0.00 H new ATOM 0 HD13 ILE A 15 8.881 -4.776 -6.849 1.00 0.00 H new ATOM 222 N PHE A 16 7.931 -0.361 -4.341 1.00 0.00 N ATOM 223 CA PHE A 16 8.105 0.871 -3.569 1.00 0.00 C ATOM 224 C PHE A 16 8.965 0.656 -2.326 1.00 0.00 C ATOM 225 O PHE A 16 10.166 0.917 -2.357 1.00 0.00 O ATOM 226 CB PHE A 16 6.713 1.443 -3.238 1.00 0.00 C ATOM 227 CG PHE A 16 6.601 2.616 -2.272 1.00 0.00 C ATOM 228 CD1 PHE A 16 7.135 3.867 -2.629 1.00 0.00 C ATOM 229 CD2 PHE A 16 5.714 2.537 -1.175 1.00 0.00 C ATOM 230 CE1 PHE A 16 6.856 5.006 -1.849 1.00 0.00 C ATOM 231 CE2 PHE A 16 5.388 3.688 -0.435 1.00 0.00 C ATOM 232 CZ PHE A 16 6.013 4.911 -0.732 1.00 0.00 C ATOM 0 H PHE A 16 6.968 -0.474 -4.656 1.00 0.00 H new ATOM 0 HA PHE A 16 8.652 1.600 -4.167 1.00 0.00 H new ATOM 0 HB2 PHE A 16 6.251 1.747 -4.178 1.00 0.00 H new ATOM 0 HB3 PHE A 16 6.111 0.628 -2.836 1.00 0.00 H new ATOM 0 HD1 PHE A 16 7.761 3.955 -3.504 1.00 0.00 H new ATOM 0 HD2 PHE A 16 5.283 1.585 -0.902 1.00 0.00 H new ATOM 0 HE1 PHE A 16 7.293 5.958 -2.112 1.00 0.00 H new ATOM 0 HE2 PHE A 16 4.659 3.632 0.360 1.00 0.00 H new ATOM 0 HZ PHE A 16 5.845 5.773 -0.104 1.00 0.00 H new ATOM 242 N HIS A 17 8.385 0.172 -1.224 1.00 0.00 N ATOM 243 CA HIS A 17 9.052 0.197 0.066 1.00 0.00 C ATOM 244 C HIS A 17 10.244 -0.702 0.346 1.00 0.00 C ATOM 245 O HIS A 17 10.557 -0.963 1.503 1.00 0.00 O ATOM 246 CB HIS A 17 8.076 0.427 1.214 1.00 0.00 C ATOM 247 CG HIS A 17 7.939 1.883 1.568 1.00 0.00 C ATOM 248 ND1 HIS A 17 8.791 2.934 1.252 1.00 0.00 N ATOM 249 CD2 HIS A 17 6.831 2.393 2.161 1.00 0.00 C ATOM 250 CE1 HIS A 17 8.176 4.061 1.639 1.00 0.00 C ATOM 251 NE2 HIS A 17 7.016 3.757 2.253 1.00 0.00 N ATOM 0 H HIS A 17 7.453 -0.241 -1.207 1.00 0.00 H new ATOM 0 HA HIS A 17 9.667 1.092 -0.030 1.00 0.00 H new ATOM 0 HB2 HIS A 17 7.099 0.029 0.942 1.00 0.00 H new ATOM 0 HB3 HIS A 17 8.413 -0.127 2.090 1.00 0.00 H new ATOM 0 HD2 HIS A 17 5.968 1.837 2.497 1.00 0.00 H new ATOM 0 HE1 HIS A 17 8.553 5.061 1.482 1.00 0.00 H new ATOM 0 HE2 HIS A 17 6.386 4.419 2.706 1.00 0.00 H new ATOM 259 N LYS A 18 10.930 -1.155 -0.699 1.00 0.00 N ATOM 260 CA LYS A 18 12.292 -1.613 -0.501 1.00 0.00 C ATOM 261 C LYS A 18 13.086 -0.308 -0.399 1.00 0.00 C ATOM 262 O LYS A 18 13.817 -0.063 0.559 1.00 0.00 O ATOM 263 CB LYS A 18 12.758 -2.448 -1.694 1.00 0.00 C ATOM 264 CG LYS A 18 11.987 -3.771 -1.703 1.00 0.00 C ATOM 265 CD LYS A 18 12.532 -4.758 -2.741 1.00 0.00 C ATOM 266 CE LYS A 18 12.691 -4.157 -4.142 1.00 0.00 C ATOM 267 NZ LYS A 18 11.463 -3.497 -4.623 1.00 0.00 N ATOM 0 H LYS A 18 10.579 -1.213 -1.655 1.00 0.00 H new ATOM 0 HA LYS A 18 12.411 -2.253 0.373 1.00 0.00 H new ATOM 0 HB2 LYS A 18 12.587 -1.906 -2.624 1.00 0.00 H new ATOM 0 HB3 LYS A 18 13.830 -2.636 -1.627 1.00 0.00 H new ATOM 0 HG2 LYS A 18 12.037 -4.224 -0.713 1.00 0.00 H new ATOM 0 HG3 LYS A 18 10.935 -3.574 -1.910 1.00 0.00 H new ATOM 0 HD2 LYS A 18 13.500 -5.129 -2.403 1.00 0.00 H new ATOM 0 HD3 LYS A 18 11.863 -5.617 -2.798 1.00 0.00 H new ATOM 0 HE2 LYS A 18 13.507 -3.434 -4.132 1.00 0.00 H new ATOM 0 HE3 LYS A 18 12.972 -4.945 -4.841 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 11.458 -3.488 -5.663 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 10.631 -4.017 -4.277 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 11.432 -2.520 -4.268 1.00 0.00 H new ATOM 281 N TYR A 19 12.853 0.556 -1.388 1.00 0.00 N ATOM 282 CA TYR A 19 13.368 1.902 -1.498 1.00 0.00 C ATOM 283 C TYR A 19 12.697 2.743 -0.410 1.00 0.00 C ATOM 284 O TYR A 19 11.473 2.705 -0.248 1.00 0.00 O ATOM 285 CB TYR A 19 13.053 2.381 -2.924 1.00 0.00 C ATOM 286 CG TYR A 19 13.430 1.366 -3.983 1.00 0.00 C ATOM 287 CD1 TYR A 19 14.778 1.022 -4.170 1.00 0.00 C ATOM 288 CD2 TYR A 19 12.430 0.653 -4.664 1.00 0.00 C ATOM 289 CE1 TYR A 19 15.115 -0.098 -4.948 1.00 0.00 C ATOM 290 CE2 TYR A 19 12.776 -0.392 -5.530 1.00 0.00 C ATOM 291 CZ TYR A 19 14.108 -0.836 -5.587 1.00 0.00 C ATOM 292 OH TYR A 19 14.410 -2.030 -6.169 1.00 0.00 O ATOM 0 H TYR A 19 12.260 0.308 -2.180 1.00 0.00 H new ATOM 0 HA TYR A 19 14.445 1.977 -1.347 1.00 0.00 H new ATOM 0 HB2 TYR A 19 11.988 2.601 -3.001 1.00 0.00 H new ATOM 0 HB3 TYR A 19 13.585 3.313 -3.115 1.00 0.00 H new ATOM 0 HD1 TYR A 19 15.556 1.618 -3.716 1.00 0.00 H new ATOM 0 HD2 TYR A 19 11.391 0.911 -4.520 1.00 0.00 H new ATOM 0 HE1 TYR A 19 16.149 -0.391 -5.054 1.00 0.00 H new ATOM 0 HE2 TYR A 19 12.023 -0.854 -6.151 1.00 0.00 H new ATOM 0 HH TYR A 19 13.596 -2.570 -6.249 1.00 0.00 H new ATOM 302 N SER A 20 13.492 3.474 0.374 1.00 0.00 N ATOM 303 CA SER A 20 13.038 4.119 1.602 1.00 0.00 C ATOM 304 C SER A 20 12.453 3.062 2.549 1.00 0.00 C ATOM 305 O SER A 20 11.432 3.274 3.207 1.00 0.00 O ATOM 306 CB SER A 20 12.150 5.351 1.339 1.00 0.00 C ATOM 307 OG SER A 20 10.902 5.045 0.750 1.00 0.00 O ATOM 0 H SER A 20 14.478 3.635 0.170 1.00 0.00 H new ATOM 0 HA SER A 20 13.890 4.556 2.123 1.00 0.00 H new ATOM 0 HB2 SER A 20 11.978 5.870 2.282 1.00 0.00 H new ATOM 0 HB3 SER A 20 12.687 6.041 0.689 1.00 0.00 H new ATOM 0 HG SER A 20 10.831 4.076 0.618 1.00 0.00 H new ATOM 376 N LYS A 26 13.529 8.845 6.408 1.00 0.00 N ATOM 377 CA LYS A 26 12.116 9.068 6.122 1.00 0.00 C ATOM 378 C LYS A 26 11.559 8.096 5.078 1.00 0.00 C ATOM 379 O LYS A 26 12.120 7.937 3.991 1.00 0.00 O ATOM 380 CB LYS A 26 11.831 10.547 5.782 1.00 0.00 C ATOM 381 CG LYS A 26 12.114 10.986 4.335 1.00 0.00 C ATOM 382 CD LYS A 26 13.606 11.097 3.987 1.00 0.00 C ATOM 383 CE LYS A 26 13.879 10.668 2.540 1.00 0.00 C ATOM 384 NZ LYS A 26 13.808 9.204 2.373 1.00 0.00 N ATOM 0 HA LYS A 26 11.570 8.847 7.039 1.00 0.00 H new ATOM 0 HB2 LYS A 26 10.783 10.752 6.002 1.00 0.00 H new ATOM 0 HB3 LYS A 26 12.425 11.171 6.450 1.00 0.00 H new ATOM 0 HG2 LYS A 26 11.646 10.275 3.654 1.00 0.00 H new ATOM 0 HG3 LYS A 26 11.640 11.952 4.162 1.00 0.00 H new ATOM 0 HD2 LYS A 26 13.939 12.125 4.132 1.00 0.00 H new ATOM 0 HD3 LYS A 26 14.187 10.475 4.668 1.00 0.00 H new ATOM 0 HE2 LYS A 26 13.155 11.144 1.879 1.00 0.00 H new ATOM 0 HE3 LYS A 26 14.866 11.020 2.238 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 14.738 8.842 2.080 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 13.534 8.765 3.275 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 13.102 8.971 1.646 1.00 0.00 H new ATOM 398 N HIS A 27 10.441 7.443 5.401 1.00 0.00 N ATOM 399 CA HIS A 27 9.894 6.357 4.598 1.00 0.00 C ATOM 400 C HIS A 27 9.003 6.900 3.481 1.00 0.00 C ATOM 401 O HIS A 27 7.854 6.499 3.311 1.00 0.00 O ATOM 402 CB HIS A 27 9.278 5.297 5.514 1.00 0.00 C ATOM 403 CG HIS A 27 10.362 4.629 6.335 1.00 0.00 C ATOM 404 ND1 HIS A 27 11.175 3.614 5.868 1.00 0.00 N ATOM 405 CD2 HIS A 27 10.976 5.173 7.434 1.00 0.00 C ATOM 406 CE1 HIS A 27 12.251 3.534 6.670 1.00 0.00 C ATOM 407 NE2 HIS A 27 12.159 4.483 7.620 1.00 0.00 N ATOM 0 H HIS A 27 9.890 7.657 6.232 1.00 0.00 H new ATOM 0 HA HIS A 27 10.681 5.831 4.058 1.00 0.00 H new ATOM 0 HB2 HIS A 27 8.542 5.757 6.174 1.00 0.00 H new ATOM 0 HB3 HIS A 27 8.750 4.552 4.918 1.00 0.00 H new ATOM 0 HD1 HIS A 27 10.991 3.027 5.055 1.00 0.00 H new ATOM 0 HD2 HIS A 27 10.605 5.987 8.040 1.00 0.00 H new ATOM 0 HE1 HIS A 27 13.058 2.824 6.568 1.00 0.00 H new ATOM 415 N THR A 28 9.615 7.784 2.697 1.00 0.00 N ATOM 416 CA THR A 28 9.199 8.355 1.431 1.00 0.00 C ATOM 417 C THR A 28 10.496 8.359 0.615 1.00 0.00 C ATOM 418 O THR A 28 11.579 8.407 1.212 1.00 0.00 O ATOM 419 CB THR A 28 8.673 9.786 1.648 1.00 0.00 C ATOM 420 OG1 THR A 28 9.698 10.613 2.160 1.00 0.00 O ATOM 421 CG2 THR A 28 7.516 9.813 2.647 1.00 0.00 C ATOM 0 H THR A 28 10.523 8.158 2.973 1.00 0.00 H new ATOM 0 HA THR A 28 8.394 7.808 0.941 1.00 0.00 H new ATOM 0 HB THR A 28 8.329 10.148 0.679 1.00 0.00 H new ATOM 0 HG1 THR A 28 9.367 11.532 2.241 1.00 0.00 H new ATOM 0 HG21 THR A 28 7.170 10.839 2.776 1.00 0.00 H new ATOM 0 HG22 THR A 28 6.697 9.198 2.272 1.00 0.00 H new ATOM 0 HG23 THR A 28 7.854 9.421 3.606 1.00 0.00 H new ATOM 429 N LEU A 29 10.442 8.277 -0.714 1.00 0.00 N ATOM 430 CA LEU A 29 11.662 8.386 -1.498 1.00 0.00 C ATOM 431 C LEU A 29 12.004 9.876 -1.575 1.00 0.00 C ATOM 432 O LEU A 29 11.103 10.708 -1.633 1.00 0.00 O ATOM 433 CB LEU A 29 11.496 7.739 -2.883 1.00 0.00 C ATOM 434 CG LEU A 29 11.349 6.206 -2.852 1.00 0.00 C ATOM 435 CD1 LEU A 29 9.940 5.742 -2.485 1.00 0.00 C ATOM 436 CD2 LEU A 29 11.648 5.650 -4.247 1.00 0.00 C ATOM 0 H LEU A 29 9.588 8.139 -1.255 1.00 0.00 H new ATOM 0 HA LEU A 29 12.484 7.844 -1.030 1.00 0.00 H new ATOM 0 HB2 LEU A 29 10.619 8.167 -3.368 1.00 0.00 H new ATOM 0 HB3 LEU A 29 12.358 7.997 -3.498 1.00 0.00 H new ATOM 0 HG LEU A 29 12.043 5.845 -2.093 1.00 0.00 H new ATOM 0 HD11 LEU A 29 9.905 4.653 -2.481 1.00 0.00 H new ATOM 0 HD12 LEU A 29 9.680 6.117 -1.495 1.00 0.00 H new ATOM 0 HD13 LEU A 29 9.229 6.125 -3.217 1.00 0.00 H new ATOM 0 HD21 LEU A 29 11.547 4.565 -4.236 1.00 0.00 H new ATOM 0 HD22 LEU A 29 10.945 6.073 -4.965 1.00 0.00 H new ATOM 0 HD23 LEU A 29 12.665 5.916 -4.535 1.00 0.00 H new ATOM 448 N SER A 30 13.288 10.230 -1.534 1.00 0.00 N ATOM 449 CA SER A 30 13.747 11.593 -1.747 1.00 0.00 C ATOM 450 C SER A 30 14.127 11.690 -3.219 1.00 0.00 C ATOM 451 O SER A 30 13.316 12.060 -4.069 1.00 0.00 O ATOM 452 CB SER A 30 14.915 11.917 -0.797 1.00 0.00 C ATOM 453 OG SER A 30 15.972 10.969 -0.849 1.00 0.00 O ATOM 0 H SER A 30 14.042 9.569 -1.350 1.00 0.00 H new ATOM 0 HA SER A 30 12.977 12.331 -1.521 1.00 0.00 H new ATOM 0 HB2 SER A 30 15.310 12.903 -1.044 1.00 0.00 H new ATOM 0 HB3 SER A 30 14.537 11.971 0.224 1.00 0.00 H new ATOM 0 HG SER A 30 15.652 10.146 -1.274 1.00 0.00 H new ATOM 459 N LYS A 31 15.370 11.302 -3.494 1.00 0.00 N ATOM 460 CA LYS A 31 15.936 11.059 -4.805 1.00 0.00 C ATOM 461 C LYS A 31 16.752 9.771 -4.729 1.00 0.00 C ATOM 462 O LYS A 31 16.552 8.905 -5.573 1.00 0.00 O ATOM 463 CB LYS A 31 16.793 12.238 -5.307 1.00 0.00 C ATOM 464 CG LYS A 31 16.039 13.140 -6.298 1.00 0.00 C ATOM 465 CD LYS A 31 15.183 14.209 -5.609 1.00 0.00 C ATOM 466 CE LYS A 31 13.906 14.510 -6.407 1.00 0.00 C ATOM 467 NZ LYS A 31 12.868 13.474 -6.221 1.00 0.00 N ATOM 0 H LYS A 31 16.050 11.140 -2.751 1.00 0.00 H new ATOM 0 HA LYS A 31 15.129 10.957 -5.531 1.00 0.00 H new ATOM 0 HB2 LYS A 31 17.118 12.834 -4.454 1.00 0.00 H new ATOM 0 HB3 LYS A 31 17.692 11.850 -5.786 1.00 0.00 H new ATOM 0 HG2 LYS A 31 16.759 13.628 -6.955 1.00 0.00 H new ATOM 0 HG3 LYS A 31 15.399 12.522 -6.928 1.00 0.00 H new ATOM 0 HD2 LYS A 31 14.916 13.872 -4.607 1.00 0.00 H new ATOM 0 HD3 LYS A 31 15.765 15.123 -5.494 1.00 0.00 H new ATOM 0 HE2 LYS A 31 13.509 15.478 -6.100 1.00 0.00 H new ATOM 0 HE3 LYS A 31 14.152 14.588 -7.466 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 11.987 13.779 -6.682 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 13.189 12.581 -6.645 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 12.697 13.333 -5.205 1.00 0.00 H new ATOM 481 N LYS A 32 17.667 9.633 -3.756 1.00 0.00 N ATOM 482 CA LYS A 32 18.599 8.503 -3.678 1.00 0.00 C ATOM 483 C LYS A 32 17.907 7.162 -3.948 1.00 0.00 C ATOM 484 O LYS A 32 18.342 6.369 -4.784 1.00 0.00 O ATOM 485 CB LYS A 32 19.377 8.505 -2.341 1.00 0.00 C ATOM 486 CG LYS A 32 18.535 8.360 -1.054 1.00 0.00 C ATOM 487 CD LYS A 32 19.419 8.233 0.198 1.00 0.00 C ATOM 488 CE LYS A 32 18.669 8.360 1.541 1.00 0.00 C ATOM 489 NZ LYS A 32 17.606 7.354 1.764 1.00 0.00 N ATOM 0 H LYS A 32 17.779 10.307 -2.999 1.00 0.00 H new ATOM 0 HA LYS A 32 19.332 8.632 -4.475 1.00 0.00 H new ATOM 0 HB2 LYS A 32 20.103 7.692 -2.367 1.00 0.00 H new ATOM 0 HB3 LYS A 32 19.942 9.435 -2.276 1.00 0.00 H new ATOM 0 HG2 LYS A 32 17.880 9.225 -0.950 1.00 0.00 H new ATOM 0 HG3 LYS A 32 17.894 7.482 -1.136 1.00 0.00 H new ATOM 0 HD2 LYS A 32 19.925 7.268 0.171 1.00 0.00 H new ATOM 0 HD3 LYS A 32 20.193 8.999 0.157 1.00 0.00 H new ATOM 0 HE2 LYS A 32 19.393 8.286 2.352 1.00 0.00 H new ATOM 0 HE3 LYS A 32 18.225 9.354 1.599 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 17.604 7.067 2.763 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 16.682 7.765 1.520 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 17.784 6.523 1.165 1.00 0.00 H new ATOM 503 N GLU A 33 16.786 6.946 -3.271 1.00 0.00 N ATOM 504 CA GLU A 33 16.000 5.734 -3.338 1.00 0.00 C ATOM 505 C GLU A 33 15.475 5.533 -4.763 1.00 0.00 C ATOM 506 O GLU A 33 15.466 4.422 -5.292 1.00 0.00 O ATOM 507 CB GLU A 33 14.864 5.868 -2.316 1.00 0.00 C ATOM 508 CG GLU A 33 15.360 6.246 -0.914 1.00 0.00 C ATOM 509 CD GLU A 33 15.336 7.735 -0.634 1.00 0.00 C ATOM 510 OE1 GLU A 33 15.367 8.529 -1.598 1.00 0.00 O ATOM 511 OE2 GLU A 33 15.330 8.101 0.558 1.00 0.00 O ATOM 0 H GLU A 33 16.390 7.641 -2.638 1.00 0.00 H new ATOM 0 HA GLU A 33 16.598 4.855 -3.097 1.00 0.00 H new ATOM 0 HB2 GLU A 33 14.159 6.624 -2.662 1.00 0.00 H new ATOM 0 HB3 GLU A 33 14.319 4.925 -2.261 1.00 0.00 H new ATOM 0 HG2 GLU A 33 14.745 5.737 -0.172 1.00 0.00 H new ATOM 0 HG3 GLU A 33 16.379 5.879 -0.789 1.00 0.00 H new ATOM 518 N LEU A 34 15.052 6.628 -5.396 1.00 0.00 N ATOM 519 CA LEU A 34 14.564 6.620 -6.761 1.00 0.00 C ATOM 520 C LEU A 34 15.726 6.283 -7.697 1.00 0.00 C ATOM 521 O LEU A 34 15.590 5.434 -8.571 1.00 0.00 O ATOM 522 CB LEU A 34 13.918 7.977 -7.090 1.00 0.00 C ATOM 523 CG LEU A 34 12.880 7.945 -8.225 1.00 0.00 C ATOM 524 CD1 LEU A 34 13.407 7.316 -9.515 1.00 0.00 C ATOM 525 CD2 LEU A 34 11.575 7.262 -7.801 1.00 0.00 C ATOM 0 H LEU A 34 15.042 7.552 -4.964 1.00 0.00 H new ATOM 0 HA LEU A 34 13.794 5.860 -6.893 1.00 0.00 H new ATOM 0 HB2 LEU A 34 13.438 8.362 -6.190 1.00 0.00 H new ATOM 0 HB3 LEU A 34 14.705 8.682 -7.358 1.00 0.00 H new ATOM 0 HG LEU A 34 12.669 8.993 -8.439 1.00 0.00 H new ATOM 0 HD11 LEU A 34 12.623 7.327 -10.272 1.00 0.00 H new ATOM 0 HD12 LEU A 34 14.265 7.885 -9.873 1.00 0.00 H new ATOM 0 HD13 LEU A 34 13.710 6.287 -9.321 1.00 0.00 H new ATOM 0 HD21 LEU A 34 10.875 7.265 -8.636 1.00 0.00 H new ATOM 0 HD22 LEU A 34 11.782 6.234 -7.504 1.00 0.00 H new ATOM 0 HD23 LEU A 34 11.139 7.801 -6.960 1.00 0.00 H new ATOM 537 N LYS A 35 16.887 6.919 -7.515 1.00 0.00 N ATOM 538 CA LYS A 35 18.038 6.663 -8.375 1.00 0.00 C ATOM 539 C LYS A 35 18.564 5.230 -8.207 1.00 0.00 C ATOM 540 O LYS A 35 19.247 4.722 -9.093 1.00 0.00 O ATOM 541 CB LYS A 35 19.116 7.747 -8.224 1.00 0.00 C ATOM 542 CG LYS A 35 18.567 9.187 -8.274 1.00 0.00 C ATOM 543 CD LYS A 35 17.618 9.507 -9.446 1.00 0.00 C ATOM 544 CE LYS A 35 16.783 10.753 -9.119 1.00 0.00 C ATOM 545 NZ LYS A 35 15.928 11.160 -10.247 1.00 0.00 N ATOM 0 H LYS A 35 17.051 7.610 -6.783 1.00 0.00 H new ATOM 0 HA LYS A 35 17.706 6.731 -9.411 1.00 0.00 H new ATOM 0 HB2 LYS A 35 19.635 7.599 -7.277 1.00 0.00 H new ATOM 0 HB3 LYS A 35 19.855 7.623 -9.015 1.00 0.00 H new ATOM 0 HG2 LYS A 35 18.040 9.387 -7.341 1.00 0.00 H new ATOM 0 HG3 LYS A 35 19.411 9.875 -8.317 1.00 0.00 H new ATOM 0 HD2 LYS A 35 18.194 9.674 -10.356 1.00 0.00 H new ATOM 0 HD3 LYS A 35 16.961 8.658 -9.635 1.00 0.00 H new ATOM 0 HE2 LYS A 35 16.160 10.553 -8.247 1.00 0.00 H new ATOM 0 HE3 LYS A 35 17.448 11.575 -8.854 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 15.251 11.882 -9.927 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 16.520 11.553 -11.007 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 15.409 10.333 -10.605 1.00 0.00 H new ATOM 559 N GLU A 36 18.217 4.567 -7.100 1.00 0.00 N ATOM 560 CA GLU A 36 18.429 3.137 -6.924 1.00 0.00 C ATOM 561 C GLU A 36 17.416 2.363 -7.789 1.00 0.00 C ATOM 562 O GLU A 36 17.776 1.605 -8.688 1.00 0.00 O ATOM 563 CB GLU A 36 18.336 2.824 -5.421 1.00 0.00 C ATOM 564 CG GLU A 36 19.005 1.513 -5.003 1.00 0.00 C ATOM 565 CD GLU A 36 18.824 1.322 -3.506 1.00 0.00 C ATOM 566 OE1 GLU A 36 19.619 1.881 -2.716 1.00 0.00 O ATOM 567 OE2 GLU A 36 17.809 0.711 -3.108 1.00 0.00 O ATOM 0 H GLU A 36 17.778 5.017 -6.297 1.00 0.00 H new ATOM 0 HA GLU A 36 19.416 2.821 -7.261 1.00 0.00 H new ATOM 0 HB2 GLU A 36 18.791 3.643 -4.863 1.00 0.00 H new ATOM 0 HB3 GLU A 36 17.285 2.788 -5.135 1.00 0.00 H new ATOM 0 HG2 GLU A 36 18.565 0.676 -5.545 1.00 0.00 H new ATOM 0 HG3 GLU A 36 20.065 1.534 -5.255 1.00 0.00 H new ATOM 574 N LEU A 37 16.134 2.599 -7.514 1.00 0.00 N ATOM 575 CA LEU A 37 14.954 1.998 -8.129 1.00 0.00 C ATOM 576 C LEU A 37 14.979 2.017 -9.663 1.00 0.00 C ATOM 577 O LEU A 37 14.834 0.974 -10.311 1.00 0.00 O ATOM 578 CB LEU A 37 13.759 2.785 -7.546 1.00 0.00 C ATOM 579 CG LEU A 37 12.343 2.298 -7.864 1.00 0.00 C ATOM 580 CD1 LEU A 37 11.342 2.924 -6.884 1.00 0.00 C ATOM 581 CD2 LEU A 37 11.869 2.698 -9.265 1.00 0.00 C ATOM 0 H LEU A 37 15.874 3.273 -6.794 1.00 0.00 H new ATOM 0 HA LEU A 37 14.896 0.934 -7.900 1.00 0.00 H new ATOM 0 HB2 LEU A 37 13.869 2.801 -6.462 1.00 0.00 H new ATOM 0 HB3 LEU A 37 13.841 3.816 -7.890 1.00 0.00 H new ATOM 0 HG LEU A 37 12.383 1.211 -7.789 1.00 0.00 H new ATOM 0 HD11 LEU A 37 10.337 2.573 -7.117 1.00 0.00 H new ATOM 0 HD12 LEU A 37 11.601 2.635 -5.865 1.00 0.00 H new ATOM 0 HD13 LEU A 37 11.376 4.010 -6.973 1.00 0.00 H new ATOM 0 HD21 LEU A 37 10.859 2.323 -9.428 1.00 0.00 H new ATOM 0 HD22 LEU A 37 11.871 3.784 -9.354 1.00 0.00 H new ATOM 0 HD23 LEU A 37 12.539 2.272 -10.011 1.00 0.00 H new ATOM 593 N ILE A 38 15.089 3.226 -10.220 1.00 0.00 N ATOM 594 CA ILE A 38 14.912 3.589 -11.623 1.00 0.00 C ATOM 595 C ILE A 38 15.301 2.486 -12.601 1.00 0.00 C ATOM 596 O ILE A 38 14.474 2.042 -13.396 1.00 0.00 O ATOM 597 CB ILE A 38 15.620 4.936 -11.897 1.00 0.00 C ATOM 598 CG1 ILE A 38 15.457 5.517 -13.311 1.00 0.00 C ATOM 599 CG2 ILE A 38 17.094 4.970 -11.483 1.00 0.00 C ATOM 600 CD1 ILE A 38 16.235 4.867 -14.461 1.00 0.00 C ATOM 0 H ILE A 38 15.323 4.040 -9.652 1.00 0.00 H new ATOM 0 HA ILE A 38 13.845 3.718 -11.805 1.00 0.00 H new ATOM 0 HB ILE A 38 15.061 5.597 -11.235 1.00 0.00 H new ATOM 0 HG12 ILE A 38 14.398 5.481 -13.565 1.00 0.00 H new ATOM 0 HG13 ILE A 38 15.739 6.569 -13.272 1.00 0.00 H new ATOM 0 HG21 ILE A 38 17.513 5.950 -11.710 1.00 0.00 H new ATOM 0 HG22 ILE A 38 17.176 4.779 -10.413 1.00 0.00 H new ATOM 0 HG23 ILE A 38 17.644 4.205 -12.031 1.00 0.00 H new ATOM 0 HD11 ILE A 38 16.014 5.390 -15.391 1.00 0.00 H new ATOM 0 HD12 ILE A 38 17.304 4.927 -14.257 1.00 0.00 H new ATOM 0 HD13 ILE A 38 15.941 3.821 -14.554 1.00 0.00 H new ATOM 612 N GLN A 39 16.564 2.066 -12.545 1.00 0.00 N ATOM 613 CA GLN A 39 17.174 1.210 -13.548 1.00 0.00 C ATOM 614 C GLN A 39 16.411 -0.102 -13.716 1.00 0.00 C ATOM 615 O GLN A 39 16.149 -0.525 -14.843 1.00 0.00 O ATOM 616 CB GLN A 39 18.659 1.002 -13.192 1.00 0.00 C ATOM 617 CG GLN A 39 19.373 2.365 -13.125 1.00 0.00 C ATOM 618 CD GLN A 39 20.724 2.449 -13.833 1.00 0.00 C ATOM 619 OE1 GLN A 39 21.398 1.452 -14.068 1.00 0.00 O ATOM 620 NE2 GLN A 39 21.099 3.677 -14.191 1.00 0.00 N ATOM 0 H GLN A 39 17.198 2.318 -11.787 1.00 0.00 H new ATOM 0 HA GLN A 39 17.121 1.696 -14.522 1.00 0.00 H new ATOM 0 HB2 GLN A 39 18.745 0.488 -12.234 1.00 0.00 H new ATOM 0 HB3 GLN A 39 19.136 0.367 -13.938 1.00 0.00 H new ATOM 0 HG2 GLN A 39 18.713 3.120 -13.553 1.00 0.00 H new ATOM 0 HG3 GLN A 39 19.518 2.626 -12.077 1.00 0.00 H new ATOM 0 HE21 GLN A 39 20.504 4.476 -13.973 1.00 0.00 H new ATOM 0 HE22 GLN A 39 21.981 3.818 -14.683 1.00 0.00 H new ATOM 629 N LYS A 40 16.122 -0.777 -12.598 1.00 0.00 N ATOM 630 CA LYS A 40 15.546 -2.113 -12.622 1.00 0.00 C ATOM 631 C LYS A 40 14.019 -2.143 -12.505 1.00 0.00 C ATOM 632 O LYS A 40 13.372 -3.039 -13.046 1.00 0.00 O ATOM 633 CB LYS A 40 16.231 -2.969 -11.546 1.00 0.00 C ATOM 634 CG LYS A 40 15.876 -4.462 -11.681 1.00 0.00 C ATOM 635 CD LYS A 40 15.026 -4.993 -10.512 1.00 0.00 C ATOM 636 CE LYS A 40 13.886 -5.904 -10.986 1.00 0.00 C ATOM 637 NZ LYS A 40 12.731 -5.123 -11.470 1.00 0.00 N ATOM 0 H LYS A 40 16.282 -0.410 -11.660 1.00 0.00 H new ATOM 0 HA LYS A 40 15.739 -2.537 -13.607 1.00 0.00 H new ATOM 0 HB2 LYS A 40 17.312 -2.846 -11.619 1.00 0.00 H new ATOM 0 HB3 LYS A 40 15.935 -2.614 -10.559 1.00 0.00 H new ATOM 0 HG2 LYS A 40 15.335 -4.617 -12.614 1.00 0.00 H new ATOM 0 HG3 LYS A 40 16.796 -5.043 -11.746 1.00 0.00 H new ATOM 0 HD2 LYS A 40 15.665 -5.544 -9.822 1.00 0.00 H new ATOM 0 HD3 LYS A 40 14.609 -4.152 -9.958 1.00 0.00 H new ATOM 0 HE2 LYS A 40 14.246 -6.554 -11.784 1.00 0.00 H new ATOM 0 HE3 LYS A 40 13.571 -6.550 -10.166 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 12.111 -5.735 -12.038 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 12.199 -4.750 -10.658 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 13.068 -4.332 -12.056 1.00 0.00 H new ATOM 651 N GLU A 41 13.428 -1.241 -11.720 1.00 0.00 N ATOM 652 CA GLU A 41 12.048 -1.420 -11.278 1.00 0.00 C ATOM 653 C GLU A 41 10.932 -0.816 -12.129 1.00 0.00 C ATOM 654 O GLU A 41 9.826 -1.350 -12.111 1.00 0.00 O ATOM 655 CB GLU A 41 11.947 -0.948 -9.836 1.00 0.00 C ATOM 656 CG GLU A 41 12.901 -1.715 -8.911 1.00 0.00 C ATOM 657 CD GLU A 41 12.317 -3.020 -8.386 1.00 0.00 C ATOM 658 OE1 GLU A 41 12.057 -3.910 -9.224 1.00 0.00 O ATOM 659 OE2 GLU A 41 12.185 -3.119 -7.141 1.00 0.00 O ATOM 0 H GLU A 41 13.878 -0.390 -11.382 1.00 0.00 H new ATOM 0 HA GLU A 41 11.857 -2.487 -11.392 1.00 0.00 H new ATOM 0 HB2 GLU A 41 12.173 0.117 -9.787 1.00 0.00 H new ATOM 0 HB3 GLU A 41 10.923 -1.073 -9.485 1.00 0.00 H new ATOM 0 HG2 GLU A 41 13.824 -1.930 -9.450 1.00 0.00 H new ATOM 0 HG3 GLU A 41 13.166 -1.079 -8.067 1.00 0.00 H new ATOM 666 N LEU A 42 11.155 0.278 -12.857 1.00 0.00 N ATOM 667 CA LEU A 42 10.058 1.033 -13.481 1.00 0.00 C ATOM 668 C LEU A 42 9.335 0.336 -14.655 1.00 0.00 C ATOM 669 O LEU A 42 8.695 1.014 -15.454 1.00 0.00 O ATOM 670 CB LEU A 42 10.548 2.444 -13.849 1.00 0.00 C ATOM 671 CG LEU A 42 10.887 3.319 -12.626 1.00 0.00 C ATOM 672 CD1 LEU A 42 11.646 4.552 -13.127 1.00 0.00 C ATOM 673 CD2 LEU A 42 9.632 3.794 -11.881 1.00 0.00 C ATOM 0 H LEU A 42 12.083 0.664 -13.032 1.00 0.00 H new ATOM 0 HA LEU A 42 9.274 1.095 -12.726 1.00 0.00 H new ATOM 0 HB2 LEU A 42 11.432 2.359 -14.481 1.00 0.00 H new ATOM 0 HB3 LEU A 42 9.781 2.943 -14.441 1.00 0.00 H new ATOM 0 HG LEU A 42 11.479 2.722 -11.932 1.00 0.00 H new ATOM 0 HD11 LEU A 42 11.900 5.191 -12.282 1.00 0.00 H new ATOM 0 HD12 LEU A 42 12.560 4.237 -13.631 1.00 0.00 H new ATOM 0 HD13 LEU A 42 11.019 5.106 -13.826 1.00 0.00 H new ATOM 0 HD21 LEU A 42 9.925 4.406 -11.028 1.00 0.00 H new ATOM 0 HD22 LEU A 42 9.010 4.384 -12.555 1.00 0.00 H new ATOM 0 HD23 LEU A 42 9.068 2.930 -11.530 1.00 0.00 H new ATOM 685 N THR A 43 9.390 -0.997 -14.761 1.00 0.00 N ATOM 686 CA THR A 43 8.759 -1.802 -15.807 1.00 0.00 C ATOM 687 C THR A 43 9.104 -1.261 -17.196 1.00 0.00 C ATOM 688 O THR A 43 8.233 -0.909 -17.981 1.00 0.00 O ATOM 689 CB THR A 43 7.239 -1.940 -15.592 1.00 0.00 C ATOM 690 OG1 THR A 43 6.951 -2.067 -14.213 1.00 0.00 O ATOM 691 CG2 THR A 43 6.696 -3.192 -16.290 1.00 0.00 C ATOM 0 H THR A 43 9.900 -1.568 -14.087 1.00 0.00 H new ATOM 0 HA THR A 43 9.167 -2.811 -15.741 1.00 0.00 H new ATOM 0 HB THR A 43 6.771 -1.047 -16.007 1.00 0.00 H new ATOM 0 HG1 THR A 43 5.983 -2.152 -14.088 1.00 0.00 H new ATOM 0 HG21 THR A 43 5.621 -3.265 -16.122 1.00 0.00 H new ATOM 0 HG22 THR A 43 6.892 -3.126 -17.360 1.00 0.00 H new ATOM 0 HG23 THR A 43 7.187 -4.077 -15.885 1.00 0.00 H new ATOM 699 N ILE A 44 10.395 -1.206 -17.515 1.00 0.00 N ATOM 700 CA ILE A 44 10.896 -0.667 -18.765 1.00 0.00 C ATOM 701 C ILE A 44 10.738 -1.740 -19.846 1.00 0.00 C ATOM 702 O ILE A 44 11.679 -2.411 -20.272 1.00 0.00 O ATOM 703 CB ILE A 44 12.330 -0.141 -18.624 1.00 0.00 C ATOM 704 CG1 ILE A 44 12.550 0.717 -17.359 1.00 0.00 C ATOM 705 CG2 ILE A 44 12.649 0.716 -19.860 1.00 0.00 C ATOM 706 CD1 ILE A 44 13.076 -0.080 -16.160 1.00 0.00 C ATOM 0 H ILE A 44 11.132 -1.543 -16.896 1.00 0.00 H new ATOM 0 HA ILE A 44 10.314 0.206 -19.061 1.00 0.00 H new ATOM 0 HB ILE A 44 12.987 -1.006 -18.538 1.00 0.00 H new ATOM 0 HG12 ILE A 44 13.254 1.516 -17.590 1.00 0.00 H new ATOM 0 HG13 ILE A 44 11.608 1.192 -17.084 1.00 0.00 H new ATOM 0 HG21 ILE A 44 13.665 1.102 -19.783 1.00 0.00 H new ATOM 0 HG22 ILE A 44 12.560 0.106 -20.759 1.00 0.00 H new ATOM 0 HG23 ILE A 44 11.948 1.549 -19.916 1.00 0.00 H new ATOM 0 HD11 ILE A 44 13.206 0.588 -15.308 1.00 0.00 H new ATOM 0 HD12 ILE A 44 12.362 -0.862 -15.902 1.00 0.00 H new ATOM 0 HD13 ILE A 44 14.034 -0.533 -16.416 1.00 0.00 H new ATOM 888 N LEU A 56 17.956 10.058 -17.737 1.00 0.00 N ATOM 889 CA LEU A 56 17.687 11.370 -18.317 1.00 0.00 C ATOM 890 C LEU A 56 16.225 11.790 -18.098 1.00 0.00 C ATOM 891 O LEU A 56 15.954 12.954 -17.809 1.00 0.00 O ATOM 892 CB LEU A 56 18.051 11.347 -19.808 1.00 0.00 C ATOM 893 CG LEU A 56 17.859 12.692 -20.531 1.00 0.00 C ATOM 894 CD1 LEU A 56 18.713 13.809 -19.918 1.00 0.00 C ATOM 895 CD2 LEU A 56 18.239 12.521 -22.006 1.00 0.00 C ATOM 0 HA LEU A 56 18.304 12.116 -17.815 1.00 0.00 H new ATOM 0 HB2 LEU A 56 19.091 11.039 -19.911 1.00 0.00 H new ATOM 0 HB3 LEU A 56 17.444 10.591 -20.306 1.00 0.00 H new ATOM 0 HG LEU A 56 16.813 12.981 -20.426 1.00 0.00 H new ATOM 0 HD11 LEU A 56 18.543 14.738 -20.463 1.00 0.00 H new ATOM 0 HD12 LEU A 56 18.437 13.946 -18.872 1.00 0.00 H new ATOM 0 HD13 LEU A 56 19.767 13.538 -19.983 1.00 0.00 H new ATOM 0 HD21 LEU A 56 18.107 13.469 -22.528 1.00 0.00 H new ATOM 0 HD22 LEU A 56 19.281 12.209 -22.080 1.00 0.00 H new ATOM 0 HD23 LEU A 56 17.600 11.764 -22.461 1.00 0.00 H new ATOM 907 N MET A 57 15.289 10.846 -18.227 1.00 0.00 N ATOM 908 CA MET A 57 13.857 11.095 -18.118 1.00 0.00 C ATOM 909 C MET A 57 13.408 11.018 -16.655 1.00 0.00 C ATOM 910 O MET A 57 12.583 11.812 -16.200 1.00 0.00 O ATOM 911 CB MET A 57 13.086 10.079 -18.977 1.00 0.00 C ATOM 912 CG MET A 57 13.711 9.850 -20.361 1.00 0.00 C ATOM 913 SD MET A 57 14.067 11.334 -21.337 1.00 0.00 S ATOM 914 CE MET A 57 14.818 10.566 -22.788 1.00 0.00 C ATOM 0 H MET A 57 15.514 9.869 -18.414 1.00 0.00 H new ATOM 0 HA MET A 57 13.643 12.099 -18.484 1.00 0.00 H new ATOM 0 HB2 MET A 57 13.039 9.128 -18.446 1.00 0.00 H new ATOM 0 HB3 MET A 57 12.060 10.425 -19.103 1.00 0.00 H new ATOM 0 HG2 MET A 57 14.641 9.296 -20.229 1.00 0.00 H new ATOM 0 HG3 MET A 57 13.040 9.214 -20.938 1.00 0.00 H new ATOM 0 HE1 MET A 57 15.102 11.339 -23.503 1.00 0.00 H new ATOM 0 HE2 MET A 57 15.704 10.007 -22.486 1.00 0.00 H new ATOM 0 HE3 MET A 57 14.102 9.888 -23.252 1.00 0.00 H new ATOM 924 N ASP A 58 13.950 10.042 -15.918 1.00 0.00 N ATOM 925 CA ASP A 58 13.570 9.741 -14.542 1.00 0.00 C ATOM 926 C ASP A 58 13.539 10.981 -13.668 1.00 0.00 C ATOM 927 O ASP A 58 12.724 11.078 -12.758 1.00 0.00 O ATOM 928 CB ASP A 58 14.477 8.660 -13.934 1.00 0.00 C ATOM 929 CG ASP A 58 15.324 9.141 -12.754 1.00 0.00 C ATOM 930 OD1 ASP A 58 14.786 9.214 -11.633 1.00 0.00 O ATOM 931 OD2 ASP A 58 16.505 9.486 -12.961 1.00 0.00 O ATOM 0 H ASP A 58 14.682 9.428 -16.274 1.00 0.00 H new ATOM 0 HA ASP A 58 12.553 9.349 -14.577 1.00 0.00 H new ATOM 0 HB2 ASP A 58 13.858 7.825 -13.606 1.00 0.00 H new ATOM 0 HB3 ASP A 58 15.140 8.279 -14.711 1.00 0.00 H new ATOM 936 N ASP A 59 14.414 11.951 -13.920 1.00 0.00 N ATOM 937 CA ASP A 59 14.486 13.072 -13.001 1.00 0.00 C ATOM 938 C ASP A 59 13.192 13.892 -12.886 1.00 0.00 C ATOM 939 O ASP A 59 13.105 14.774 -12.038 1.00 0.00 O ATOM 940 CB ASP A 59 15.736 13.932 -13.241 1.00 0.00 C ATOM 941 CG ASP A 59 16.567 14.031 -11.977 1.00 0.00 C ATOM 942 OD1 ASP A 59 17.192 12.992 -11.653 1.00 0.00 O ATOM 943 OD2 ASP A 59 16.583 15.111 -11.347 1.00 0.00 O ATOM 0 H ASP A 59 15.053 11.983 -14.714 1.00 0.00 H new ATOM 0 HA ASP A 59 14.594 12.627 -12.012 1.00 0.00 H new ATOM 0 HB2 ASP A 59 16.334 13.498 -14.043 1.00 0.00 H new ATOM 0 HB3 ASP A 59 15.441 14.929 -13.567 1.00 0.00 H new ATOM 948 N LEU A 60 12.157 13.593 -13.681 1.00 0.00 N ATOM 949 CA LEU A 60 10.810 14.102 -13.441 1.00 0.00 C ATOM 950 C LEU A 60 10.335 13.758 -12.014 1.00 0.00 C ATOM 951 O LEU A 60 9.447 14.429 -11.495 1.00 0.00 O ATOM 952 CB LEU A 60 9.833 13.564 -14.501 1.00 0.00 C ATOM 953 CG LEU A 60 9.639 14.533 -15.679 1.00 0.00 C ATOM 954 CD1 LEU A 60 10.933 14.799 -16.458 1.00 0.00 C ATOM 955 CD2 LEU A 60 8.585 13.962 -16.636 1.00 0.00 C ATOM 0 H LEU A 60 12.234 12.994 -14.503 1.00 0.00 H new ATOM 0 HA LEU A 60 10.834 15.188 -13.525 1.00 0.00 H new ATOM 0 HB2 LEU A 60 10.202 12.610 -14.878 1.00 0.00 H new ATOM 0 HB3 LEU A 60 8.868 13.370 -14.033 1.00 0.00 H new ATOM 0 HG LEU A 60 9.314 15.485 -15.259 1.00 0.00 H new ATOM 0 HD11 LEU A 60 10.730 15.490 -17.276 1.00 0.00 H new ATOM 0 HD12 LEU A 60 11.676 15.235 -15.791 1.00 0.00 H new ATOM 0 HD13 LEU A 60 11.314 13.861 -16.862 1.00 0.00 H new ATOM 0 HD21 LEU A 60 8.445 14.646 -17.473 1.00 0.00 H new ATOM 0 HD22 LEU A 60 8.920 12.995 -17.011 1.00 0.00 H new ATOM 0 HD23 LEU A 60 7.641 13.839 -16.106 1.00 0.00 H new ATOM 967 N ASP A 61 10.941 12.766 -11.344 1.00 0.00 N ATOM 968 CA ASP A 61 10.761 12.481 -9.914 1.00 0.00 C ATOM 969 C ASP A 61 11.024 13.703 -9.024 1.00 0.00 C ATOM 970 O ASP A 61 10.658 13.753 -7.850 1.00 0.00 O ATOM 971 CB ASP A 61 11.697 11.340 -9.506 1.00 0.00 C ATOM 972 CG ASP A 61 13.033 11.797 -8.940 1.00 0.00 C ATOM 973 OD1 ASP A 61 13.761 12.530 -9.641 1.00 0.00 O ATOM 974 OD2 ASP A 61 13.336 11.438 -7.782 1.00 0.00 O ATOM 0 H ASP A 61 11.589 12.121 -11.797 1.00 0.00 H new ATOM 0 HA ASP A 61 9.718 12.199 -9.768 1.00 0.00 H new ATOM 0 HB2 ASP A 61 11.194 10.721 -8.763 1.00 0.00 H new ATOM 0 HB3 ASP A 61 11.881 10.708 -10.375 1.00 0.00 H new ATOM 979 N ARG A 62 11.722 14.686 -9.576 1.00 0.00 N ATOM 980 CA ARG A 62 11.911 16.014 -8.998 1.00 0.00 C ATOM 981 C ARG A 62 10.602 16.826 -8.900 1.00 0.00 C ATOM 982 O ARG A 62 10.603 17.903 -8.309 1.00 0.00 O ATOM 983 CB ARG A 62 12.997 16.711 -9.826 1.00 0.00 C ATOM 984 CG ARG A 62 13.632 17.949 -9.186 1.00 0.00 C ATOM 985 CD ARG A 62 14.846 18.371 -10.027 1.00 0.00 C ATOM 986 NE ARG A 62 15.901 17.337 -10.032 1.00 0.00 N ATOM 987 CZ ARG A 62 16.885 17.195 -9.134 1.00 0.00 C ATOM 988 NH1 ARG A 62 16.993 18.040 -8.103 1.00 0.00 N ATOM 989 NH2 ARG A 62 17.748 16.189 -9.283 1.00 0.00 N ATOM 0 H ARG A 62 12.192 14.578 -10.475 1.00 0.00 H new ATOM 0 HA ARG A 62 12.231 15.929 -7.960 1.00 0.00 H new ATOM 0 HB2 ARG A 62 13.786 15.989 -10.037 1.00 0.00 H new ATOM 0 HB3 ARG A 62 12.566 17.001 -10.784 1.00 0.00 H new ATOM 0 HG2 ARG A 62 12.907 18.762 -9.135 1.00 0.00 H new ATOM 0 HG3 ARG A 62 13.939 17.730 -8.163 1.00 0.00 H new ATOM 0 HD2 ARG A 62 14.527 18.569 -11.050 1.00 0.00 H new ATOM 0 HD3 ARG A 62 15.253 19.303 -9.634 1.00 0.00 H new ATOM 0 HE ARG A 62 15.878 16.663 -10.797 1.00 0.00 H new ATOM 0 HH11 ARG A 62 16.323 18.801 -7.995 1.00 0.00 H new ATOM 0 HH12 ARG A 62 17.746 17.923 -7.425 1.00 0.00 H new ATOM 0 HH21 ARG A 62 17.651 15.546 -10.069 1.00 0.00 H new ATOM 0 HH22 ARG A 62 18.505 16.062 -8.611 1.00 0.00 H new ATOM 1003 N ASN A 63 9.500 16.310 -9.460 1.00 0.00 N ATOM 1004 CA ASN A 63 8.201 16.946 -9.657 1.00 0.00 C ATOM 1005 C ASN A 63 7.795 18.021 -8.649 1.00 0.00 C ATOM 1006 O ASN A 63 7.725 19.192 -9.016 1.00 0.00 O ATOM 1007 CB ASN A 63 7.117 15.859 -9.758 1.00 0.00 C ATOM 1008 CG ASN A 63 5.703 16.434 -9.789 1.00 0.00 C ATOM 1009 OD1 ASN A 63 4.879 16.112 -8.941 1.00 0.00 O ATOM 1010 ND2 ASN A 63 5.405 17.288 -10.764 1.00 0.00 N ATOM 0 H ASN A 63 9.500 15.354 -9.816 1.00 0.00 H new ATOM 0 HA ASN A 63 8.303 17.506 -10.587 1.00 0.00 H new ATOM 0 HB2 ASN A 63 7.284 15.269 -10.659 1.00 0.00 H new ATOM 0 HB3 ASN A 63 7.210 15.180 -8.910 1.00 0.00 H new ATOM 0 HD21 ASN A 63 4.470 17.693 -10.819 1.00 0.00 H new ATOM 0 HD22 ASN A 63 6.111 17.538 -11.456 1.00 0.00 H new ATOM 1017 N LYS A 64 7.433 17.625 -7.428 1.00 0.00 N ATOM 1018 CA LYS A 64 6.817 18.514 -6.455 1.00 0.00 C ATOM 1019 C LYS A 64 7.562 18.389 -5.136 1.00 0.00 C ATOM 1020 O LYS A 64 7.819 17.271 -4.685 1.00 0.00 O ATOM 1021 CB LYS A 64 5.315 18.214 -6.327 1.00 0.00 C ATOM 1022 CG LYS A 64 5.001 16.856 -5.679 1.00 0.00 C ATOM 1023 CD LYS A 64 4.739 17.009 -4.170 1.00 0.00 C ATOM 1024 CE LYS A 64 4.773 15.650 -3.463 1.00 0.00 C ATOM 1025 NZ LYS A 64 6.148 15.178 -3.185 1.00 0.00 N ATOM 0 H LYS A 64 7.562 16.672 -7.089 1.00 0.00 H new ATOM 0 HA LYS A 64 6.891 19.550 -6.784 1.00 0.00 H new ATOM 0 HB2 LYS A 64 4.846 19.003 -5.738 1.00 0.00 H new ATOM 0 HB3 LYS A 64 4.863 18.245 -7.318 1.00 0.00 H new ATOM 0 HG2 LYS A 64 4.129 16.413 -6.160 1.00 0.00 H new ATOM 0 HG3 LYS A 64 5.834 16.172 -5.839 1.00 0.00 H new ATOM 0 HD2 LYS A 64 5.489 17.669 -3.733 1.00 0.00 H new ATOM 0 HD3 LYS A 64 3.769 17.480 -4.012 1.00 0.00 H new ATOM 0 HE2 LYS A 64 4.222 15.721 -2.525 1.00 0.00 H new ATOM 0 HE3 LYS A 64 4.259 14.913 -4.080 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 6.112 14.213 -2.800 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 6.700 15.179 -4.066 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 6.599 15.810 -2.493 1.00 0.00 H new ATOM 1039 N ASP A 65 7.919 19.543 -4.567 1.00 0.00 N ATOM 1040 CA ASP A 65 8.650 19.781 -3.327 1.00 0.00 C ATOM 1041 C ASP A 65 10.103 19.301 -3.372 1.00 0.00 C ATOM 1042 O ASP A 65 10.992 20.081 -3.037 1.00 0.00 O ATOM 1043 CB ASP A 65 7.876 19.350 -2.069 1.00 0.00 C ATOM 1044 CG ASP A 65 8.068 17.894 -1.673 1.00 0.00 C ATOM 1045 OD1 ASP A 65 9.205 17.544 -1.288 1.00 0.00 O ATOM 1046 OD2 ASP A 65 7.072 17.145 -1.764 1.00 0.00 O ATOM 0 H ASP A 65 7.675 20.426 -5.015 1.00 0.00 H new ATOM 0 HA ASP A 65 8.729 20.865 -3.239 1.00 0.00 H new ATOM 0 HB2 ASP A 65 8.182 19.983 -1.236 1.00 0.00 H new ATOM 0 HB3 ASP A 65 6.814 19.531 -2.233 1.00 0.00 H new ATOM 1051 N GLN A 66 10.322 18.061 -3.823 1.00 0.00 N ATOM 1052 CA GLN A 66 11.550 17.275 -3.782 1.00 0.00 C ATOM 1053 C GLN A 66 11.193 15.801 -3.606 1.00 0.00 C ATOM 1054 O GLN A 66 11.662 14.959 -4.372 1.00 0.00 O ATOM 1055 CB GLN A 66 12.555 17.775 -2.720 1.00 0.00 C ATOM 1056 CG GLN A 66 13.837 16.940 -2.574 1.00 0.00 C ATOM 1057 CD GLN A 66 13.656 15.623 -1.829 1.00 0.00 C ATOM 1058 OE1 GLN A 66 14.111 14.585 -2.295 1.00 0.00 O ATOM 1059 NE2 GLN A 66 13.008 15.643 -0.669 1.00 0.00 N ATOM 0 H GLN A 66 9.569 17.537 -4.268 1.00 0.00 H new ATOM 0 HA GLN A 66 12.071 17.401 -4.731 1.00 0.00 H new ATOM 0 HB2 GLN A 66 12.836 18.799 -2.965 1.00 0.00 H new ATOM 0 HB3 GLN A 66 12.051 17.805 -1.754 1.00 0.00 H new ATOM 0 HG2 GLN A 66 14.232 16.729 -3.568 1.00 0.00 H new ATOM 0 HG3 GLN A 66 14.586 17.537 -2.053 1.00 0.00 H new ATOM 0 HE21 GLN A 66 12.640 16.522 -0.306 1.00 0.00 H new ATOM 0 HE22 GLN A 66 12.879 14.779 -0.142 1.00 0.00 H new ATOM 1068 N GLU A 67 10.421 15.478 -2.573 1.00 0.00 N ATOM 1069 CA GLU A 67 10.192 14.086 -2.203 1.00 0.00 C ATOM 1070 C GLU A 67 9.176 13.396 -3.113 1.00 0.00 C ATOM 1071 O GLU A 67 8.465 14.030 -3.898 1.00 0.00 O ATOM 1072 CB GLU A 67 9.885 13.898 -0.707 1.00 0.00 C ATOM 1073 CG GLU A 67 8.454 14.252 -0.281 1.00 0.00 C ATOM 1074 CD GLU A 67 8.080 13.626 1.057 1.00 0.00 C ATOM 1075 OE1 GLU A 67 8.994 13.127 1.754 1.00 0.00 O ATOM 1076 OE2 GLU A 67 6.861 13.598 1.331 1.00 0.00 O ATOM 0 H GLU A 67 9.945 16.158 -1.980 1.00 0.00 H new ATOM 0 HA GLU A 67 11.141 13.575 -2.368 1.00 0.00 H new ATOM 0 HB2 GLU A 67 10.079 12.859 -0.441 1.00 0.00 H new ATOM 0 HB3 GLU A 67 10.580 14.509 -0.131 1.00 0.00 H new ATOM 0 HG2 GLU A 67 8.354 15.335 -0.214 1.00 0.00 H new ATOM 0 HG3 GLU A 67 7.755 13.914 -1.046 1.00 0.00 H new ATOM 1083 N VAL A 68 9.138 12.069 -2.987 1.00 0.00 N ATOM 1084 CA VAL A 68 8.399 11.143 -3.818 1.00 0.00 C ATOM 1085 C VAL A 68 7.805 10.062 -2.908 1.00 0.00 C ATOM 1086 O VAL A 68 8.438 9.062 -2.561 1.00 0.00 O ATOM 1087 CB VAL A 68 9.343 10.542 -4.864 1.00 0.00 C ATOM 1088 CG1 VAL A 68 8.649 9.557 -5.812 1.00 0.00 C ATOM 1089 CG2 VAL A 68 10.041 11.615 -5.707 1.00 0.00 C ATOM 0 H VAL A 68 9.659 11.591 -2.252 1.00 0.00 H new ATOM 0 HA VAL A 68 7.590 11.644 -4.349 1.00 0.00 H new ATOM 0 HB VAL A 68 10.084 9.999 -4.278 1.00 0.00 H new ATOM 0 HG11 VAL A 68 9.374 9.168 -6.527 1.00 0.00 H new ATOM 0 HG12 VAL A 68 8.229 8.732 -5.236 1.00 0.00 H new ATOM 0 HG13 VAL A 68 7.850 10.069 -6.347 1.00 0.00 H new ATOM 0 HG21 VAL A 68 10.699 11.137 -6.433 1.00 0.00 H new ATOM 0 HG22 VAL A 68 9.293 12.209 -6.232 1.00 0.00 H new ATOM 0 HG23 VAL A 68 10.629 12.263 -5.057 1.00 0.00 H new ATOM 1099 N ASN A 69 6.564 10.284 -2.507 1.00 0.00 N ATOM 1100 CA ASN A 69 5.718 9.303 -1.844 1.00 0.00 C ATOM 1101 C ASN A 69 5.158 8.347 -2.902 1.00 0.00 C ATOM 1102 O ASN A 69 5.496 8.428 -4.087 1.00 0.00 O ATOM 1103 CB ASN A 69 4.575 9.963 -1.051 1.00 0.00 C ATOM 1104 CG ASN A 69 5.042 10.971 -0.013 1.00 0.00 C ATOM 1105 OD1 ASN A 69 5.036 10.657 1.173 1.00 0.00 O ATOM 1106 ND2 ASN A 69 5.429 12.167 -0.436 1.00 0.00 N ATOM 0 H ASN A 69 6.101 11.183 -2.638 1.00 0.00 H new ATOM 0 HA ASN A 69 6.321 8.754 -1.121 1.00 0.00 H new ATOM 0 HB2 ASN A 69 3.903 10.462 -1.750 1.00 0.00 H new ATOM 0 HB3 ASN A 69 3.997 9.185 -0.552 1.00 0.00 H new ATOM 0 HD21 ASN A 69 5.738 12.870 0.235 1.00 0.00 H new ATOM 0 HD22 ASN A 69 5.417 12.384 -1.433 1.00 0.00 H new ATOM 1113 N PHE A 70 4.292 7.424 -2.472 1.00 0.00 N ATOM 1114 CA PHE A 70 3.706 6.422 -3.349 1.00 0.00 C ATOM 1115 C PHE A 70 2.942 7.085 -4.493 1.00 0.00 C ATOM 1116 O PHE A 70 3.063 6.640 -5.627 1.00 0.00 O ATOM 1117 CB PHE A 70 2.794 5.486 -2.552 1.00 0.00 C ATOM 1118 CG PHE A 70 2.332 4.241 -3.285 1.00 0.00 C ATOM 1119 CD1 PHE A 70 3.263 3.237 -3.605 1.00 0.00 C ATOM 1120 CD2 PHE A 70 0.961 4.010 -3.503 1.00 0.00 C ATOM 1121 CE1 PHE A 70 2.827 1.996 -4.101 1.00 0.00 C ATOM 1122 CE2 PHE A 70 0.527 2.781 -4.034 1.00 0.00 C ATOM 1123 CZ PHE A 70 1.458 1.771 -4.324 1.00 0.00 C ATOM 0 H PHE A 70 3.981 7.356 -1.503 1.00 0.00 H new ATOM 0 HA PHE A 70 4.511 5.829 -3.783 1.00 0.00 H new ATOM 0 HB2 PHE A 70 3.319 5.180 -1.647 1.00 0.00 H new ATOM 0 HB3 PHE A 70 1.915 6.047 -2.236 1.00 0.00 H new ATOM 0 HD1 PHE A 70 4.319 3.420 -3.469 1.00 0.00 H new ATOM 0 HD2 PHE A 70 0.240 4.778 -3.262 1.00 0.00 H new ATOM 0 HE1 PHE A 70 3.544 1.216 -4.311 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -0.524 2.615 -4.219 1.00 0.00 H new ATOM 0 HZ PHE A 70 1.123 0.823 -4.718 1.00 0.00 H new ATOM 1133 N GLN A 71 2.173 8.147 -4.210 1.00 0.00 N ATOM 1134 CA GLN A 71 1.443 8.874 -5.244 1.00 0.00 C ATOM 1135 C GLN A 71 2.397 9.302 -6.353 1.00 0.00 C ATOM 1136 O GLN A 71 2.176 8.951 -7.507 1.00 0.00 O ATOM 1137 CB GLN A 71 0.661 10.058 -4.650 1.00 0.00 C ATOM 1138 CG GLN A 71 -0.010 10.958 -5.704 1.00 0.00 C ATOM 1139 CD GLN A 71 0.869 12.119 -6.172 1.00 0.00 C ATOM 1140 OE1 GLN A 71 1.145 13.037 -5.408 1.00 0.00 O ATOM 1141 NE2 GLN A 71 1.287 12.131 -7.435 1.00 0.00 N ATOM 0 H GLN A 71 2.044 8.518 -3.269 1.00 0.00 H new ATOM 0 HA GLN A 71 0.700 8.210 -5.685 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -0.104 9.673 -3.976 1.00 0.00 H new ATOM 0 HB3 GLN A 71 1.340 10.664 -4.049 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -0.283 10.350 -6.567 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -0.935 11.359 -5.290 1.00 0.00 H new ATOM 0 HE21 GLN A 71 1.049 11.360 -8.058 1.00 0.00 H new ATOM 0 HE22 GLN A 71 1.846 12.912 -7.780 1.00 0.00 H new ATOM 1150 N GLU A 72 3.443 10.052 -6.018 1.00 0.00 N ATOM 1151 CA GLU A 72 4.422 10.553 -6.965 1.00 0.00 C ATOM 1152 C GLU A 72 5.057 9.396 -7.740 1.00 0.00 C ATOM 1153 O GLU A 72 5.006 9.380 -8.972 1.00 0.00 O ATOM 1154 CB GLU A 72 5.486 11.374 -6.229 1.00 0.00 C ATOM 1155 CG GLU A 72 4.929 12.580 -5.453 1.00 0.00 C ATOM 1156 CD GLU A 72 4.621 12.235 -4.004 1.00 0.00 C ATOM 1157 OE1 GLU A 72 3.659 11.475 -3.790 1.00 0.00 O ATOM 1158 OE2 GLU A 72 5.402 12.671 -3.123 1.00 0.00 O ATOM 0 H GLU A 72 3.634 10.332 -5.056 1.00 0.00 H new ATOM 0 HA GLU A 72 3.923 11.202 -7.684 1.00 0.00 H new ATOM 0 HB2 GLU A 72 6.015 10.722 -5.534 1.00 0.00 H new ATOM 0 HB3 GLU A 72 6.219 11.730 -6.953 1.00 0.00 H new ATOM 0 HG2 GLU A 72 5.651 13.396 -5.485 1.00 0.00 H new ATOM 0 HG3 GLU A 72 4.022 12.937 -5.941 1.00 0.00 H new ATOM 1165 N TYR A 73 5.640 8.428 -7.018 1.00 0.00 N ATOM 1166 CA TYR A 73 6.262 7.241 -7.606 1.00 0.00 C ATOM 1167 C TYR A 73 5.315 6.602 -8.623 1.00 0.00 C ATOM 1168 O TYR A 73 5.693 6.354 -9.770 1.00 0.00 O ATOM 1169 CB TYR A 73 6.676 6.260 -6.492 1.00 0.00 C ATOM 1170 CG TYR A 73 6.574 4.778 -6.818 1.00 0.00 C ATOM 1171 CD1 TYR A 73 7.619 4.096 -7.471 1.00 0.00 C ATOM 1172 CD2 TYR A 73 5.417 4.071 -6.447 1.00 0.00 C ATOM 1173 CE1 TYR A 73 7.524 2.708 -7.684 1.00 0.00 C ATOM 1174 CE2 TYR A 73 5.323 2.689 -6.656 1.00 0.00 C ATOM 1175 CZ TYR A 73 6.394 2.007 -7.235 1.00 0.00 C ATOM 1176 OH TYR A 73 6.357 0.653 -7.260 1.00 0.00 O ATOM 0 H TYR A 73 5.691 8.451 -6.000 1.00 0.00 H new ATOM 0 HA TYR A 73 7.167 7.525 -8.143 1.00 0.00 H new ATOM 0 HB2 TYR A 73 7.707 6.477 -6.212 1.00 0.00 H new ATOM 0 HB3 TYR A 73 6.059 6.459 -5.616 1.00 0.00 H new ATOM 0 HD1 TYR A 73 8.491 4.637 -7.808 1.00 0.00 H new ATOM 0 HD2 TYR A 73 4.591 4.600 -5.995 1.00 0.00 H new ATOM 0 HE1 TYR A 73 8.319 2.183 -8.192 1.00 0.00 H new ATOM 0 HE2 TYR A 73 4.428 2.155 -6.371 1.00 0.00 H new ATOM 0 HH TYR A 73 5.905 0.323 -6.455 1.00 0.00 H new ATOM 1186 N ILE A 74 4.077 6.351 -8.203 1.00 0.00 N ATOM 1187 CA ILE A 74 3.086 5.720 -9.046 1.00 0.00 C ATOM 1188 C ILE A 74 2.796 6.604 -10.259 1.00 0.00 C ATOM 1189 O ILE A 74 2.820 6.123 -11.384 1.00 0.00 O ATOM 1190 CB ILE A 74 1.791 5.433 -8.255 1.00 0.00 C ATOM 1191 CG1 ILE A 74 1.811 4.127 -7.441 1.00 0.00 C ATOM 1192 CG2 ILE A 74 0.605 5.381 -9.208 1.00 0.00 C ATOM 1193 CD1 ILE A 74 1.808 2.856 -8.298 1.00 0.00 C ATOM 0 H ILE A 74 3.741 6.582 -7.268 1.00 0.00 H new ATOM 0 HA ILE A 74 3.481 4.765 -9.393 1.00 0.00 H new ATOM 0 HB ILE A 74 1.706 6.251 -7.540 1.00 0.00 H new ATOM 0 HG12 ILE A 74 2.696 4.121 -6.805 1.00 0.00 H new ATOM 0 HG13 ILE A 74 0.944 4.109 -6.781 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -0.306 5.178 -8.645 1.00 0.00 H new ATOM 0 HG22 ILE A 74 0.509 6.338 -9.722 1.00 0.00 H new ATOM 0 HG23 ILE A 74 0.762 4.590 -9.941 1.00 0.00 H new ATOM 0 HD11 ILE A 74 1.823 1.980 -7.650 1.00 0.00 H new ATOM 0 HD12 ILE A 74 0.910 2.835 -8.915 1.00 0.00 H new ATOM 0 HD13 ILE A 74 2.689 2.848 -8.939 1.00 0.00 H new ATOM 1205 N THR A 75 2.458 7.874 -10.028 1.00 0.00 N ATOM 1206 CA THR A 75 2.059 8.826 -11.062 1.00 0.00 C ATOM 1207 C THR A 75 3.101 8.812 -12.169 1.00 0.00 C ATOM 1208 O THR A 75 2.791 8.693 -13.351 1.00 0.00 O ATOM 1209 CB THR A 75 1.936 10.226 -10.440 1.00 0.00 C ATOM 1210 OG1 THR A 75 0.898 10.208 -9.482 1.00 0.00 O ATOM 1211 CG2 THR A 75 1.648 11.313 -11.481 1.00 0.00 C ATOM 0 H THR A 75 2.455 8.278 -9.091 1.00 0.00 H new ATOM 0 HA THR A 75 1.093 8.551 -11.485 1.00 0.00 H new ATOM 0 HB THR A 75 2.893 10.469 -9.979 1.00 0.00 H new ATOM 0 HG1 THR A 75 1.147 9.617 -8.741 1.00 0.00 H new ATOM 0 HG21 THR A 75 1.571 12.281 -10.985 1.00 0.00 H new ATOM 0 HG22 THR A 75 2.458 11.342 -12.210 1.00 0.00 H new ATOM 0 HG23 THR A 75 0.710 11.091 -11.989 1.00 0.00 H new ATOM 1219 N PHE A 76 4.354 8.915 -11.741 1.00 0.00 N ATOM 1220 CA PHE A 76 5.521 8.855 -12.584 1.00 0.00 C ATOM 1221 C PHE A 76 5.588 7.541 -13.364 1.00 0.00 C ATOM 1222 O PHE A 76 5.578 7.559 -14.597 1.00 0.00 O ATOM 1223 CB PHE A 76 6.706 9.059 -11.644 1.00 0.00 C ATOM 1224 CG PHE A 76 8.062 8.738 -12.202 1.00 0.00 C ATOM 1225 CD1 PHE A 76 8.699 9.692 -13.005 1.00 0.00 C ATOM 1226 CD2 PHE A 76 8.790 7.664 -11.662 1.00 0.00 C ATOM 1227 CE1 PHE A 76 10.097 9.704 -13.081 1.00 0.00 C ATOM 1228 CE2 PHE A 76 10.197 7.684 -11.727 1.00 0.00 C ATOM 1229 CZ PHE A 76 10.853 8.774 -12.343 1.00 0.00 C ATOM 0 H PHE A 76 4.583 9.048 -10.756 1.00 0.00 H new ATOM 0 HA PHE A 76 5.509 9.622 -13.359 1.00 0.00 H new ATOM 0 HB2 PHE A 76 6.708 10.099 -11.317 1.00 0.00 H new ATOM 0 HB3 PHE A 76 6.548 8.446 -10.756 1.00 0.00 H new ATOM 0 HD1 PHE A 76 8.117 10.412 -13.561 1.00 0.00 H new ATOM 0 HD2 PHE A 76 8.276 6.833 -11.202 1.00 0.00 H new ATOM 0 HE1 PHE A 76 10.596 10.428 -13.707 1.00 0.00 H new ATOM 0 HE2 PHE A 76 10.771 6.871 -11.308 1.00 0.00 H new ATOM 0 HZ PHE A 76 11.922 8.892 -12.248 1.00 0.00 H new ATOM 1239 N LEU A 77 5.647 6.400 -12.664 1.00 0.00 N ATOM 1240 CA LEU A 77 5.782 5.111 -13.334 1.00 0.00 C ATOM 1241 C LEU A 77 4.644 4.924 -14.341 1.00 0.00 C ATOM 1242 O LEU A 77 4.863 4.495 -15.469 1.00 0.00 O ATOM 1243 CB LEU A 77 5.962 3.968 -12.313 1.00 0.00 C ATOM 1244 CG LEU A 77 4.733 3.130 -11.918 1.00 0.00 C ATOM 1245 CD1 LEU A 77 4.400 2.033 -12.943 1.00 0.00 C ATOM 1246 CD2 LEU A 77 5.050 2.432 -10.591 1.00 0.00 C ATOM 0 H LEU A 77 5.604 6.348 -11.646 1.00 0.00 H new ATOM 0 HA LEU A 77 6.698 5.085 -13.924 1.00 0.00 H new ATOM 0 HB2 LEU A 77 6.714 3.286 -12.710 1.00 0.00 H new ATOM 0 HB3 LEU A 77 6.374 4.401 -11.401 1.00 0.00 H new ATOM 0 HG LEU A 77 3.880 3.805 -11.856 1.00 0.00 H new ATOM 0 HD11 LEU A 77 3.524 1.476 -12.609 1.00 0.00 H new ATOM 0 HD12 LEU A 77 4.192 2.490 -13.910 1.00 0.00 H new ATOM 0 HD13 LEU A 77 5.247 1.354 -13.037 1.00 0.00 H new ATOM 0 HD21 LEU A 77 4.196 1.829 -10.284 1.00 0.00 H new ATOM 0 HD22 LEU A 77 5.921 1.789 -10.717 1.00 0.00 H new ATOM 0 HD23 LEU A 77 5.259 3.181 -9.827 1.00 0.00 H new ATOM 1258 N GLY A 78 3.430 5.300 -13.948 1.00 0.00 N ATOM 1259 CA GLY A 78 2.243 5.253 -14.776 1.00 0.00 C ATOM 1260 C GLY A 78 2.317 6.170 -15.995 1.00 0.00 C ATOM 1261 O GLY A 78 1.956 5.754 -17.099 1.00 0.00 O ATOM 0 H GLY A 78 3.246 5.657 -13.010 1.00 0.00 H new ATOM 0 HA2 GLY A 78 2.083 4.228 -15.111 1.00 0.00 H new ATOM 0 HA3 GLY A 78 1.378 5.530 -14.174 1.00 0.00 H new ATOM 1265 N ALA A 79 2.775 7.416 -15.820 1.00 0.00 N ATOM 1266 CA ALA A 79 2.983 8.318 -16.943 1.00 0.00 C ATOM 1267 C ALA A 79 3.910 7.657 -17.963 1.00 0.00 C ATOM 1268 O ALA A 79 3.603 7.617 -19.153 1.00 0.00 O ATOM 1269 CB ALA A 79 3.541 9.656 -16.452 1.00 0.00 C ATOM 0 H ALA A 79 3.006 7.815 -14.910 1.00 0.00 H new ATOM 0 HA ALA A 79 2.031 8.523 -17.432 1.00 0.00 H new ATOM 0 HB1 ALA A 79 3.692 10.321 -17.302 1.00 0.00 H new ATOM 0 HB2 ALA A 79 2.836 10.111 -15.756 1.00 0.00 H new ATOM 0 HB3 ALA A 79 4.493 9.490 -15.948 1.00 0.00 H new ATOM 1275 N LEU A 80 5.024 7.093 -17.487 1.00 0.00 N ATOM 1276 CA LEU A 80 5.925 6.330 -18.342 1.00 0.00 C ATOM 1277 C LEU A 80 5.203 5.115 -18.948 1.00 0.00 C ATOM 1278 O LEU A 80 5.374 4.816 -20.130 1.00 0.00 O ATOM 1279 CB LEU A 80 7.187 5.928 -17.563 1.00 0.00 C ATOM 1280 CG LEU A 80 8.003 7.120 -17.026 1.00 0.00 C ATOM 1281 CD1 LEU A 80 9.086 6.607 -16.068 1.00 0.00 C ATOM 1282 CD2 LEU A 80 8.668 7.914 -18.157 1.00 0.00 C ATOM 0 H LEU A 80 5.320 7.153 -16.513 1.00 0.00 H new ATOM 0 HA LEU A 80 6.242 6.959 -19.174 1.00 0.00 H new ATOM 0 HB2 LEU A 80 6.897 5.294 -16.725 1.00 0.00 H new ATOM 0 HB3 LEU A 80 7.825 5.328 -18.211 1.00 0.00 H new ATOM 0 HG LEU A 80 7.315 7.786 -16.505 1.00 0.00 H new ATOM 0 HD11 LEU A 80 9.664 7.449 -15.688 1.00 0.00 H new ATOM 0 HD12 LEU A 80 8.617 6.083 -15.235 1.00 0.00 H new ATOM 0 HD13 LEU A 80 9.748 5.924 -16.600 1.00 0.00 H new ATOM 0 HD21 LEU A 80 9.233 8.745 -17.735 1.00 0.00 H new ATOM 0 HD22 LEU A 80 9.342 7.262 -18.712 1.00 0.00 H new ATOM 0 HD23 LEU A 80 7.902 8.300 -18.829 1.00 0.00 H new ATOM 1294 N ALA A 81 4.373 4.418 -18.166 1.00 0.00 N ATOM 1295 CA ALA A 81 3.644 3.238 -18.612 1.00 0.00 C ATOM 1296 C ALA A 81 2.746 3.520 -19.809 1.00 0.00 C ATOM 1297 O ALA A 81 2.740 2.737 -20.756 1.00 0.00 O ATOM 1298 CB ALA A 81 2.863 2.587 -17.469 1.00 0.00 C ATOM 0 H ALA A 81 4.190 4.665 -17.193 1.00 0.00 H new ATOM 0 HA ALA A 81 4.396 2.524 -18.947 1.00 0.00 H new ATOM 0 HB1 ALA A 81 2.333 1.711 -17.843 1.00 0.00 H new ATOM 0 HB2 ALA A 81 3.554 2.285 -16.682 1.00 0.00 H new ATOM 0 HB3 ALA A 81 2.144 3.301 -17.066 1.00 0.00 H new ATOM 1304 N MET A 82 2.022 4.643 -19.807 1.00 0.00 N ATOM 1305 CA MET A 82 1.257 5.032 -20.989 1.00 0.00 C ATOM 1306 C MET A 82 2.129 5.164 -22.242 1.00 0.00 C ATOM 1307 O MET A 82 1.572 5.148 -23.339 1.00 0.00 O ATOM 1308 CB MET A 82 0.457 6.317 -20.749 1.00 0.00 C ATOM 1309 CG MET A 82 -0.885 6.059 -20.049 1.00 0.00 C ATOM 1310 SD MET A 82 -2.013 7.478 -20.038 1.00 0.00 S ATOM 1311 CE MET A 82 -0.977 8.709 -19.224 1.00 0.00 C ATOM 0 H MET A 82 1.951 5.285 -19.017 1.00 0.00 H new ATOM 0 HA MET A 82 0.553 4.220 -21.172 1.00 0.00 H new ATOM 0 HB2 MET A 82 1.051 7.002 -20.145 1.00 0.00 H new ATOM 0 HB3 MET A 82 0.275 6.810 -21.704 1.00 0.00 H new ATOM 0 HG2 MET A 82 -1.381 5.221 -20.539 1.00 0.00 H new ATOM 0 HG3 MET A 82 -0.691 5.757 -19.020 1.00 0.00 H new ATOM 0 HE1 MET A 82 -1.573 9.592 -18.994 1.00 0.00 H new ATOM 0 HE2 MET A 82 -0.574 8.293 -18.301 1.00 0.00 H new ATOM 0 HE3 MET A 82 -0.156 8.988 -19.885 1.00 0.00 H new ATOM 1321 N ILE A 83 3.453 5.307 -22.111 1.00 0.00 N ATOM 1322 CA ILE A 83 4.375 5.222 -23.234 1.00 0.00 C ATOM 1323 C ILE A 83 4.828 3.767 -23.394 1.00 0.00 C ATOM 1324 O ILE A 83 4.437 3.109 -24.354 1.00 0.00 O ATOM 1325 CB ILE A 83 5.548 6.208 -23.068 1.00 0.00 C ATOM 1326 CG1 ILE A 83 5.083 7.636 -22.718 1.00 0.00 C ATOM 1327 CG2 ILE A 83 6.419 6.217 -24.333 1.00 0.00 C ATOM 1328 CD1 ILE A 83 4.101 8.251 -23.722 1.00 0.00 C ATOM 0 H ILE A 83 3.910 5.485 -21.217 1.00 0.00 H new ATOM 0 HA ILE A 83 3.872 5.521 -24.154 1.00 0.00 H new ATOM 0 HB ILE A 83 6.142 5.858 -22.224 1.00 0.00 H new ATOM 0 HG12 ILE A 83 4.614 7.621 -21.734 1.00 0.00 H new ATOM 0 HG13 ILE A 83 5.958 8.281 -22.644 1.00 0.00 H new ATOM 0 HG21 ILE A 83 7.244 6.918 -24.202 1.00 0.00 H new ATOM 0 HG22 ILE A 83 6.817 5.217 -24.508 1.00 0.00 H new ATOM 0 HG23 ILE A 83 5.816 6.522 -25.188 1.00 0.00 H new ATOM 0 HD11 ILE A 83 3.828 9.255 -23.396 1.00 0.00 H new ATOM 0 HD12 ILE A 83 4.570 8.303 -24.704 1.00 0.00 H new ATOM 0 HD13 ILE A 83 3.205 7.633 -23.780 1.00 0.00 H new ATOM 1340 N TYR A 84 5.649 3.234 -22.477 1.00 0.00 N ATOM 1341 CA TYR A 84 6.278 1.930 -22.708 1.00 0.00 C ATOM 1342 C TYR A 84 5.249 0.829 -22.976 1.00 0.00 C ATOM 1343 O TYR A 84 5.472 -0.047 -23.806 1.00 0.00 O ATOM 1344 CB TYR A 84 7.289 1.546 -21.611 1.00 0.00 C ATOM 1345 CG TYR A 84 6.825 1.558 -20.161 1.00 0.00 C ATOM 1346 CD1 TYR A 84 6.057 0.498 -19.634 1.00 0.00 C ATOM 1347 CD2 TYR A 84 7.378 2.504 -19.277 1.00 0.00 C ATOM 1348 CE1 TYR A 84 5.709 0.481 -18.271 1.00 0.00 C ATOM 1349 CE2 TYR A 84 7.139 2.410 -17.896 1.00 0.00 C ATOM 1350 CZ TYR A 84 6.284 1.416 -17.396 1.00 0.00 C ATOM 1351 OH TYR A 84 6.092 1.305 -16.054 1.00 0.00 O ATOM 0 H TYR A 84 5.888 3.675 -21.589 1.00 0.00 H new ATOM 0 HA TYR A 84 6.863 2.034 -23.622 1.00 0.00 H new ATOM 0 HB2 TYR A 84 7.656 0.544 -21.834 1.00 0.00 H new ATOM 0 HB3 TYR A 84 8.140 2.222 -21.693 1.00 0.00 H new ATOM 0 HD1 TYR A 84 5.735 -0.305 -20.281 1.00 0.00 H new ATOM 0 HD2 TYR A 84 7.989 3.306 -19.663 1.00 0.00 H new ATOM 0 HE1 TYR A 84 5.003 -0.247 -17.900 1.00 0.00 H new ATOM 0 HE2 TYR A 84 7.614 3.104 -17.218 1.00 0.00 H new ATOM 0 HH TYR A 84 6.960 1.296 -15.599 1.00 0.00 H new ATOM 1361 N ASN A 85 4.126 0.878 -22.263 1.00 0.00 N ATOM 1362 CA ASN A 85 3.015 -0.054 -22.367 1.00 0.00 C ATOM 1363 C ASN A 85 1.913 0.418 -23.339 1.00 0.00 C ATOM 1364 O ASN A 85 0.761 0.050 -23.125 1.00 0.00 O ATOM 1365 CB ASN A 85 2.527 -0.412 -20.953 1.00 0.00 C ATOM 1366 CG ASN A 85 1.987 -1.838 -20.839 1.00 0.00 C ATOM 1367 OD1 ASN A 85 2.454 -2.609 -20.009 1.00 0.00 O ATOM 1368 ND2 ASN A 85 1.006 -2.216 -21.650 1.00 0.00 N ATOM 0 H ASN A 85 3.962 1.604 -21.566 1.00 0.00 H new ATOM 0 HA ASN A 85 3.360 -0.977 -22.834 1.00 0.00 H new ATOM 0 HB2 ASN A 85 3.350 -0.286 -20.250 1.00 0.00 H new ATOM 0 HB3 ASN A 85 1.746 0.289 -20.658 1.00 0.00 H new ATOM 0 HD21 ASN A 85 0.629 -3.162 -21.588 1.00 0.00 H new ATOM 0 HD22 ASN A 85 0.629 -1.561 -22.335 1.00 0.00 H new ATOM 1375 N GLU A 86 2.222 1.253 -24.351 1.00 0.00 N ATOM 1376 CA GLU A 86 1.318 1.984 -25.264 1.00 0.00 C ATOM 1377 C GLU A 86 -0.154 1.528 -25.344 1.00 0.00 C ATOM 1378 O GLU A 86 -1.060 2.365 -25.333 1.00 0.00 O ATOM 1379 CB GLU A 86 1.894 1.943 -26.701 1.00 0.00 C ATOM 1380 CG GLU A 86 2.621 3.219 -27.154 1.00 0.00 C ATOM 1381 CD GLU A 86 1.755 4.465 -27.044 1.00 0.00 C ATOM 1382 OE1 GLU A 86 0.510 4.336 -26.989 1.00 0.00 O ATOM 1383 OE2 GLU A 86 2.312 5.574 -26.888 1.00 0.00 O ATOM 0 H GLU A 86 3.198 1.451 -24.571 1.00 0.00 H new ATOM 0 HA GLU A 86 1.282 2.980 -24.822 1.00 0.00 H new ATOM 0 HB2 GLU A 86 2.587 1.105 -26.773 1.00 0.00 H new ATOM 0 HB3 GLU A 86 1.078 1.743 -27.396 1.00 0.00 H new ATOM 0 HG2 GLU A 86 3.519 3.353 -26.551 1.00 0.00 H new ATOM 0 HG3 GLU A 86 2.946 3.099 -28.188 1.00 0.00 H new ATOM 1552 N ALA B 8 1.181 -7.271 -12.595 1.00 0.00 N ATOM 1553 CA ALA B 8 0.430 -6.290 -11.824 1.00 0.00 C ATOM 1554 C ALA B 8 0.089 -5.089 -12.700 1.00 0.00 C ATOM 1555 O ALA B 8 -1.059 -4.647 -12.719 1.00 0.00 O ATOM 1556 CB ALA B 8 1.217 -5.869 -10.581 1.00 0.00 C ATOM 0 HA ALA B 8 -0.504 -6.740 -11.487 1.00 0.00 H new ATOM 0 HB1 ALA B 8 0.641 -5.136 -10.017 1.00 0.00 H new ATOM 0 HB2 ALA B 8 1.404 -6.742 -9.956 1.00 0.00 H new ATOM 0 HB3 ALA B 8 2.167 -5.429 -10.884 1.00 0.00 H new ATOM 1562 N ILE B 9 1.078 -4.581 -13.442 1.00 0.00 N ATOM 1563 CA ILE B 9 0.852 -3.523 -14.422 1.00 0.00 C ATOM 1564 C ILE B 9 -0.279 -3.959 -15.365 1.00 0.00 C ATOM 1565 O ILE B 9 -1.256 -3.235 -15.542 1.00 0.00 O ATOM 1566 CB ILE B 9 2.176 -3.157 -15.134 1.00 0.00 C ATOM 1567 CG1 ILE B 9 2.982 -2.112 -14.336 1.00 0.00 C ATOM 1568 CG2 ILE B 9 1.946 -2.557 -16.526 1.00 0.00 C ATOM 1569 CD1 ILE B 9 3.422 -2.595 -12.955 1.00 0.00 C ATOM 0 H ILE B 9 2.048 -4.890 -13.379 1.00 0.00 H new ATOM 0 HA ILE B 9 0.525 -2.601 -13.941 1.00 0.00 H new ATOM 0 HB ILE B 9 2.722 -4.097 -15.213 1.00 0.00 H new ATOM 0 HG12 ILE B 9 3.865 -1.832 -14.911 1.00 0.00 H new ATOM 0 HG13 ILE B 9 2.378 -1.212 -14.220 1.00 0.00 H new ATOM 0 HG21 ILE B 9 2.907 -2.318 -16.982 1.00 0.00 H new ATOM 0 HG22 ILE B 9 1.417 -3.278 -17.150 1.00 0.00 H new ATOM 0 HG23 ILE B 9 1.350 -1.648 -16.437 1.00 0.00 H new ATOM 0 HD11 ILE B 9 3.983 -1.805 -12.455 1.00 0.00 H new ATOM 0 HD12 ILE B 9 2.544 -2.848 -12.361 1.00 0.00 H new ATOM 0 HD13 ILE B 9 4.054 -3.477 -13.062 1.00 0.00 H new ATOM 1581 N GLY B 10 -0.177 -5.168 -15.916 1.00 0.00 N ATOM 1582 CA GLY B 10 -1.184 -5.804 -16.748 1.00 0.00 C ATOM 1583 C GLY B 10 -2.570 -5.715 -16.116 1.00 0.00 C ATOM 1584 O GLY B 10 -3.492 -5.192 -16.737 1.00 0.00 O ATOM 0 H GLY B 10 0.649 -5.752 -15.786 1.00 0.00 H new ATOM 0 HA2 GLY B 10 -1.199 -5.329 -17.729 1.00 0.00 H new ATOM 0 HA3 GLY B 10 -0.921 -6.850 -16.904 1.00 0.00 H new ATOM 1588 N LEU B 11 -2.731 -6.206 -14.883 1.00 0.00 N ATOM 1589 CA LEU B 11 -4.019 -6.150 -14.199 1.00 0.00 C ATOM 1590 C LEU B 11 -4.507 -4.702 -14.080 1.00 0.00 C ATOM 1591 O LEU B 11 -5.653 -4.404 -14.417 1.00 0.00 O ATOM 1592 CB LEU B 11 -3.939 -6.834 -12.826 1.00 0.00 C ATOM 1593 CG LEU B 11 -5.285 -6.831 -12.073 1.00 0.00 C ATOM 1594 CD1 LEU B 11 -6.385 -7.582 -12.836 1.00 0.00 C ATOM 1595 CD2 LEU B 11 -5.111 -7.478 -10.697 1.00 0.00 C ATOM 0 H LEU B 11 -1.985 -6.645 -14.343 1.00 0.00 H new ATOM 0 HA LEU B 11 -4.750 -6.697 -14.795 1.00 0.00 H new ATOM 0 HB2 LEU B 11 -3.605 -7.863 -12.958 1.00 0.00 H new ATOM 0 HB3 LEU B 11 -3.188 -6.330 -12.218 1.00 0.00 H new ATOM 0 HG LEU B 11 -5.592 -5.790 -11.975 1.00 0.00 H new ATOM 0 HD11 LEU B 11 -7.312 -7.550 -12.263 1.00 0.00 H new ATOM 0 HD12 LEU B 11 -6.542 -7.110 -13.806 1.00 0.00 H new ATOM 0 HD13 LEU B 11 -6.084 -8.619 -12.981 1.00 0.00 H new ATOM 0 HD21 LEU B 11 -6.065 -7.473 -10.169 1.00 0.00 H new ATOM 0 HD22 LEU B 11 -4.769 -8.506 -10.819 1.00 0.00 H new ATOM 0 HD23 LEU B 11 -4.375 -6.916 -10.121 1.00 0.00 H new ATOM 1607 N LEU B 12 -3.643 -3.801 -13.608 1.00 0.00 N ATOM 1608 CA LEU B 12 -3.980 -2.394 -13.432 1.00 0.00 C ATOM 1609 C LEU B 12 -4.457 -1.769 -14.748 1.00 0.00 C ATOM 1610 O LEU B 12 -5.417 -0.993 -14.745 1.00 0.00 O ATOM 1611 CB LEU B 12 -2.786 -1.629 -12.842 1.00 0.00 C ATOM 1612 CG LEU B 12 -2.508 -2.012 -11.376 1.00 0.00 C ATOM 1613 CD1 LEU B 12 -1.087 -1.587 -10.989 1.00 0.00 C ATOM 1614 CD2 LEU B 12 -3.507 -1.342 -10.425 1.00 0.00 C ATOM 0 H LEU B 12 -2.687 -4.032 -13.337 1.00 0.00 H new ATOM 0 HA LEU B 12 -4.807 -2.323 -12.726 1.00 0.00 H new ATOM 0 HB2 LEU B 12 -1.898 -1.829 -13.441 1.00 0.00 H new ATOM 0 HB3 LEU B 12 -2.978 -0.558 -12.904 1.00 0.00 H new ATOM 0 HG LEU B 12 -2.615 -3.093 -11.287 1.00 0.00 H new ATOM 0 HD11 LEU B 12 -0.895 -1.860 -9.951 1.00 0.00 H new ATOM 0 HD12 LEU B 12 -0.368 -2.090 -11.635 1.00 0.00 H new ATOM 0 HD13 LEU B 12 -0.986 -0.508 -11.105 1.00 0.00 H new ATOM 0 HD21 LEU B 12 -3.283 -1.633 -9.399 1.00 0.00 H new ATOM 0 HD22 LEU B 12 -3.430 -0.259 -10.520 1.00 0.00 H new ATOM 0 HD23 LEU B 12 -4.519 -1.657 -10.679 1.00 0.00 H new ATOM 1626 N ILE B 13 -3.802 -2.104 -15.865 1.00 0.00 N ATOM 1627 CA ILE B 13 -4.213 -1.673 -17.195 1.00 0.00 C ATOM 1628 C ILE B 13 -5.546 -2.309 -17.566 1.00 0.00 C ATOM 1629 O ILE B 13 -6.419 -1.628 -18.094 1.00 0.00 O ATOM 1630 CB ILE B 13 -3.160 -2.012 -18.261 1.00 0.00 C ATOM 1631 CG1 ILE B 13 -1.856 -1.252 -17.983 1.00 0.00 C ATOM 1632 CG2 ILE B 13 -3.712 -1.652 -19.657 1.00 0.00 C ATOM 1633 CD1 ILE B 13 -0.680 -1.937 -18.680 1.00 0.00 C ATOM 0 H ILE B 13 -2.965 -2.687 -15.865 1.00 0.00 H new ATOM 0 HA ILE B 13 -4.320 -0.589 -17.166 1.00 0.00 H new ATOM 0 HB ILE B 13 -2.943 -3.080 -18.228 1.00 0.00 H new ATOM 0 HG12 ILE B 13 -1.945 -0.224 -18.333 1.00 0.00 H new ATOM 0 HG13 ILE B 13 -1.675 -1.208 -16.909 1.00 0.00 H new ATOM 0 HG21 ILE B 13 -2.967 -1.891 -20.416 1.00 0.00 H new ATOM 0 HG22 ILE B 13 -4.620 -2.223 -19.847 1.00 0.00 H new ATOM 0 HG23 ILE B 13 -3.939 -0.587 -19.695 1.00 0.00 H new ATOM 0 HD11 ILE B 13 0.237 -1.386 -18.473 1.00 0.00 H new ATOM 0 HD12 ILE B 13 -0.582 -2.957 -18.309 1.00 0.00 H new ATOM 0 HD13 ILE B 13 -0.856 -1.957 -19.755 1.00 0.00 H new ATOM 1645 N GLY B 14 -5.703 -3.612 -17.340 1.00 0.00 N ATOM 1646 CA GLY B 14 -6.922 -4.328 -17.668 1.00 0.00 C ATOM 1647 C GLY B 14 -8.114 -3.659 -16.995 1.00 0.00 C ATOM 1648 O GLY B 14 -9.071 -3.255 -17.658 1.00 0.00 O ATOM 0 H GLY B 14 -4.981 -4.199 -16.922 1.00 0.00 H new ATOM 0 HA2 GLY B 14 -7.065 -4.344 -18.748 1.00 0.00 H new ATOM 0 HA3 GLY B 14 -6.844 -5.365 -17.342 1.00 0.00 H new ATOM 1652 N ILE B 15 -8.042 -3.513 -15.669 1.00 0.00 N ATOM 1653 CA ILE B 15 -9.133 -2.937 -14.906 1.00 0.00 C ATOM 1654 C ILE B 15 -9.332 -1.467 -15.306 1.00 0.00 C ATOM 1655 O ILE B 15 -10.458 -1.084 -15.607 1.00 0.00 O ATOM 1656 CB ILE B 15 -8.962 -3.233 -13.400 1.00 0.00 C ATOM 1657 CG1 ILE B 15 -10.302 -3.265 -12.649 1.00 0.00 C ATOM 1658 CG2 ILE B 15 -8.018 -2.253 -12.707 1.00 0.00 C ATOM 1659 CD1 ILE B 15 -11.063 -4.574 -12.888 1.00 0.00 C ATOM 0 H ILE B 15 -7.235 -3.789 -15.109 1.00 0.00 H new ATOM 0 HA ILE B 15 -10.082 -3.413 -15.150 1.00 0.00 H new ATOM 0 HB ILE B 15 -8.516 -4.227 -13.360 1.00 0.00 H new ATOM 0 HG12 ILE B 15 -10.122 -3.140 -11.581 1.00 0.00 H new ATOM 0 HG13 ILE B 15 -10.917 -2.424 -12.969 1.00 0.00 H new ATOM 0 HG21 ILE B 15 -7.937 -2.511 -11.651 1.00 0.00 H new ATOM 0 HG22 ILE B 15 -7.033 -2.307 -13.170 1.00 0.00 H new ATOM 0 HG23 ILE B 15 -8.409 -1.240 -12.804 1.00 0.00 H new ATOM 0 HD11 ILE B 15 -12.004 -4.553 -12.338 1.00 0.00 H new ATOM 0 HD12 ILE B 15 -11.267 -4.687 -13.953 1.00 0.00 H new ATOM 0 HD13 ILE B 15 -10.460 -5.414 -12.543 1.00 0.00 H new ATOM 1671 N PHE B 16 -8.257 -0.663 -15.405 1.00 0.00 N ATOM 1672 CA PHE B 16 -8.314 0.681 -15.993 1.00 0.00 C ATOM 1673 C PHE B 16 -9.151 0.675 -17.255 1.00 0.00 C ATOM 1674 O PHE B 16 -10.113 1.431 -17.383 1.00 0.00 O ATOM 1675 CB PHE B 16 -6.896 1.176 -16.331 1.00 0.00 C ATOM 1676 CG PHE B 16 -6.806 2.318 -17.333 1.00 0.00 C ATOM 1677 CD1 PHE B 16 -7.358 3.564 -17.002 1.00 0.00 C ATOM 1678 CD2 PHE B 16 -6.071 2.183 -18.532 1.00 0.00 C ATOM 1679 CE1 PHE B 16 -7.281 4.632 -17.911 1.00 0.00 C ATOM 1680 CE2 PHE B 16 -5.968 3.264 -19.427 1.00 0.00 C ATOM 1681 CZ PHE B 16 -6.648 4.465 -19.155 1.00 0.00 C ATOM 0 H PHE B 16 -7.328 -0.930 -15.079 1.00 0.00 H new ATOM 0 HA PHE B 16 -8.770 1.350 -15.263 1.00 0.00 H new ATOM 0 HB2 PHE B 16 -6.414 1.492 -15.406 1.00 0.00 H new ATOM 0 HB3 PHE B 16 -6.322 0.334 -16.718 1.00 0.00 H new ATOM 0 HD1 PHE B 16 -7.843 3.703 -16.047 1.00 0.00 H new ATOM 0 HD2 PHE B 16 -5.586 1.246 -18.763 1.00 0.00 H new ATOM 0 HE1 PHE B 16 -7.711 5.588 -17.652 1.00 0.00 H new ATOM 0 HE2 PHE B 16 -5.368 3.172 -20.321 1.00 0.00 H new ATOM 0 HZ PHE B 16 -6.683 5.251 -19.895 1.00 0.00 H new ATOM 1691 N HIS B 17 -8.755 -0.169 -18.206 1.00 0.00 N ATOM 1692 CA HIS B 17 -9.317 -0.070 -19.522 1.00 0.00 C ATOM 1693 C HIS B 17 -10.738 -0.601 -19.593 1.00 0.00 C ATOM 1694 O HIS B 17 -11.511 -0.085 -20.395 1.00 0.00 O ATOM 1695 CB HIS B 17 -8.383 -0.608 -20.625 1.00 0.00 C ATOM 1696 CG HIS B 17 -8.415 0.358 -21.781 1.00 0.00 C ATOM 1697 ND1 HIS B 17 -9.621 0.959 -22.103 1.00 0.00 N ATOM 1698 CD2 HIS B 17 -7.465 1.348 -21.801 1.00 0.00 C ATOM 1699 CE1 HIS B 17 -9.441 2.278 -22.001 1.00 0.00 C ATOM 1700 NE2 HIS B 17 -8.133 2.548 -21.920 1.00 0.00 N ATOM 0 H HIS B 17 -8.063 -0.908 -18.081 1.00 0.00 H new ATOM 0 HA HIS B 17 -9.403 0.995 -19.738 1.00 0.00 H new ATOM 0 HB2 HIS B 17 -7.367 -0.713 -20.245 1.00 0.00 H new ATOM 0 HB3 HIS B 17 -8.706 -1.598 -20.948 1.00 0.00 H new ATOM 0 HD2 HIS B 17 -6.396 1.213 -21.736 1.00 0.00 H new ATOM 0 HE1 HIS B 17 -10.231 3.015 -21.986 1.00 0.00 H new ATOM 0 HE2 HIS B 17 -7.707 3.475 -21.942 1.00 0.00 H new ATOM 1708 N LYS B 18 -11.098 -1.619 -18.806 1.00 0.00 N ATOM 1709 CA LYS B 18 -12.404 -2.229 -18.991 1.00 0.00 C ATOM 1710 C LYS B 18 -13.566 -1.323 -18.584 1.00 0.00 C ATOM 1711 O LYS B 18 -14.631 -1.421 -19.201 1.00 0.00 O ATOM 1712 CB LYS B 18 -12.497 -3.638 -18.408 1.00 0.00 C ATOM 1713 CG LYS B 18 -13.706 -4.402 -18.987 1.00 0.00 C ATOM 1714 CD LYS B 18 -13.655 -4.634 -20.518 1.00 0.00 C ATOM 1715 CE LYS B 18 -14.741 -3.917 -21.354 1.00 0.00 C ATOM 1716 NZ LYS B 18 -14.456 -2.496 -21.667 1.00 0.00 N ATOM 0 H LYS B 18 -10.525 -2.021 -18.064 1.00 0.00 H new ATOM 0 HA LYS B 18 -12.512 -2.354 -20.068 1.00 0.00 H new ATOM 0 HB2 LYS B 18 -11.580 -4.185 -18.625 1.00 0.00 H new ATOM 0 HB3 LYS B 18 -12.585 -3.581 -17.323 1.00 0.00 H new ATOM 0 HG2 LYS B 18 -13.779 -5.369 -18.489 1.00 0.00 H new ATOM 0 HG3 LYS B 18 -14.615 -3.851 -18.747 1.00 0.00 H new ATOM 0 HD2 LYS B 18 -12.678 -4.315 -20.880 1.00 0.00 H new ATOM 0 HD3 LYS B 18 -13.730 -5.705 -20.705 1.00 0.00 H new ATOM 0 HE2 LYS B 18 -14.875 -4.460 -22.290 1.00 0.00 H new ATOM 0 HE3 LYS B 18 -15.687 -3.972 -20.816 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 -15.166 -2.139 -22.338 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 -14.493 -1.934 -20.793 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 -13.509 -2.417 -22.090 1.00 0.00 H new ATOM 1730 N TYR B 19 -13.394 -0.443 -17.596 1.00 0.00 N ATOM 1731 CA TYR B 19 -14.451 0.479 -17.184 1.00 0.00 C ATOM 1732 C TYR B 19 -14.563 1.639 -18.158 1.00 0.00 C ATOM 1733 O TYR B 19 -14.271 2.786 -17.833 1.00 0.00 O ATOM 1734 CB TYR B 19 -14.228 0.939 -15.748 1.00 0.00 C ATOM 1735 CG TYR B 19 -14.586 -0.152 -14.772 1.00 0.00 C ATOM 1736 CD1 TYR B 19 -13.690 -1.203 -14.540 1.00 0.00 C ATOM 1737 CD2 TYR B 19 -15.878 -0.200 -14.224 1.00 0.00 C ATOM 1738 CE1 TYR B 19 -14.038 -2.243 -13.671 1.00 0.00 C ATOM 1739 CE2 TYR B 19 -16.238 -1.252 -13.364 1.00 0.00 C ATOM 1740 CZ TYR B 19 -15.310 -2.268 -13.083 1.00 0.00 C ATOM 1741 OH TYR B 19 -15.619 -3.219 -12.163 1.00 0.00 O ATOM 0 H TYR B 19 -12.528 -0.350 -17.065 1.00 0.00 H new ATOM 0 HA TYR B 19 -15.407 -0.044 -17.207 1.00 0.00 H new ATOM 0 HB2 TYR B 19 -13.185 1.227 -15.612 1.00 0.00 H new ATOM 0 HB3 TYR B 19 -14.832 1.824 -15.548 1.00 0.00 H new ATOM 0 HD1 TYR B 19 -12.729 -1.211 -15.033 1.00 0.00 H new ATOM 0 HD2 TYR B 19 -16.595 0.571 -14.463 1.00 0.00 H new ATOM 0 HE1 TYR B 19 -13.327 -3.026 -13.453 1.00 0.00 H new ATOM 0 HE2 TYR B 19 -17.223 -1.279 -12.922 1.00 0.00 H new ATOM 0 HH TYR B 19 -14.822 -3.434 -11.635 1.00 0.00 H new ATOM 1751 N SER B 20 -15.031 1.305 -19.355 1.00 0.00 N ATOM 1752 CA SER B 20 -15.090 2.165 -20.511 1.00 0.00 C ATOM 1753 C SER B 20 -16.463 2.063 -21.168 1.00 0.00 C ATOM 1754 O SER B 20 -16.571 2.078 -22.392 1.00 0.00 O ATOM 1755 CB SER B 20 -13.951 1.729 -21.428 1.00 0.00 C ATOM 1756 OG SER B 20 -13.924 0.316 -21.542 1.00 0.00 O ATOM 0 H SER B 20 -15.398 0.373 -19.546 1.00 0.00 H new ATOM 0 HA SER B 20 -14.965 3.217 -20.256 1.00 0.00 H new ATOM 0 HB2 SER B 20 -14.076 2.178 -22.413 1.00 0.00 H new ATOM 0 HB3 SER B 20 -13.000 2.087 -21.033 1.00 0.00 H new ATOM 0 HG SER B 20 -13.080 -0.025 -21.179 1.00 0.00 H new ATOM 1762 N GLY B 21 -17.504 1.960 -20.332 1.00 0.00 N ATOM 1763 CA GLY B 21 -18.908 2.095 -20.695 1.00 0.00 C ATOM 1764 C GLY B 21 -19.291 1.454 -22.024 1.00 0.00 C ATOM 1765 O GLY B 21 -19.524 2.161 -23.005 1.00 0.00 O ATOM 0 H GLY B 21 -17.377 1.771 -19.338 1.00 0.00 H new ATOM 0 HA2 GLY B 21 -19.516 1.653 -19.906 1.00 0.00 H new ATOM 0 HA3 GLY B 21 -19.158 3.155 -20.734 1.00 0.00 H new ATOM 1825 N LYS B 26 -13.822 3.285 -24.657 1.00 0.00 N ATOM 1826 CA LYS B 26 -13.408 4.649 -24.355 1.00 0.00 C ATOM 1827 C LYS B 26 -11.988 4.656 -23.777 1.00 0.00 C ATOM 1828 O LYS B 26 -11.796 4.270 -22.628 1.00 0.00 O ATOM 1829 CB LYS B 26 -14.430 5.256 -23.364 1.00 0.00 C ATOM 1830 CG LYS B 26 -15.423 6.246 -23.994 1.00 0.00 C ATOM 1831 CD LYS B 26 -16.357 5.686 -25.083 1.00 0.00 C ATOM 1832 CE LYS B 26 -17.743 5.241 -24.580 1.00 0.00 C ATOM 1833 NZ LYS B 26 -17.711 3.982 -23.811 1.00 0.00 N ATOM 0 HA LYS B 26 -13.387 5.253 -25.262 1.00 0.00 H new ATOM 0 HB2 LYS B 26 -14.991 4.445 -22.899 1.00 0.00 H new ATOM 0 HB3 LYS B 26 -13.886 5.764 -22.568 1.00 0.00 H new ATOM 0 HG2 LYS B 26 -16.040 6.663 -23.198 1.00 0.00 H new ATOM 0 HG3 LYS B 26 -14.855 7.071 -24.423 1.00 0.00 H new ATOM 0 HD2 LYS B 26 -16.492 6.447 -25.852 1.00 0.00 H new ATOM 0 HD3 LYS B 26 -15.868 4.835 -25.558 1.00 0.00 H new ATOM 0 HE2 LYS B 26 -18.165 6.029 -23.956 1.00 0.00 H new ATOM 0 HE3 LYS B 26 -18.409 5.120 -25.434 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 -18.662 3.562 -23.793 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 -17.048 3.318 -24.259 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 -17.400 4.177 -22.838 1.00 0.00 H new ATOM 1847 N HIS B 27 -10.987 5.054 -24.576 1.00 0.00 N ATOM 1848 CA HIS B 27 -9.578 4.961 -24.199 1.00 0.00 C ATOM 1849 C HIS B 27 -9.286 5.729 -22.908 1.00 0.00 C ATOM 1850 O HIS B 27 -8.626 5.208 -22.005 1.00 0.00 O ATOM 1851 CB HIS B 27 -8.669 5.442 -25.336 1.00 0.00 C ATOM 1852 CG HIS B 27 -8.573 4.498 -26.512 1.00 0.00 C ATOM 1853 ND1 HIS B 27 -8.406 4.880 -27.831 1.00 0.00 N ATOM 1854 CD2 HIS B 27 -8.343 3.149 -26.435 1.00 0.00 C ATOM 1855 CE1 HIS B 27 -8.082 3.783 -28.540 1.00 0.00 C ATOM 1856 NE2 HIS B 27 -8.037 2.723 -27.712 1.00 0.00 N ATOM 0 H HIS B 27 -11.138 5.450 -25.504 1.00 0.00 H new ATOM 0 HA HIS B 27 -9.362 3.909 -24.012 1.00 0.00 H new ATOM 0 HB2 HIS B 27 -9.033 6.406 -25.691 1.00 0.00 H new ATOM 0 HB3 HIS B 27 -7.668 5.607 -24.937 1.00 0.00 H new ATOM 0 HD2 HIS B 27 -8.392 2.537 -25.546 1.00 0.00 H new ATOM 0 HE1 HIS B 27 -7.889 3.757 -29.602 1.00 0.00 H new ATOM 0 HE2 HIS B 27 -7.814 1.765 -27.983 1.00 0.00 H new ATOM 1864 N THR B 28 -9.764 6.969 -22.854 1.00 0.00 N ATOM 1865 CA THR B 28 -9.815 7.813 -21.676 1.00 0.00 C ATOM 1866 C THR B 28 -11.237 7.666 -21.136 1.00 0.00 C ATOM 1867 O THR B 28 -12.171 7.707 -21.939 1.00 0.00 O ATOM 1868 CB THR B 28 -9.581 9.255 -22.146 1.00 0.00 C ATOM 1869 OG1 THR B 28 -10.455 9.522 -23.230 1.00 0.00 O ATOM 1870 CG2 THR B 28 -8.149 9.444 -22.655 1.00 0.00 C ATOM 0 H THR B 28 -10.146 7.432 -23.679 1.00 0.00 H new ATOM 0 HA THR B 28 -9.078 7.554 -20.916 1.00 0.00 H new ATOM 0 HB THR B 28 -9.758 9.924 -21.304 1.00 0.00 H new ATOM 0 HG1 THR B 28 -11.271 8.988 -23.132 1.00 0.00 H new ATOM 0 HG21 THR B 28 -8.012 10.475 -22.981 1.00 0.00 H new ATOM 0 HG22 THR B 28 -7.445 9.221 -21.853 1.00 0.00 H new ATOM 0 HG23 THR B 28 -7.969 8.771 -23.493 1.00 0.00 H new ATOM 1878 N LEU B 29 -11.420 7.484 -19.829 1.00 0.00 N ATOM 1879 CA LEU B 29 -12.733 7.171 -19.285 1.00 0.00 C ATOM 1880 C LEU B 29 -13.511 8.461 -19.046 1.00 0.00 C ATOM 1881 O LEU B 29 -12.971 9.427 -18.511 1.00 0.00 O ATOM 1882 CB LEU B 29 -12.635 6.371 -17.981 1.00 0.00 C ATOM 1883 CG LEU B 29 -11.885 5.032 -18.054 1.00 0.00 C ATOM 1884 CD1 LEU B 29 -12.036 4.304 -19.390 1.00 0.00 C ATOM 1885 CD2 LEU B 29 -10.399 5.197 -17.746 1.00 0.00 C ATOM 0 H LEU B 29 -10.677 7.548 -19.133 1.00 0.00 H new ATOM 0 HA LEU B 29 -13.257 6.552 -20.013 1.00 0.00 H new ATOM 0 HB2 LEU B 29 -12.146 6.996 -17.233 1.00 0.00 H new ATOM 0 HB3 LEU B 29 -13.646 6.177 -17.623 1.00 0.00 H new ATOM 0 HG LEU B 29 -12.358 4.416 -17.290 1.00 0.00 H new ATOM 0 HD11 LEU B 29 -11.477 3.369 -19.360 1.00 0.00 H new ATOM 0 HD12 LEU B 29 -13.090 4.092 -19.572 1.00 0.00 H new ATOM 0 HD13 LEU B 29 -11.649 4.932 -20.192 1.00 0.00 H new ATOM 0 HD21 LEU B 29 -9.905 4.227 -17.808 1.00 0.00 H new ATOM 0 HD22 LEU B 29 -9.951 5.879 -18.468 1.00 0.00 H new ATOM 0 HD23 LEU B 29 -10.278 5.602 -16.741 1.00 0.00 H new ATOM 1897 N SER B 30 -14.797 8.460 -19.379 1.00 0.00 N ATOM 1898 CA SER B 30 -15.668 9.626 -19.331 1.00 0.00 C ATOM 1899 C SER B 30 -16.165 9.883 -17.902 1.00 0.00 C ATOM 1900 O SER B 30 -17.346 10.168 -17.701 1.00 0.00 O ATOM 1901 CB SER B 30 -16.847 9.394 -20.290 1.00 0.00 C ATOM 1902 OG SER B 30 -16.421 8.749 -21.477 1.00 0.00 O ATOM 0 H SER B 30 -15.277 7.619 -19.700 1.00 0.00 H new ATOM 0 HA SER B 30 -15.112 10.511 -19.641 1.00 0.00 H new ATOM 0 HB2 SER B 30 -17.607 8.789 -19.796 1.00 0.00 H new ATOM 0 HB3 SER B 30 -17.311 10.349 -20.538 1.00 0.00 H new ATOM 0 HG SER B 30 -16.390 7.781 -21.330 1.00 0.00 H new ATOM 1908 N LYS B 31 -15.291 9.711 -16.902 1.00 0.00 N ATOM 1909 CA LYS B 31 -15.578 9.718 -15.470 1.00 0.00 C ATOM 1910 C LYS B 31 -16.637 8.697 -15.043 1.00 0.00 C ATOM 1911 O LYS B 31 -16.318 7.766 -14.311 1.00 0.00 O ATOM 1912 CB LYS B 31 -15.890 11.139 -14.987 1.00 0.00 C ATOM 1913 CG LYS B 31 -16.252 11.247 -13.497 1.00 0.00 C ATOM 1914 CD LYS B 31 -15.160 10.756 -12.527 1.00 0.00 C ATOM 1915 CE LYS B 31 -15.474 9.414 -11.833 1.00 0.00 C ATOM 1916 NZ LYS B 31 -15.016 9.426 -10.432 1.00 0.00 N ATOM 0 H LYS B 31 -14.301 9.553 -17.089 1.00 0.00 H new ATOM 0 HA LYS B 31 -14.670 9.386 -14.967 1.00 0.00 H new ATOM 0 HB2 LYS B 31 -15.025 11.773 -15.183 1.00 0.00 H new ATOM 0 HB3 LYS B 31 -16.716 11.535 -15.577 1.00 0.00 H new ATOM 0 HG2 LYS B 31 -16.480 12.288 -13.268 1.00 0.00 H new ATOM 0 HG3 LYS B 31 -17.162 10.675 -13.317 1.00 0.00 H new ATOM 0 HD2 LYS B 31 -14.223 10.656 -13.076 1.00 0.00 H new ATOM 0 HD3 LYS B 31 -15.002 11.517 -11.763 1.00 0.00 H new ATOM 0 HE2 LYS B 31 -16.547 9.225 -11.867 1.00 0.00 H new ATOM 0 HE3 LYS B 31 -14.989 8.600 -12.371 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 -14.758 8.461 -10.143 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 -14.187 10.047 -10.343 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 -15.780 9.778 -9.820 1.00 0.00 H new ATOM 1930 N LYS B 32 -17.899 8.856 -15.450 1.00 0.00 N ATOM 1931 CA LYS B 32 -19.001 8.005 -15.013 1.00 0.00 C ATOM 1932 C LYS B 32 -18.710 6.518 -15.253 1.00 0.00 C ATOM 1933 O LYS B 32 -19.214 5.667 -14.520 1.00 0.00 O ATOM 1934 CB LYS B 32 -20.308 8.458 -15.688 1.00 0.00 C ATOM 1935 CG LYS B 32 -21.514 7.539 -15.421 1.00 0.00 C ATOM 1936 CD LYS B 32 -21.923 7.460 -13.936 1.00 0.00 C ATOM 1937 CE LYS B 32 -22.605 6.122 -13.619 1.00 0.00 C ATOM 1938 NZ LYS B 32 -21.633 5.012 -13.545 1.00 0.00 N ATOM 0 H LYS B 32 -18.184 9.589 -16.100 1.00 0.00 H new ATOM 0 HA LYS B 32 -19.116 8.116 -13.935 1.00 0.00 H new ATOM 0 HB2 LYS B 32 -20.550 9.464 -15.345 1.00 0.00 H new ATOM 0 HB3 LYS B 32 -20.145 8.519 -16.764 1.00 0.00 H new ATOM 0 HG2 LYS B 32 -22.364 7.893 -16.004 1.00 0.00 H new ATOM 0 HG3 LYS B 32 -21.280 6.536 -15.777 1.00 0.00 H new ATOM 0 HD2 LYS B 32 -21.041 7.580 -13.306 1.00 0.00 H new ATOM 0 HD3 LYS B 32 -22.599 8.281 -13.698 1.00 0.00 H new ATOM 0 HE2 LYS B 32 -23.138 6.202 -12.671 1.00 0.00 H new ATOM 0 HE3 LYS B 32 -23.349 5.903 -14.385 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 -22.045 4.160 -13.977 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 -20.766 5.275 -14.056 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 -21.402 4.818 -12.550 1.00 0.00 H new ATOM 1952 N GLU B 33 -17.920 6.200 -16.277 1.00 0.00 N ATOM 1953 CA GLU B 33 -17.452 4.849 -16.532 1.00 0.00 C ATOM 1954 C GLU B 33 -16.504 4.420 -15.400 1.00 0.00 C ATOM 1955 O GLU B 33 -16.745 3.417 -14.728 1.00 0.00 O ATOM 1956 CB GLU B 33 -16.791 4.819 -17.924 1.00 0.00 C ATOM 1957 CG GLU B 33 -17.689 5.381 -19.044 1.00 0.00 C ATOM 1958 CD GLU B 33 -16.959 5.500 -20.381 1.00 0.00 C ATOM 1959 OE1 GLU B 33 -16.030 6.332 -20.445 1.00 0.00 O ATOM 1960 OE2 GLU B 33 -17.344 4.796 -21.339 1.00 0.00 O ATOM 0 H GLU B 33 -17.586 6.884 -16.957 1.00 0.00 H new ATOM 0 HA GLU B 33 -18.273 4.132 -16.542 1.00 0.00 H new ATOM 0 HB2 GLU B 33 -15.865 5.392 -17.890 1.00 0.00 H new ATOM 0 HB3 GLU B 33 -16.521 3.791 -18.167 1.00 0.00 H new ATOM 0 HG2 GLU B 33 -18.558 4.735 -19.166 1.00 0.00 H new ATOM 0 HG3 GLU B 33 -18.060 6.362 -18.749 1.00 0.00 H new ATOM 1967 N LEU B 34 -15.459 5.213 -15.133 1.00 0.00 N ATOM 1968 CA LEU B 34 -14.469 4.907 -14.103 1.00 0.00 C ATOM 1969 C LEU B 34 -15.121 4.842 -12.719 1.00 0.00 C ATOM 1970 O LEU B 34 -14.741 4.004 -11.904 1.00 0.00 O ATOM 1971 CB LEU B 34 -13.321 5.929 -14.157 1.00 0.00 C ATOM 1972 CG LEU B 34 -11.993 5.512 -13.493 1.00 0.00 C ATOM 1973 CD1 LEU B 34 -12.024 5.454 -11.961 1.00 0.00 C ATOM 1974 CD2 LEU B 34 -11.434 4.204 -14.062 1.00 0.00 C ATOM 0 H LEU B 34 -15.279 6.086 -15.629 1.00 0.00 H new ATOM 0 HA LEU B 34 -14.046 3.921 -14.297 1.00 0.00 H new ATOM 0 HB2 LEU B 34 -13.121 6.161 -15.203 1.00 0.00 H new ATOM 0 HB3 LEU B 34 -13.663 6.850 -13.686 1.00 0.00 H new ATOM 0 HG LEU B 34 -11.316 6.326 -13.751 1.00 0.00 H new ATOM 0 HD11 LEU B 34 -11.045 5.152 -11.588 1.00 0.00 H new ATOM 0 HD12 LEU B 34 -12.275 6.438 -11.565 1.00 0.00 H new ATOM 0 HD13 LEU B 34 -12.774 4.731 -11.639 1.00 0.00 H new ATOM 0 HD21 LEU B 34 -10.499 3.958 -13.559 1.00 0.00 H new ATOM 0 HD22 LEU B 34 -12.154 3.401 -13.903 1.00 0.00 H new ATOM 0 HD23 LEU B 34 -11.251 4.321 -15.130 1.00 0.00 H new ATOM 1986 N LYS B 35 -16.138 5.678 -12.473 1.00 0.00 N ATOM 1987 CA LYS B 35 -16.945 5.669 -11.255 1.00 0.00 C ATOM 1988 C LYS B 35 -17.305 4.235 -10.841 1.00 0.00 C ATOM 1989 O LYS B 35 -17.274 3.897 -9.654 1.00 0.00 O ATOM 1990 CB LYS B 35 -18.199 6.545 -11.434 1.00 0.00 C ATOM 1991 CG LYS B 35 -18.903 6.788 -10.091 1.00 0.00 C ATOM 1992 CD LYS B 35 -19.993 7.874 -10.116 1.00 0.00 C ATOM 1993 CE LYS B 35 -19.504 9.330 -10.253 1.00 0.00 C ATOM 1994 NZ LYS B 35 -18.613 9.731 -9.148 1.00 0.00 N ATOM 0 H LYS B 35 -16.427 6.397 -13.136 1.00 0.00 H new ATOM 0 HA LYS B 35 -16.354 6.097 -10.445 1.00 0.00 H new ATOM 0 HB2 LYS B 35 -17.918 7.500 -11.878 1.00 0.00 H new ATOM 0 HB3 LYS B 35 -18.888 6.061 -12.126 1.00 0.00 H new ATOM 0 HG2 LYS B 35 -19.351 5.852 -9.758 1.00 0.00 H new ATOM 0 HG3 LYS B 35 -18.153 7.064 -9.349 1.00 0.00 H new ATOM 0 HD2 LYS B 35 -20.669 7.661 -10.944 1.00 0.00 H new ATOM 0 HD3 LYS B 35 -20.577 7.794 -9.199 1.00 0.00 H new ATOM 0 HE2 LYS B 35 -18.978 9.446 -11.201 1.00 0.00 H new ATOM 0 HE3 LYS B 35 -20.365 9.998 -10.283 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 -18.724 10.749 -8.964 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 -18.860 9.195 -8.291 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 -17.626 9.532 -9.408 1.00 0.00 H new ATOM 2008 N GLU B 36 -17.647 3.392 -11.821 1.00 0.00 N ATOM 2009 CA GLU B 36 -18.052 2.015 -11.588 1.00 0.00 C ATOM 2010 C GLU B 36 -16.899 1.129 -11.097 1.00 0.00 C ATOM 2011 O GLU B 36 -17.125 0.137 -10.397 1.00 0.00 O ATOM 2012 CB GLU B 36 -18.785 1.472 -12.827 1.00 0.00 C ATOM 2013 CG GLU B 36 -20.244 1.137 -12.506 1.00 0.00 C ATOM 2014 CD GLU B 36 -21.129 2.375 -12.532 1.00 0.00 C ATOM 2015 OE1 GLU B 36 -20.938 3.301 -11.705 1.00 0.00 O ATOM 2016 OE2 GLU B 36 -21.943 2.481 -13.476 1.00 0.00 O ATOM 0 H GLU B 36 -17.648 3.656 -12.806 1.00 0.00 H new ATOM 0 HA GLU B 36 -18.761 1.994 -10.761 1.00 0.00 H new ATOM 0 HB2 GLU B 36 -18.747 2.210 -13.628 1.00 0.00 H new ATOM 0 HB3 GLU B 36 -18.276 0.580 -13.192 1.00 0.00 H new ATOM 0 HG2 GLU B 36 -20.617 0.409 -13.227 1.00 0.00 H new ATOM 0 HG3 GLU B 36 -20.302 0.670 -11.523 1.00 0.00 H new ATOM 2023 N LEU B 37 -15.665 1.487 -11.440 1.00 0.00 N ATOM 2024 CA LEU B 37 -14.453 0.869 -10.933 1.00 0.00 C ATOM 2025 C LEU B 37 -14.287 1.285 -9.469 1.00 0.00 C ATOM 2026 O LEU B 37 -14.366 0.455 -8.564 1.00 0.00 O ATOM 2027 CB LEU B 37 -13.273 1.314 -11.823 1.00 0.00 C ATOM 2028 CG LEU B 37 -12.142 0.287 -11.940 1.00 0.00 C ATOM 2029 CD1 LEU B 37 -11.151 0.726 -13.023 1.00 0.00 C ATOM 2030 CD2 LEU B 37 -11.359 0.134 -10.645 1.00 0.00 C ATOM 0 H LEU B 37 -15.480 2.241 -12.101 1.00 0.00 H new ATOM 0 HA LEU B 37 -14.495 -0.220 -10.967 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -13.651 1.535 -12.821 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -12.864 2.242 -11.424 1.00 0.00 H new ATOM 0 HG LEU B 37 -12.613 -0.665 -12.186 1.00 0.00 H new ATOM 0 HD11 LEU B 37 -10.349 -0.008 -13.102 1.00 0.00 H new ATOM 0 HD12 LEU B 37 -11.668 0.803 -13.980 1.00 0.00 H new ATOM 0 HD13 LEU B 37 -10.730 1.696 -12.759 1.00 0.00 H new ATOM 0 HD21 LEU B 37 -10.570 -0.605 -10.782 1.00 0.00 H new ATOM 0 HD22 LEU B 37 -10.916 1.092 -10.373 1.00 0.00 H new ATOM 0 HD23 LEU B 37 -12.030 -0.194 -9.851 1.00 0.00 H new ATOM 2042 N ILE B 38 -14.077 2.586 -9.238 1.00 0.00 N ATOM 2043 CA ILE B 38 -13.715 3.119 -7.925 1.00 0.00 C ATOM 2044 C ILE B 38 -14.726 2.741 -6.849 1.00 0.00 C ATOM 2045 O ILE B 38 -14.325 2.262 -5.792 1.00 0.00 O ATOM 2046 CB ILE B 38 -13.410 4.627 -7.975 1.00 0.00 C ATOM 2047 CG1 ILE B 38 -13.189 5.283 -6.599 1.00 0.00 C ATOM 2048 CG2 ILE B 38 -14.503 5.427 -8.688 1.00 0.00 C ATOM 2049 CD1 ILE B 38 -12.117 4.689 -5.690 1.00 0.00 C ATOM 0 H ILE B 38 -14.154 3.300 -9.962 1.00 0.00 H new ATOM 0 HA ILE B 38 -12.782 2.638 -7.631 1.00 0.00 H new ATOM 0 HB ILE B 38 -12.475 4.665 -8.534 1.00 0.00 H new ATOM 0 HG12 ILE B 38 -12.944 6.332 -6.764 1.00 0.00 H new ATOM 0 HG13 ILE B 38 -14.136 5.258 -6.060 1.00 0.00 H new ATOM 0 HG21 ILE B 38 -14.236 6.484 -8.694 1.00 0.00 H new ATOM 0 HG22 ILE B 38 -14.603 5.073 -9.714 1.00 0.00 H new ATOM 0 HG23 ILE B 38 -15.450 5.295 -8.165 1.00 0.00 H new ATOM 0 HD11 ILE B 38 -12.076 5.254 -4.759 1.00 0.00 H new ATOM 0 HD12 ILE B 38 -12.359 3.649 -5.473 1.00 0.00 H new ATOM 0 HD13 ILE B 38 -11.149 4.740 -6.188 1.00 0.00 H new ATOM 2061 N GLN B 39 -16.026 2.933 -7.102 1.00 0.00 N ATOM 2062 CA GLN B 39 -17.023 2.716 -6.057 1.00 0.00 C ATOM 2063 C GLN B 39 -16.938 1.302 -5.465 1.00 0.00 C ATOM 2064 O GLN B 39 -17.286 1.100 -4.304 1.00 0.00 O ATOM 2065 CB GLN B 39 -18.431 3.057 -6.579 1.00 0.00 C ATOM 2066 CG GLN B 39 -18.990 1.958 -7.491 1.00 0.00 C ATOM 2067 CD GLN B 39 -20.204 2.391 -8.307 1.00 0.00 C ATOM 2068 OE1 GLN B 39 -21.280 1.813 -8.193 1.00 0.00 O ATOM 2069 NE2 GLN B 39 -20.003 3.363 -9.186 1.00 0.00 N ATOM 0 H GLN B 39 -16.403 3.232 -8.002 1.00 0.00 H new ATOM 0 HA GLN B 39 -16.806 3.395 -5.233 1.00 0.00 H new ATOM 0 HB2 GLN B 39 -19.104 3.204 -5.735 1.00 0.00 H new ATOM 0 HB3 GLN B 39 -18.396 3.999 -7.127 1.00 0.00 H new ATOM 0 HG2 GLN B 39 -18.205 1.630 -8.172 1.00 0.00 H new ATOM 0 HG3 GLN B 39 -19.263 1.097 -6.881 1.00 0.00 H new ATOM 0 HE21 GLN B 39 -19.091 3.816 -9.246 1.00 0.00 H new ATOM 0 HE22 GLN B 39 -20.760 3.658 -9.802 1.00 0.00 H new ATOM 2078 N LYS B 40 -16.546 0.326 -6.290 1.00 0.00 N ATOM 2079 CA LYS B 40 -16.432 -1.071 -5.918 1.00 0.00 C ATOM 2080 C LYS B 40 -15.012 -1.465 -5.461 1.00 0.00 C ATOM 2081 O LYS B 40 -14.633 -1.228 -4.316 1.00 0.00 O ATOM 2082 CB LYS B 40 -16.897 -1.907 -7.110 1.00 0.00 C ATOM 2083 CG LYS B 40 -18.390 -1.800 -7.439 1.00 0.00 C ATOM 2084 CD LYS B 40 -18.849 -2.972 -8.323 1.00 0.00 C ATOM 2085 CE LYS B 40 -18.464 -2.878 -9.811 1.00 0.00 C ATOM 2086 NZ LYS B 40 -17.053 -2.516 -10.046 1.00 0.00 N ATOM 0 H LYS B 40 -16.294 0.501 -7.263 1.00 0.00 H new ATOM 0 HA LYS B 40 -17.063 -1.260 -5.049 1.00 0.00 H new ATOM 0 HB2 LYS B 40 -16.325 -1.608 -7.988 1.00 0.00 H new ATOM 0 HB3 LYS B 40 -16.658 -2.953 -6.915 1.00 0.00 H new ATOM 0 HG2 LYS B 40 -18.969 -1.789 -6.515 1.00 0.00 H new ATOM 0 HG3 LYS B 40 -18.586 -0.857 -7.950 1.00 0.00 H new ATOM 0 HD2 LYS B 40 -18.433 -3.894 -7.917 1.00 0.00 H new ATOM 0 HD3 LYS B 40 -19.934 -3.053 -8.252 1.00 0.00 H new ATOM 0 HE2 LYS B 40 -18.667 -3.836 -10.289 1.00 0.00 H new ATOM 0 HE3 LYS B 40 -19.103 -2.139 -10.295 1.00 0.00 H new ATOM 0 HZ1 LYS B 40 -16.774 -2.810 -11.004 1.00 0.00 H new ATOM 0 HZ2 LYS B 40 -16.939 -1.487 -9.953 1.00 0.00 H new ATOM 0 HZ3 LYS B 40 -16.450 -2.996 -9.347 1.00 0.00 H new ATOM 2100 N GLU B 41 -14.239 -2.108 -6.350 1.00 0.00 N ATOM 2101 CA GLU B 41 -13.007 -2.806 -6.015 1.00 0.00 C ATOM 2102 C GLU B 41 -11.870 -1.950 -5.454 1.00 0.00 C ATOM 2103 O GLU B 41 -11.116 -2.451 -4.625 1.00 0.00 O ATOM 2104 CB GLU B 41 -12.540 -3.668 -7.201 1.00 0.00 C ATOM 2105 CG GLU B 41 -12.468 -2.921 -8.544 1.00 0.00 C ATOM 2106 CD GLU B 41 -13.712 -3.109 -9.404 1.00 0.00 C ATOM 2107 OE1 GLU B 41 -14.826 -3.105 -8.835 1.00 0.00 O ATOM 2108 OE2 GLU B 41 -13.560 -3.255 -10.634 1.00 0.00 O ATOM 0 H GLU B 41 -14.467 -2.153 -7.343 1.00 0.00 H new ATOM 0 HA GLU B 41 -13.273 -3.443 -5.172 1.00 0.00 H new ATOM 0 HB2 GLU B 41 -11.555 -4.074 -6.973 1.00 0.00 H new ATOM 0 HB3 GLU B 41 -13.218 -4.515 -7.307 1.00 0.00 H new ATOM 0 HG2 GLU B 41 -12.324 -1.858 -8.353 1.00 0.00 H new ATOM 0 HG3 GLU B 41 -11.596 -3.267 -9.098 1.00 0.00 H new ATOM 2115 N LEU B 42 -11.681 -0.707 -5.913 1.00 0.00 N ATOM 2116 CA LEU B 42 -10.472 0.027 -5.542 1.00 0.00 C ATOM 2117 C LEU B 42 -10.360 0.201 -4.022 1.00 0.00 C ATOM 2118 O LEU B 42 -9.474 -0.370 -3.380 1.00 0.00 O ATOM 2119 CB LEU B 42 -10.385 1.400 -6.234 1.00 0.00 C ATOM 2120 CG LEU B 42 -10.180 1.425 -7.761 1.00 0.00 C ATOM 2121 CD1 LEU B 42 -9.729 2.825 -8.181 1.00 0.00 C ATOM 2122 CD2 LEU B 42 -9.140 0.398 -8.224 1.00 0.00 C ATOM 0 H LEU B 42 -12.327 -0.204 -6.521 1.00 0.00 H new ATOM 0 HA LEU B 42 -9.634 -0.578 -5.888 1.00 0.00 H new ATOM 0 HB2 LEU B 42 -11.302 1.946 -6.010 1.00 0.00 H new ATOM 0 HB3 LEU B 42 -9.565 1.954 -5.777 1.00 0.00 H new ATOM 0 HG LEU B 42 -11.130 1.166 -8.229 1.00 0.00 H new ATOM 0 HD11 LEU B 42 -9.582 2.851 -9.261 1.00 0.00 H new ATOM 0 HD12 LEU B 42 -10.491 3.552 -7.901 1.00 0.00 H new ATOM 0 HD13 LEU B 42 -8.792 3.071 -7.681 1.00 0.00 H new ATOM 0 HD21 LEU B 42 -9.031 0.454 -9.307 1.00 0.00 H new ATOM 0 HD22 LEU B 42 -8.182 0.612 -7.751 1.00 0.00 H new ATOM 0 HD23 LEU B 42 -9.467 -0.603 -7.944 1.00 0.00 H new ATOM 2134 N THR B 43 -11.249 1.005 -3.438 1.00 0.00 N ATOM 2135 CA THR B 43 -11.140 1.475 -2.065 1.00 0.00 C ATOM 2136 C THR B 43 -11.328 0.401 -0.992 1.00 0.00 C ATOM 2137 O THR B 43 -11.120 0.694 0.186 1.00 0.00 O ATOM 2138 CB THR B 43 -12.108 2.650 -1.885 1.00 0.00 C ATOM 2139 OG1 THR B 43 -13.239 2.473 -2.717 1.00 0.00 O ATOM 2140 CG2 THR B 43 -11.419 3.950 -2.302 1.00 0.00 C ATOM 0 H THR B 43 -12.079 1.352 -3.919 1.00 0.00 H new ATOM 0 HA THR B 43 -10.110 1.796 -1.910 1.00 0.00 H new ATOM 0 HB THR B 43 -12.411 2.694 -0.839 1.00 0.00 H new ATOM 0 HG1 THR B 43 -13.112 2.971 -3.552 1.00 0.00 H new ATOM 0 HG21 THR B 43 -12.108 4.785 -2.174 1.00 0.00 H new ATOM 0 HG22 THR B 43 -10.537 4.109 -1.682 1.00 0.00 H new ATOM 0 HG23 THR B 43 -11.120 3.884 -3.348 1.00 0.00 H new ATOM 2148 N ILE B 44 -11.711 -0.824 -1.366 1.00 0.00 N ATOM 2149 CA ILE B 44 -11.853 -1.914 -0.408 1.00 0.00 C ATOM 2150 C ILE B 44 -10.560 -2.705 -0.208 1.00 0.00 C ATOM 2151 O ILE B 44 -10.516 -3.584 0.653 1.00 0.00 O ATOM 2152 CB ILE B 44 -13.056 -2.810 -0.740 1.00 0.00 C ATOM 2153 CG1 ILE B 44 -13.070 -3.441 -2.141 1.00 0.00 C ATOM 2154 CG2 ILE B 44 -14.354 -2.015 -0.549 1.00 0.00 C ATOM 2155 CD1 ILE B 44 -11.998 -4.514 -2.359 1.00 0.00 C ATOM 0 H ILE B 44 -11.928 -1.081 -2.329 1.00 0.00 H new ATOM 0 HA ILE B 44 -12.061 -1.454 0.558 1.00 0.00 H new ATOM 0 HB ILE B 44 -12.968 -3.647 -0.048 1.00 0.00 H new ATOM 0 HG12 ILE B 44 -14.051 -3.882 -2.318 1.00 0.00 H new ATOM 0 HG13 ILE B 44 -12.936 -2.654 -2.883 1.00 0.00 H new ATOM 0 HG21 ILE B 44 -15.208 -2.650 -0.784 1.00 0.00 H new ATOM 0 HG22 ILE B 44 -14.426 -1.679 0.485 1.00 0.00 H new ATOM 0 HG23 ILE B 44 -14.352 -1.150 -1.212 1.00 0.00 H new ATOM 0 HD11 ILE B 44 -12.078 -4.907 -3.372 1.00 0.00 H new ATOM 0 HD12 ILE B 44 -11.010 -4.076 -2.217 1.00 0.00 H new ATOM 0 HD13 ILE B 44 -12.142 -5.323 -1.643 1.00 0.00 H new ATOM 2167 N GLY B 45 -9.507 -2.407 -0.974 1.00 0.00 N ATOM 2168 CA GLY B 45 -8.219 -3.069 -0.803 1.00 0.00 C ATOM 2169 C GLY B 45 -7.737 -2.958 0.648 1.00 0.00 C ATOM 2170 O GLY B 45 -7.608 -1.853 1.177 1.00 0.00 O ATOM 0 H GLY B 45 -9.525 -1.710 -1.719 1.00 0.00 H new ATOM 0 HA2 GLY B 45 -8.305 -4.119 -1.083 1.00 0.00 H new ATOM 0 HA3 GLY B 45 -7.483 -2.620 -1.470 1.00 0.00 H new ATOM 2373 N ASP B 58 -14.098 8.930 -4.762 1.00 0.00 N ATOM 2374 CA ASP B 58 -14.639 8.670 -6.093 1.00 0.00 C ATOM 2375 C ASP B 58 -14.168 9.646 -7.149 1.00 0.00 C ATOM 2376 O ASP B 58 -13.550 9.236 -8.128 1.00 0.00 O ATOM 2377 CB ASP B 58 -16.167 8.603 -5.994 1.00 0.00 C ATOM 2378 CG ASP B 58 -16.917 8.368 -7.295 1.00 0.00 C ATOM 2379 OD1 ASP B 58 -16.360 8.486 -8.417 1.00 0.00 O ATOM 2380 OD2 ASP B 58 -18.149 8.186 -7.187 1.00 0.00 O ATOM 0 HA ASP B 58 -14.251 7.711 -6.436 1.00 0.00 H new ATOM 0 HB2 ASP B 58 -16.430 7.806 -5.299 1.00 0.00 H new ATOM 0 HB3 ASP B 58 -16.523 9.536 -5.558 1.00 0.00 H new ATOM 2385 N ASP B 59 -14.488 10.923 -6.983 1.00 0.00 N ATOM 2386 CA ASP B 59 -14.286 11.891 -8.043 1.00 0.00 C ATOM 2387 C ASP B 59 -12.937 12.610 -8.005 1.00 0.00 C ATOM 2388 O ASP B 59 -12.760 13.609 -8.699 1.00 0.00 O ATOM 2389 CB ASP B 59 -15.526 12.801 -8.108 1.00 0.00 C ATOM 2390 CG ASP B 59 -16.721 12.061 -8.702 1.00 0.00 C ATOM 2391 OD1 ASP B 59 -16.561 11.425 -9.765 1.00 0.00 O ATOM 2392 OD2 ASP B 59 -17.813 12.030 -8.095 1.00 0.00 O ATOM 0 H ASP B 59 -14.887 11.307 -6.126 1.00 0.00 H new ATOM 0 HA ASP B 59 -14.203 11.366 -8.995 1.00 0.00 H new ATOM 0 HB2 ASP B 59 -15.774 13.154 -7.107 1.00 0.00 H new ATOM 0 HB3 ASP B 59 -15.303 13.681 -8.711 1.00 0.00 H new ATOM 2397 N LEU B 60 -11.953 12.083 -7.268 1.00 0.00 N ATOM 2398 CA LEU B 60 -10.589 12.606 -7.311 1.00 0.00 C ATOM 2399 C LEU B 60 -9.798 12.096 -8.530 1.00 0.00 C ATOM 2400 O LEU B 60 -8.695 12.576 -8.779 1.00 0.00 O ATOM 2401 CB LEU B 60 -9.867 12.310 -5.988 1.00 0.00 C ATOM 2402 CG LEU B 60 -10.545 12.931 -4.752 1.00 0.00 C ATOM 2403 CD1 LEU B 60 -9.731 12.572 -3.504 1.00 0.00 C ATOM 2404 CD2 LEU B 60 -10.664 14.457 -4.847 1.00 0.00 C ATOM 0 H LEU B 60 -12.079 11.294 -6.635 1.00 0.00 H new ATOM 0 HA LEU B 60 -10.651 13.687 -7.433 1.00 0.00 H new ATOM 0 HB2 LEU B 60 -9.807 11.230 -5.853 1.00 0.00 H new ATOM 0 HB3 LEU B 60 -8.844 12.681 -6.053 1.00 0.00 H new ATOM 0 HG LEU B 60 -11.556 12.526 -4.695 1.00 0.00 H new ATOM 0 HD11 LEU B 60 -10.204 13.008 -2.624 1.00 0.00 H new ATOM 0 HD12 LEU B 60 -9.691 11.488 -3.395 1.00 0.00 H new ATOM 0 HD13 LEU B 60 -8.719 12.965 -3.604 1.00 0.00 H new ATOM 0 HD21 LEU B 60 -11.149 14.841 -3.949 1.00 0.00 H new ATOM 0 HD22 LEU B 60 -9.670 14.895 -4.937 1.00 0.00 H new ATOM 0 HD23 LEU B 60 -11.258 14.722 -5.722 1.00 0.00 H new ATOM 2416 N ASP B 61 -10.336 11.147 -9.304 1.00 0.00 N ATOM 2417 CA ASP B 61 -9.793 10.741 -10.600 1.00 0.00 C ATOM 2418 C ASP B 61 -10.074 11.836 -11.623 1.00 0.00 C ATOM 2419 O ASP B 61 -9.269 12.085 -12.514 1.00 0.00 O ATOM 2420 CB ASP B 61 -10.429 9.432 -11.079 1.00 0.00 C ATOM 2421 CG ASP B 61 -11.941 9.518 -11.227 1.00 0.00 C ATOM 2422 OD1 ASP B 61 -12.555 10.387 -10.566 1.00 0.00 O ATOM 2423 OD2 ASP B 61 -12.513 8.704 -11.976 1.00 0.00 O ATOM 0 H ASP B 61 -11.176 10.632 -9.040 1.00 0.00 H new ATOM 0 HA ASP B 61 -8.720 10.585 -10.492 1.00 0.00 H new ATOM 0 HB2 ASP B 61 -9.992 9.153 -12.038 1.00 0.00 H new ATOM 0 HB3 ASP B 61 -10.184 8.638 -10.374 1.00 0.00 H new ATOM 2428 N ARG B 62 -11.204 12.521 -11.461 1.00 0.00 N ATOM 2429 CA ARG B 62 -11.639 13.680 -12.242 1.00 0.00 C ATOM 2430 C ARG B 62 -10.710 14.916 -12.135 1.00 0.00 C ATOM 2431 O ARG B 62 -11.186 16.038 -12.272 1.00 0.00 O ATOM 2432 CB ARG B 62 -13.095 14.018 -11.867 1.00 0.00 C ATOM 2433 CG ARG B 62 -13.989 14.242 -13.094 1.00 0.00 C ATOM 2434 CD ARG B 62 -13.529 15.415 -13.971 1.00 0.00 C ATOM 2435 NE ARG B 62 -14.483 15.691 -15.055 1.00 0.00 N ATOM 2436 CZ ARG B 62 -14.660 14.931 -16.148 1.00 0.00 C ATOM 2437 NH1 ARG B 62 -13.932 13.827 -16.327 1.00 0.00 N ATOM 2438 NH2 ARG B 62 -15.570 15.287 -17.058 1.00 0.00 N ATOM 0 H ARG B 62 -11.880 12.269 -10.740 1.00 0.00 H new ATOM 0 HA ARG B 62 -11.579 13.400 -13.294 1.00 0.00 H new ATOM 0 HB2 ARG B 62 -13.508 13.208 -11.266 1.00 0.00 H new ATOM 0 HB3 ARG B 62 -13.107 14.914 -11.246 1.00 0.00 H new ATOM 0 HG2 ARG B 62 -14.006 13.332 -13.694 1.00 0.00 H new ATOM 0 HG3 ARG B 62 -15.011 14.424 -12.762 1.00 0.00 H new ATOM 0 HD2 ARG B 62 -13.411 16.306 -13.354 1.00 0.00 H new ATOM 0 HD3 ARG B 62 -12.551 15.190 -14.396 1.00 0.00 H new ATOM 0 HE ARG B 62 -15.058 16.529 -14.970 1.00 0.00 H new ATOM 0 HH11 ARG B 62 -13.237 13.556 -15.632 1.00 0.00 H new ATOM 0 HH12 ARG B 62 -14.071 13.254 -17.159 1.00 0.00 H new ATOM 0 HH21 ARG B 62 -16.125 16.131 -16.921 1.00 0.00 H new ATOM 0 HH22 ARG B 62 -15.710 14.715 -17.891 1.00 0.00 H new ATOM 2452 N ASN B 63 -9.423 14.732 -11.825 1.00 0.00 N ATOM 2453 CA ASN B 63 -8.454 15.754 -11.445 1.00 0.00 C ATOM 2454 C ASN B 63 -8.260 16.903 -12.445 1.00 0.00 C ATOM 2455 O ASN B 63 -9.053 17.843 -12.432 1.00 0.00 O ATOM 2456 CB ASN B 63 -7.161 15.051 -11.009 1.00 0.00 C ATOM 2457 CG ASN B 63 -5.997 15.996 -10.727 1.00 0.00 C ATOM 2458 OD1 ASN B 63 -6.172 17.042 -10.109 1.00 0.00 O ATOM 2459 ND2 ASN B 63 -4.795 15.642 -11.172 1.00 0.00 N ATOM 0 H ASN B 63 -9.007 13.801 -11.835 1.00 0.00 H new ATOM 0 HA ASN B 63 -8.864 16.307 -10.600 1.00 0.00 H new ATOM 0 HB2 ASN B 63 -7.364 14.466 -10.112 1.00 0.00 H new ATOM 0 HB3 ASN B 63 -6.863 14.348 -11.787 1.00 0.00 H new ATOM 0 HD21 ASN B 63 -3.990 16.245 -11.002 1.00 0.00 H new ATOM 0 HD22 ASN B 63 -4.678 14.767 -11.683 1.00 0.00 H new ATOM 2466 N LYS B 64 -7.205 16.912 -13.268 1.00 0.00 N ATOM 2467 CA LYS B 64 -6.899 18.113 -14.033 1.00 0.00 C ATOM 2468 C LYS B 64 -7.408 17.981 -15.462 1.00 0.00 C ATOM 2469 O LYS B 64 -6.653 17.552 -16.324 1.00 0.00 O ATOM 2470 CB LYS B 64 -5.416 18.522 -13.923 1.00 0.00 C ATOM 2471 CG LYS B 64 -4.371 17.536 -14.477 1.00 0.00 C ATOM 2472 CD LYS B 64 -3.173 18.197 -15.188 1.00 0.00 C ATOM 2473 CE LYS B 64 -3.511 19.173 -16.338 1.00 0.00 C ATOM 2474 NZ LYS B 64 -4.456 18.626 -17.334 1.00 0.00 N ATOM 0 H LYS B 64 -6.571 16.127 -13.415 1.00 0.00 H new ATOM 0 HA LYS B 64 -7.439 18.950 -13.590 1.00 0.00 H new ATOM 0 HB2 LYS B 64 -5.289 19.474 -14.439 1.00 0.00 H new ATOM 0 HB3 LYS B 64 -5.191 18.697 -12.871 1.00 0.00 H new ATOM 0 HG2 LYS B 64 -3.996 16.926 -13.655 1.00 0.00 H new ATOM 0 HG3 LYS B 64 -4.864 16.861 -15.177 1.00 0.00 H new ATOM 0 HD2 LYS B 64 -2.588 18.736 -14.443 1.00 0.00 H new ATOM 0 HD3 LYS B 64 -2.534 17.409 -15.585 1.00 0.00 H new ATOM 0 HE2 LYS B 64 -3.933 20.085 -15.915 1.00 0.00 H new ATOM 0 HE3 LYS B 64 -2.588 19.454 -16.845 1.00 0.00 H new ATOM 0 HZ1 LYS B 64 -4.880 19.406 -17.875 1.00 0.00 H new ATOM 0 HZ2 LYS B 64 -3.948 17.991 -17.983 1.00 0.00 H new ATOM 0 HZ3 LYS B 64 -5.206 18.095 -16.846 1.00 0.00 H new ATOM 2488 N ASP B 65 -8.676 18.328 -15.714 1.00 0.00 N ATOM 2489 CA ASP B 65 -9.281 18.528 -17.042 1.00 0.00 C ATOM 2490 C ASP B 65 -9.299 17.348 -18.033 1.00 0.00 C ATOM 2491 O ASP B 65 -10.167 17.303 -18.905 1.00 0.00 O ATOM 2492 CB ASP B 65 -8.700 19.793 -17.713 1.00 0.00 C ATOM 2493 CG ASP B 65 -7.238 19.667 -18.137 1.00 0.00 C ATOM 2494 OD1 ASP B 65 -6.924 18.844 -19.019 1.00 0.00 O ATOM 2495 OD2 ASP B 65 -6.383 20.345 -17.524 1.00 0.00 O ATOM 0 H ASP B 65 -9.345 18.486 -14.960 1.00 0.00 H new ATOM 0 HA ASP B 65 -10.338 18.641 -16.802 1.00 0.00 H new ATOM 0 HB2 ASP B 65 -9.301 20.033 -18.590 1.00 0.00 H new ATOM 0 HB3 ASP B 65 -8.795 20.632 -17.023 1.00 0.00 H new ATOM 2500 N GLN B 66 -8.407 16.367 -17.909 1.00 0.00 N ATOM 2501 CA GLN B 66 -8.145 15.366 -18.940 1.00 0.00 C ATOM 2502 C GLN B 66 -9.112 14.183 -18.866 1.00 0.00 C ATOM 2503 O GLN B 66 -8.685 13.028 -18.867 1.00 0.00 O ATOM 2504 CB GLN B 66 -6.658 14.971 -18.876 1.00 0.00 C ATOM 2505 CG GLN B 66 -6.221 14.371 -17.530 1.00 0.00 C ATOM 2506 CD GLN B 66 -4.703 14.260 -17.426 1.00 0.00 C ATOM 2507 OE1 GLN B 66 -4.035 13.821 -18.359 1.00 0.00 O ATOM 2508 NE2 GLN B 66 -4.143 14.629 -16.285 1.00 0.00 N ATOM 0 H GLN B 66 -7.836 16.244 -17.073 1.00 0.00 H new ATOM 0 HA GLN B 66 -8.336 15.792 -19.925 1.00 0.00 H new ATOM 0 HB2 GLN B 66 -6.451 14.250 -19.666 1.00 0.00 H new ATOM 0 HB3 GLN B 66 -6.051 15.852 -19.082 1.00 0.00 H new ATOM 0 HG2 GLN B 66 -6.597 14.991 -16.716 1.00 0.00 H new ATOM 0 HG3 GLN B 66 -6.667 13.384 -17.410 1.00 0.00 H new ATOM 0 HE21 GLN B 66 -4.721 14.990 -15.526 1.00 0.00 H new ATOM 0 HE22 GLN B 66 -3.133 14.552 -16.164 1.00 0.00 H new ATOM 2517 N GLU B 67 -10.415 14.493 -18.826 1.00 0.00 N ATOM 2518 CA GLU B 67 -11.507 13.578 -18.518 1.00 0.00 C ATOM 2519 C GLU B 67 -11.122 12.699 -17.322 1.00 0.00 C ATOM 2520 O GLU B 67 -11.290 13.133 -16.179 1.00 0.00 O ATOM 2521 CB GLU B 67 -11.993 12.802 -19.762 1.00 0.00 C ATOM 2522 CG GLU B 67 -13.195 13.494 -20.423 1.00 0.00 C ATOM 2523 CD GLU B 67 -14.409 13.534 -19.502 1.00 0.00 C ATOM 2524 OE1 GLU B 67 -14.509 12.657 -18.617 1.00 0.00 O ATOM 2525 OE2 GLU B 67 -15.178 14.517 -19.564 1.00 0.00 O ATOM 0 H GLU B 67 -10.746 15.438 -19.018 1.00 0.00 H new ATOM 0 HA GLU B 67 -12.384 14.151 -18.215 1.00 0.00 H new ATOM 0 HB2 GLU B 67 -11.179 12.719 -20.482 1.00 0.00 H new ATOM 0 HB3 GLU B 67 -12.269 11.787 -19.474 1.00 0.00 H new ATOM 0 HG2 GLU B 67 -12.919 14.511 -20.703 1.00 0.00 H new ATOM 0 HG3 GLU B 67 -13.455 12.969 -21.342 1.00 0.00 H new ATOM 2532 N VAL B 68 -10.623 11.493 -17.607 1.00 0.00 N ATOM 2533 CA VAL B 68 -9.935 10.576 -16.718 1.00 0.00 C ATOM 2534 C VAL B 68 -9.103 9.695 -17.654 1.00 0.00 C ATOM 2535 O VAL B 68 -9.603 9.245 -18.688 1.00 0.00 O ATOM 2536 CB VAL B 68 -10.877 9.710 -15.861 1.00 0.00 C ATOM 2537 CG1 VAL B 68 -10.032 8.857 -14.906 1.00 0.00 C ATOM 2538 CG2 VAL B 68 -11.874 10.513 -15.020 1.00 0.00 C ATOM 0 H VAL B 68 -10.701 11.108 -18.548 1.00 0.00 H new ATOM 0 HA VAL B 68 -9.342 11.128 -15.989 1.00 0.00 H new ATOM 0 HB VAL B 68 -11.458 9.108 -16.559 1.00 0.00 H new ATOM 0 HG11 VAL B 68 -10.688 8.239 -14.293 1.00 0.00 H new ATOM 0 HG12 VAL B 68 -9.365 8.217 -15.483 1.00 0.00 H new ATOM 0 HG13 VAL B 68 -9.442 9.509 -14.262 1.00 0.00 H new ATOM 0 HG21 VAL B 68 -12.500 9.829 -14.446 1.00 0.00 H new ATOM 0 HG22 VAL B 68 -11.331 11.167 -14.338 1.00 0.00 H new ATOM 0 HG23 VAL B 68 -12.502 11.115 -15.677 1.00 0.00 H new ATOM 2548 N ASN B 69 -7.840 9.438 -17.320 1.00 0.00 N ATOM 2549 CA ASN B 69 -6.986 8.515 -18.056 1.00 0.00 C ATOM 2550 C ASN B 69 -6.020 7.880 -17.065 1.00 0.00 C ATOM 2551 O ASN B 69 -6.084 8.203 -15.881 1.00 0.00 O ATOM 2552 CB ASN B 69 -6.265 9.219 -19.209 1.00 0.00 C ATOM 2553 CG ASN B 69 -5.142 10.137 -18.740 1.00 0.00 C ATOM 2554 OD1 ASN B 69 -4.091 9.670 -18.306 1.00 0.00 O ATOM 2555 ND2 ASN B 69 -5.354 11.441 -18.850 1.00 0.00 N ATOM 0 H ASN B 69 -7.378 9.871 -16.521 1.00 0.00 H new ATOM 0 HA ASN B 69 -7.586 7.733 -18.522 1.00 0.00 H new ATOM 0 HB2 ASN B 69 -5.855 8.469 -19.885 1.00 0.00 H new ATOM 0 HB3 ASN B 69 -6.988 9.802 -19.780 1.00 0.00 H new ATOM 0 HD21 ASN B 69 -4.629 12.101 -18.569 1.00 0.00 H new ATOM 0 HD22 ASN B 69 -6.242 11.784 -19.216 1.00 0.00 H new ATOM 2562 N PHE B 70 -5.151 6.978 -17.533 1.00 0.00 N ATOM 2563 CA PHE B 70 -4.325 6.169 -16.649 1.00 0.00 C ATOM 2564 C PHE B 70 -3.515 7.020 -15.685 1.00 0.00 C ATOM 2565 O PHE B 70 -3.371 6.623 -14.537 1.00 0.00 O ATOM 2566 CB PHE B 70 -3.395 5.240 -17.422 1.00 0.00 C ATOM 2567 CG PHE B 70 -2.758 4.150 -16.574 1.00 0.00 C ATOM 2568 CD1 PHE B 70 -3.515 3.018 -16.234 1.00 0.00 C ATOM 2569 CD2 PHE B 70 -1.395 4.200 -16.223 1.00 0.00 C ATOM 2570 CE1 PHE B 70 -2.906 1.897 -15.645 1.00 0.00 C ATOM 2571 CE2 PHE B 70 -0.796 3.097 -15.584 1.00 0.00 C ATOM 2572 CZ PHE B 70 -1.542 1.937 -15.319 1.00 0.00 C ATOM 0 H PHE B 70 -5.006 6.794 -18.526 1.00 0.00 H new ATOM 0 HA PHE B 70 -5.018 5.558 -16.071 1.00 0.00 H new ATOM 0 HB2 PHE B 70 -3.956 4.774 -18.232 1.00 0.00 H new ATOM 0 HB3 PHE B 70 -2.606 5.835 -17.882 1.00 0.00 H new ATOM 0 HD1 PHE B 70 -4.578 3.008 -16.427 1.00 0.00 H new ATOM 0 HD2 PHE B 70 -0.811 5.081 -16.443 1.00 0.00 H new ATOM 0 HE1 PHE B 70 -3.486 1.008 -15.444 1.00 0.00 H new ATOM 0 HE2 PHE B 70 0.244 3.144 -15.296 1.00 0.00 H new ATOM 0 HZ PHE B 70 -1.068 1.079 -14.866 1.00 0.00 H new ATOM 2582 N GLN B 71 -2.989 8.173 -16.122 1.00 0.00 N ATOM 2583 CA GLN B 71 -2.260 9.038 -15.208 1.00 0.00 C ATOM 2584 C GLN B 71 -3.162 9.387 -14.027 1.00 0.00 C ATOM 2585 O GLN B 71 -2.818 9.093 -12.890 1.00 0.00 O ATOM 2586 CB GLN B 71 -1.702 10.277 -15.927 1.00 0.00 C ATOM 2587 CG GLN B 71 -0.907 11.207 -14.992 1.00 0.00 C ATOM 2588 CD GLN B 71 -1.790 12.297 -14.392 1.00 0.00 C ATOM 2589 OE1 GLN B 71 -2.080 13.282 -15.068 1.00 0.00 O ATOM 2590 NE2 GLN B 71 -2.239 12.130 -13.154 1.00 0.00 N ATOM 0 H GLN B 71 -3.056 8.515 -17.081 1.00 0.00 H new ATOM 0 HA GLN B 71 -1.387 8.512 -14.822 1.00 0.00 H new ATOM 0 HB2 GLN B 71 -1.057 9.956 -16.745 1.00 0.00 H new ATOM 0 HB3 GLN B 71 -2.526 10.835 -16.371 1.00 0.00 H new ATOM 0 HG2 GLN B 71 -0.459 10.620 -14.190 1.00 0.00 H new ATOM 0 HG3 GLN B 71 -0.089 11.666 -15.546 1.00 0.00 H new ATOM 0 HE21 GLN B 71 -1.976 11.299 -12.624 1.00 0.00 H new ATOM 0 HE22 GLN B 71 -2.847 12.833 -12.733 1.00 0.00 H new ATOM 2599 N GLU B 72 -4.326 9.984 -14.278 1.00 0.00 N ATOM 2600 CA GLU B 72 -5.187 10.413 -13.189 1.00 0.00 C ATOM 2601 C GLU B 72 -5.672 9.210 -12.383 1.00 0.00 C ATOM 2602 O GLU B 72 -5.574 9.218 -11.162 1.00 0.00 O ATOM 2603 CB GLU B 72 -6.345 11.262 -13.711 1.00 0.00 C ATOM 2604 CG GLU B 72 -5.891 12.474 -14.537 1.00 0.00 C ATOM 2605 CD GLU B 72 -5.349 13.635 -13.708 1.00 0.00 C ATOM 2606 OE1 GLU B 72 -4.582 13.419 -12.743 1.00 0.00 O ATOM 2607 OE2 GLU B 72 -5.696 14.781 -14.075 1.00 0.00 O ATOM 0 H GLU B 72 -4.686 10.177 -15.212 1.00 0.00 H new ATOM 0 HA GLU B 72 -4.609 11.044 -12.514 1.00 0.00 H new ATOM 0 HB2 GLU B 72 -6.996 10.638 -14.324 1.00 0.00 H new ATOM 0 HB3 GLU B 72 -6.940 11.610 -12.866 1.00 0.00 H new ATOM 0 HG2 GLU B 72 -5.120 12.153 -15.237 1.00 0.00 H new ATOM 0 HG3 GLU B 72 -6.733 12.830 -15.131 1.00 0.00 H new ATOM 2614 N TYR B 73 -6.153 8.163 -13.059 1.00 0.00 N ATOM 2615 CA TYR B 73 -6.581 6.916 -12.435 1.00 0.00 C ATOM 2616 C TYR B 73 -5.504 6.353 -11.503 1.00 0.00 C ATOM 2617 O TYR B 73 -5.816 5.923 -10.394 1.00 0.00 O ATOM 2618 CB TYR B 73 -6.968 5.899 -13.520 1.00 0.00 C ATOM 2619 CG TYR B 73 -6.812 4.438 -13.137 1.00 0.00 C ATOM 2620 CD1 TYR B 73 -7.821 3.764 -12.423 1.00 0.00 C ATOM 2621 CD2 TYR B 73 -5.622 3.759 -13.460 1.00 0.00 C ATOM 2622 CE1 TYR B 73 -7.696 2.389 -12.158 1.00 0.00 C ATOM 2623 CE2 TYR B 73 -5.487 2.395 -13.168 1.00 0.00 C ATOM 2624 CZ TYR B 73 -6.546 1.699 -12.576 1.00 0.00 C ATOM 2625 OH TYR B 73 -6.495 0.343 -12.530 1.00 0.00 O ATOM 0 H TYR B 73 -6.256 8.162 -14.074 1.00 0.00 H new ATOM 0 HA TYR B 73 -7.456 7.121 -11.818 1.00 0.00 H new ATOM 0 HB2 TYR B 73 -8.006 6.073 -13.802 1.00 0.00 H new ATOM 0 HB3 TYR B 73 -6.361 6.091 -14.405 1.00 0.00 H new ATOM 0 HD1 TYR B 73 -8.691 4.303 -12.079 1.00 0.00 H new ATOM 0 HD2 TYR B 73 -4.810 4.291 -13.934 1.00 0.00 H new ATOM 0 HE1 TYR B 73 -8.482 1.865 -11.635 1.00 0.00 H new ATOM 0 HE2 TYR B 73 -4.566 1.881 -13.400 1.00 0.00 H new ATOM 0 HH TYR B 73 -6.116 0.001 -13.366 1.00 0.00 H new ATOM 2635 N ILE B 74 -4.247 6.309 -11.946 1.00 0.00 N ATOM 2636 CA ILE B 74 -3.198 5.655 -11.186 1.00 0.00 C ATOM 2637 C ILE B 74 -2.679 6.590 -10.086 1.00 0.00 C ATOM 2638 O ILE B 74 -2.484 6.143 -8.958 1.00 0.00 O ATOM 2639 CB ILE B 74 -2.136 5.043 -12.115 1.00 0.00 C ATOM 2640 CG1 ILE B 74 -1.444 3.831 -11.470 1.00 0.00 C ATOM 2641 CG2 ILE B 74 -1.093 6.071 -12.547 1.00 0.00 C ATOM 2642 CD1 ILE B 74 -2.289 2.557 -11.510 1.00 0.00 C ATOM 0 H ILE B 74 -3.937 6.720 -12.827 1.00 0.00 H new ATOM 0 HA ILE B 74 -3.596 4.793 -10.651 1.00 0.00 H new ATOM 0 HB ILE B 74 -2.667 4.703 -13.004 1.00 0.00 H new ATOM 0 HG12 ILE B 74 -0.499 3.647 -11.981 1.00 0.00 H new ATOM 0 HG13 ILE B 74 -1.205 4.067 -10.433 1.00 0.00 H new ATOM 0 HG21 ILE B 74 -0.363 5.595 -13.202 1.00 0.00 H new ATOM 0 HG22 ILE B 74 -1.584 6.885 -13.081 1.00 0.00 H new ATOM 0 HG23 ILE B 74 -0.587 6.468 -11.667 1.00 0.00 H new ATOM 0 HD11 ILE B 74 -1.741 1.742 -11.038 1.00 0.00 H new ATOM 0 HD12 ILE B 74 -3.224 2.723 -10.974 1.00 0.00 H new ATOM 0 HD13 ILE B 74 -2.506 2.297 -12.546 1.00 0.00 H new ATOM 2654 N THR B 75 -2.515 7.889 -10.376 1.00 0.00 N ATOM 2655 CA THR B 75 -2.252 8.925 -9.379 1.00 0.00 C ATOM 2656 C THR B 75 -3.264 8.787 -8.243 1.00 0.00 C ATOM 2657 O THR B 75 -2.899 8.701 -7.071 1.00 0.00 O ATOM 2658 CB THR B 75 -2.364 10.315 -10.041 1.00 0.00 C ATOM 2659 OG1 THR B 75 -1.362 10.463 -11.022 1.00 0.00 O ATOM 2660 CG2 THR B 75 -2.226 11.474 -9.050 1.00 0.00 C ATOM 0 H THR B 75 -2.563 8.251 -11.329 1.00 0.00 H new ATOM 0 HA THR B 75 -1.246 8.814 -8.975 1.00 0.00 H new ATOM 0 HB THR B 75 -3.363 10.359 -10.476 1.00 0.00 H new ATOM 0 HG1 THR B 75 -0.484 10.299 -10.620 1.00 0.00 H new ATOM 0 HG21 THR B 75 -2.315 12.421 -9.583 1.00 0.00 H new ATOM 0 HG22 THR B 75 -3.012 11.406 -8.298 1.00 0.00 H new ATOM 0 HG23 THR B 75 -1.253 11.422 -8.562 1.00 0.00 H new ATOM 2668 N PHE B 76 -4.540 8.752 -8.623 1.00 0.00 N ATOM 2669 CA PHE B 76 -5.677 8.519 -7.755 1.00 0.00 C ATOM 2670 C PHE B 76 -5.460 7.251 -6.948 1.00 0.00 C ATOM 2671 O PHE B 76 -5.367 7.335 -5.728 1.00 0.00 O ATOM 2672 CB PHE B 76 -6.931 8.474 -8.637 1.00 0.00 C ATOM 2673 CG PHE B 76 -8.203 7.900 -8.059 1.00 0.00 C ATOM 2674 CD1 PHE B 76 -9.093 8.800 -7.462 1.00 0.00 C ATOM 2675 CD2 PHE B 76 -8.686 6.659 -8.532 1.00 0.00 C ATOM 2676 CE1 PHE B 76 -10.472 8.591 -7.584 1.00 0.00 C ATOM 2677 CE2 PHE B 76 -10.073 6.419 -8.595 1.00 0.00 C ATOM 2678 CZ PHE B 76 -10.964 7.457 -8.241 1.00 0.00 C ATOM 0 H PHE B 76 -4.815 8.893 -9.595 1.00 0.00 H new ATOM 0 HA PHE B 76 -5.802 9.319 -7.025 1.00 0.00 H new ATOM 0 HB2 PHE B 76 -7.145 9.493 -8.960 1.00 0.00 H new ATOM 0 HB3 PHE B 76 -6.686 7.901 -9.531 1.00 0.00 H new ATOM 0 HD1 PHE B 76 -8.719 9.650 -6.911 1.00 0.00 H new ATOM 0 HD2 PHE B 76 -7.991 5.894 -8.845 1.00 0.00 H new ATOM 0 HE1 PHE B 76 -11.162 9.310 -7.168 1.00 0.00 H new ATOM 0 HE2 PHE B 76 -10.449 5.457 -8.909 1.00 0.00 H new ATOM 0 HZ PHE B 76 -12.015 7.376 -8.475 1.00 0.00 H new ATOM 2688 N LEU B 77 -5.333 6.094 -7.604 1.00 0.00 N ATOM 2689 CA LEU B 77 -5.087 4.832 -6.921 1.00 0.00 C ATOM 2690 C LEU B 77 -4.000 4.985 -5.857 1.00 0.00 C ATOM 2691 O LEU B 77 -4.223 4.652 -4.700 1.00 0.00 O ATOM 2692 CB LEU B 77 -4.723 3.730 -7.929 1.00 0.00 C ATOM 2693 CG LEU B 77 -5.700 2.553 -7.865 1.00 0.00 C ATOM 2694 CD1 LEU B 77 -5.372 1.575 -8.996 1.00 0.00 C ATOM 2695 CD2 LEU B 77 -5.644 1.847 -6.503 1.00 0.00 C ATOM 0 H LEU B 77 -5.398 6.011 -8.619 1.00 0.00 H new ATOM 0 HA LEU B 77 -6.006 4.537 -6.415 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -4.721 4.146 -8.937 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -3.712 3.374 -7.729 1.00 0.00 H new ATOM 0 HG LEU B 77 -6.715 2.930 -7.987 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -6.062 0.732 -8.960 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -5.469 2.083 -9.956 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -4.351 1.213 -8.879 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -6.351 1.017 -6.494 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -4.637 1.468 -6.331 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -5.905 2.554 -5.716 1.00 0.00 H new ATOM 2707 N GLY B 78 -2.842 5.525 -6.238 1.00 0.00 N ATOM 2708 CA GLY B 78 -1.745 5.790 -5.322 1.00 0.00 C ATOM 2709 C GLY B 78 -2.165 6.659 -4.131 1.00 0.00 C ATOM 2710 O GLY B 78 -1.944 6.284 -2.975 1.00 0.00 O ATOM 0 H GLY B 78 -2.643 5.792 -7.202 1.00 0.00 H new ATOM 0 HA2 GLY B 78 -1.348 4.844 -4.954 1.00 0.00 H new ATOM 0 HA3 GLY B 78 -0.938 6.286 -5.862 1.00 0.00 H new ATOM 2714 N ALA B 79 -2.750 7.830 -4.405 1.00 0.00 N ATOM 2715 CA ALA B 79 -3.110 8.800 -3.379 1.00 0.00 C ATOM 2716 C ALA B 79 -4.122 8.193 -2.410 1.00 0.00 C ATOM 2717 O ALA B 79 -3.914 8.175 -1.198 1.00 0.00 O ATOM 2718 CB ALA B 79 -3.678 10.058 -4.043 1.00 0.00 C ATOM 0 H ALA B 79 -2.986 8.128 -5.352 1.00 0.00 H new ATOM 0 HA ALA B 79 -2.221 9.073 -2.810 1.00 0.00 H new ATOM 0 HB1 ALA B 79 -3.948 10.784 -3.276 1.00 0.00 H new ATOM 0 HB2 ALA B 79 -2.928 10.491 -4.705 1.00 0.00 H new ATOM 0 HB3 ALA B 79 -4.564 9.796 -4.622 1.00 0.00 H new ATOM 2724 N LEU B 80 -5.218 7.684 -2.966 1.00 0.00 N ATOM 2725 CA LEU B 80 -6.275 7.017 -2.233 1.00 0.00 C ATOM 2726 C LEU B 80 -5.677 5.873 -1.412 1.00 0.00 C ATOM 2727 O LEU B 80 -5.931 5.779 -0.212 1.00 0.00 O ATOM 2728 CB LEU B 80 -7.333 6.514 -3.224 1.00 0.00 C ATOM 2729 CG LEU B 80 -8.381 7.559 -3.640 1.00 0.00 C ATOM 2730 CD1 LEU B 80 -7.830 8.879 -4.187 1.00 0.00 C ATOM 2731 CD2 LEU B 80 -9.294 6.906 -4.682 1.00 0.00 C ATOM 0 H LEU B 80 -5.395 7.729 -3.970 1.00 0.00 H new ATOM 0 HA LEU B 80 -6.759 7.708 -1.542 1.00 0.00 H new ATOM 0 HB2 LEU B 80 -6.828 6.152 -4.119 1.00 0.00 H new ATOM 0 HB3 LEU B 80 -7.848 5.661 -2.781 1.00 0.00 H new ATOM 0 HG LEU B 80 -8.909 7.848 -2.731 1.00 0.00 H new ATOM 0 HD11 LEU B 80 -8.658 9.539 -4.448 1.00 0.00 H new ATOM 0 HD12 LEU B 80 -7.210 9.357 -3.428 1.00 0.00 H new ATOM 0 HD13 LEU B 80 -7.229 8.682 -5.075 1.00 0.00 H new ATOM 0 HD21 LEU B 80 -10.052 7.621 -5.001 1.00 0.00 H new ATOM 0 HD22 LEU B 80 -8.701 6.598 -5.543 1.00 0.00 H new ATOM 0 HD23 LEU B 80 -9.779 6.033 -4.245 1.00 0.00 H new ATOM 2743 N ALA B 81 -4.878 5.004 -2.039 1.00 0.00 N ATOM 2744 CA ALA B 81 -4.282 3.848 -1.384 1.00 0.00 C ATOM 2745 C ALA B 81 -3.475 4.260 -0.157 1.00 0.00 C ATOM 2746 O ALA B 81 -3.661 3.672 0.904 1.00 0.00 O ATOM 2747 CB ALA B 81 -3.453 3.020 -2.368 1.00 0.00 C ATOM 0 H ALA B 81 -4.628 5.089 -3.024 1.00 0.00 H new ATOM 0 HA ALA B 81 -5.091 3.209 -1.031 1.00 0.00 H new ATOM 0 HB1 ALA B 81 -3.021 2.164 -1.850 1.00 0.00 H new ATOM 0 HB2 ALA B 81 -4.093 2.669 -3.177 1.00 0.00 H new ATOM 0 HB3 ALA B 81 -2.654 3.637 -2.779 1.00 0.00 H new ATOM 2753 N MET B 82 -2.629 5.292 -0.252 1.00 0.00 N ATOM 2754 CA MET B 82 -1.919 5.783 0.928 1.00 0.00 C ATOM 2755 C MET B 82 -2.852 6.096 2.108 1.00 0.00 C ATOM 2756 O MET B 82 -2.388 6.075 3.249 1.00 0.00 O ATOM 2757 CB MET B 82 -1.048 6.998 0.591 1.00 0.00 C ATOM 2758 CG MET B 82 0.281 6.603 -0.064 1.00 0.00 C ATOM 2759 SD MET B 82 1.473 7.956 -0.232 1.00 0.00 S ATOM 2760 CE MET B 82 0.512 9.116 -1.219 1.00 0.00 C ATOM 0 H MET B 82 -2.424 5.793 -1.116 1.00 0.00 H new ATOM 0 HA MET B 82 -1.271 4.967 1.248 1.00 0.00 H new ATOM 0 HB2 MET B 82 -1.597 7.660 -0.079 1.00 0.00 H new ATOM 0 HB3 MET B 82 -0.847 7.561 1.502 1.00 0.00 H new ATOM 0 HG2 MET B 82 0.737 5.806 0.523 1.00 0.00 H new ATOM 0 HG3 MET B 82 0.075 6.193 -1.053 1.00 0.00 H new ATOM 0 HE1 MET B 82 1.187 9.778 -1.762 1.00 0.00 H new ATOM 0 HE2 MET B 82 -0.105 8.565 -1.929 1.00 0.00 H new ATOM 0 HE3 MET B 82 -0.128 9.708 -0.564 1.00 0.00 H new ATOM 2770 N ILE B 83 -4.134 6.390 1.862 1.00 0.00 N ATOM 2771 CA ILE B 83 -5.139 6.532 2.906 1.00 0.00 C ATOM 2772 C ILE B 83 -5.824 5.183 3.173 1.00 0.00 C ATOM 2773 O ILE B 83 -5.636 4.591 4.232 1.00 0.00 O ATOM 2774 CB ILE B 83 -6.138 7.649 2.539 1.00 0.00 C ATOM 2775 CG1 ILE B 83 -5.444 8.972 2.157 1.00 0.00 C ATOM 2776 CG2 ILE B 83 -7.143 7.878 3.679 1.00 0.00 C ATOM 2777 CD1 ILE B 83 -4.508 9.537 3.231 1.00 0.00 C ATOM 0 H ILE B 83 -4.500 6.536 0.921 1.00 0.00 H new ATOM 0 HA ILE B 83 -4.658 6.832 3.837 1.00 0.00 H new ATOM 0 HB ILE B 83 -6.674 7.307 1.654 1.00 0.00 H new ATOM 0 HG12 ILE B 83 -4.873 8.816 1.242 1.00 0.00 H new ATOM 0 HG13 ILE B 83 -6.208 9.716 1.933 1.00 0.00 H new ATOM 0 HG21 ILE B 83 -7.838 8.670 3.398 1.00 0.00 H new ATOM 0 HG22 ILE B 83 -7.697 6.958 3.865 1.00 0.00 H new ATOM 0 HG23 ILE B 83 -6.608 8.169 4.583 1.00 0.00 H new ATOM 0 HD11 ILE B 83 -4.065 10.467 2.875 1.00 0.00 H new ATOM 0 HD12 ILE B 83 -5.074 9.730 4.142 1.00 0.00 H new ATOM 0 HD13 ILE B 83 -3.718 8.816 3.441 1.00 0.00 H new ATOM 2789 N TYR B 84 -6.650 4.687 2.244 1.00 0.00 N ATOM 2790 CA TYR B 84 -7.509 3.535 2.517 1.00 0.00 C ATOM 2791 C TYR B 84 -6.692 2.260 2.758 1.00 0.00 C ATOM 2792 O TYR B 84 -7.037 1.443 3.607 1.00 0.00 O ATOM 2793 CB TYR B 84 -8.583 3.368 1.427 1.00 0.00 C ATOM 2794 CG TYR B 84 -8.136 2.706 0.136 1.00 0.00 C ATOM 2795 CD1 TYR B 84 -8.054 1.304 0.033 1.00 0.00 C ATOM 2796 CD2 TYR B 84 -7.919 3.494 -1.004 1.00 0.00 C ATOM 2797 CE1 TYR B 84 -7.623 0.715 -1.166 1.00 0.00 C ATOM 2798 CE2 TYR B 84 -7.520 2.901 -2.214 1.00 0.00 C ATOM 2799 CZ TYR B 84 -7.352 1.510 -2.290 1.00 0.00 C ATOM 2800 OH TYR B 84 -7.148 0.926 -3.501 1.00 0.00 O ATOM 0 H TYR B 84 -6.740 5.066 1.301 1.00 0.00 H new ATOM 0 HA TYR B 84 -8.042 3.727 3.448 1.00 0.00 H new ATOM 0 HB2 TYR B 84 -9.405 2.785 1.843 1.00 0.00 H new ATOM 0 HB3 TYR B 84 -8.981 4.354 1.186 1.00 0.00 H new ATOM 0 HD1 TYR B 84 -8.322 0.683 0.875 1.00 0.00 H new ATOM 0 HD2 TYR B 84 -8.059 4.564 -0.951 1.00 0.00 H new ATOM 0 HE1 TYR B 84 -7.499 -0.356 -1.224 1.00 0.00 H new ATOM 0 HE2 TYR B 84 -7.343 3.515 -3.084 1.00 0.00 H new ATOM 0 HH TYR B 84 -7.805 0.212 -3.635 1.00 0.00 H new ATOM 2810 N ASN B 85 -5.588 2.114 2.027 1.00 0.00 N ATOM 2811 CA ASN B 85 -4.615 1.029 2.117 1.00 0.00 C ATOM 2812 C ASN B 85 -3.492 1.393 3.110 1.00 0.00 C ATOM 2813 O ASN B 85 -2.357 0.937 2.961 1.00 0.00 O ATOM 2814 CB ASN B 85 -4.120 0.700 0.700 1.00 0.00 C ATOM 2815 CG ASN B 85 -3.819 -0.776 0.458 1.00 0.00 C ATOM 2816 OD1 ASN B 85 -2.668 -1.151 0.261 1.00 0.00 O ATOM 2817 ND2 ASN B 85 -4.862 -1.600 0.388 1.00 0.00 N ATOM 0 H ASN B 85 -5.334 2.794 1.311 1.00 0.00 H new ATOM 0 HA ASN B 85 -5.069 0.124 2.520 1.00 0.00 H new ATOM 0 HB2 ASN B 85 -4.872 1.026 -0.018 1.00 0.00 H new ATOM 0 HB3 ASN B 85 -3.218 1.278 0.501 1.00 0.00 H new ATOM 0 HD21 ASN B 85 -4.720 -2.585 0.163 1.00 0.00 H new ATOM 0 HD22 ASN B 85 -5.803 -1.247 0.559 1.00 0.00 H new ATOM 2824 N GLU B 86 -3.817 2.261 4.087 1.00 0.00 N ATOM 2825 CA GLU B 86 -2.977 2.972 5.051 1.00 0.00 C ATOM 2826 C GLU B 86 -1.555 2.424 5.168 1.00 0.00 C ATOM 2827 O GLU B 86 -0.599 3.113 4.789 1.00 0.00 O ATOM 2828 CB GLU B 86 -3.738 2.933 6.399 1.00 0.00 C ATOM 2829 CG GLU B 86 -2.943 3.241 7.679 1.00 0.00 C ATOM 2830 CD GLU B 86 -2.140 4.515 7.548 1.00 0.00 C ATOM 2831 OE1 GLU B 86 -2.752 5.601 7.451 1.00 0.00 O ATOM 2832 OE2 GLU B 86 -0.912 4.417 7.344 1.00 0.00 O ATOM 0 H GLU B 86 -4.797 2.505 4.230 1.00 0.00 H new ATOM 0 HA GLU B 86 -2.818 3.996 4.712 1.00 0.00 H new ATOM 0 HB2 GLU B 86 -4.564 3.642 6.338 1.00 0.00 H new ATOM 0 HB3 GLU B 86 -4.177 1.941 6.508 1.00 0.00 H new ATOM 0 HG2 GLU B 86 -3.630 3.329 8.521 1.00 0.00 H new ATOM 0 HG3 GLU B 86 -2.273 2.410 7.900 1.00 0.00 H new