USER MOD reduce.3.24.130724 H: found=0, std=0, add=1121, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1123 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 109 MET CE :methyl 148:sc= -1.59 (180deg=-2.55!) USER MOD Set 1.2: A 124 MET CE :methyl -135:sc= -4.85! (180deg=-7.59!) USER MOD Set 2.1: A 60 ASN : amide:sc= -1.76 K(o=-2.2,f=-12!) USER MOD Set 2.2: A 62 THR OG1 : rot -160:sc= -0.431 USER MOD Set 3.1: A 49 GLN :FLIP amide:sc= -0.271 F(o=-3.3,f=-1.9) USER MOD Set 3.2: A 53 ASN : amide:sc= -1.67 K(o=-1.9,f=-3.7!) USER MOD Single : A 8 GLN : amide:sc= -0.18 K(o=-0.18,f=-2.4!) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 THR OG1 : rot 29:sc= 0.427 USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot 92:sc= 1.27 USER MOD Single : A 36 MET CE :methyl 179:sc= -3.78! (180deg=-3.78!) USER MOD Single : A 38 SER OG : rot -67:sc= -3.35! USER MOD Single : A 41 GLN : amide:sc= -1.52 K(o=-1.5,f=-4.1!) USER MOD Single : A 42 ASN : amide:sc= -0.141 K(o=-0.14,f=-2.2!) USER MOD Single : A 44 THR OG1 : rot 180:sc= -0.406 USER MOD Single : A 51 MET CE :methyl -135:sc= -1.47 (180deg=-4.68!) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 MET CE :methyl -159:sc= -1.07 (180deg=-1.85) USER MOD Single : A 72 MET CE :methyl 154:sc= 0 (180deg=-0.8) USER MOD Single : A 94 LYS NZ :NH3+ 166:sc= -0.0398 (180deg=-0.288) USER MOD Single : A 97 ASN : amide:sc= -0.649 K(o=-0.65,f=-9.5!) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 180:sc= 0.00539 USER MOD Single : A 107 HIS : no HD1:sc= -0.725 X(o=-0.73,f=-0.86) USER MOD Single : A 110 THR OG1 : rot 77:sc= 0.975 USER MOD Single : A 111 ASN : amide:sc= -0.0167 X(o=-0.017,f=-0.071) USER MOD Single : A 115 LYS NZ :NH3+ 173:sc=-0.00209 (180deg=-0.0922) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 135 GLN : amide:sc= -0.804 X(o=-0.8,f=-1.2) USER MOD Single : A 137 ASN : amide:sc= -2.06 K(o=-2.1,f=-14!) USER MOD Single : A 138 TYR OH : rot 180:sc= 0 USER MOD Single : A 143 GLN : amide:sc= -0.418 K(o=-0.42,f=-1.3) USER MOD Single : A 144 MET CE :methyl -112:sc= -0.197 (180deg=-1.38) USER MOD Single : A 145 MET CE :methyl -174:sc= -2.46 (180deg=-2.64) USER MOD Single : A 146 THR OG1 : rot 75:sc= 0.463 USER MOD Single : M 15 LYS NZ :NH3+ 150:sc= -0.15 (180deg=-0.801) USER MOD Single : M 18 LYS NZ :NH3+ -161:sc= -0.107 (180deg=-0.563) USER MOD Single : M 30 LYS NZ :NH3+ 166:sc= 0.0432 (180deg=0.0147) USER MOD Single : M 32 LYS NZ :NH3+ -148:sc= -0.199 (180deg=-1.21) USER MOD Single : M 33 HIS : no HD1:sc= -0.233 K(o=-0.23,f=-1.1) USER MOD Single : M 38 SER OG : rot -148:sc= 0.124 USER MOD ----------------------------------------------------------------- ATOM 103 N GLN A 8 7.195 1.666 2.360 1.00 33.44 N ATOM 104 CA GLN A 8 7.663 0.313 2.637 1.00 60.31 C ATOM 105 C GLN A 8 9.054 0.089 2.054 1.00 24.40 C ATOM 106 O GLN A 8 9.922 -0.499 2.701 1.00 13.25 O ATOM 107 CB GLN A 8 6.686 -0.715 2.064 1.00 35.01 C ATOM 108 CG GLN A 8 6.867 -2.112 2.635 1.00 4.14 C ATOM 109 CD GLN A 8 5.576 -2.905 2.660 1.00 33.03 C ATOM 110 OE1 GLN A 8 4.496 -2.363 2.419 1.00 25.41 O ATOM 111 NE2 GLN A 8 5.679 -4.196 2.953 1.00 60.21 N ATOM 0 HA GLN A 8 7.717 0.189 3.719 1.00 60.31 H new ATOM 0 HB2 GLN A 8 5.666 -0.382 2.258 1.00 35.01 H new ATOM 0 HB3 GLN A 8 6.808 -0.756 0.982 1.00 35.01 H new ATOM 0 HG2 GLN A 8 7.607 -2.649 2.042 1.00 4.14 H new ATOM 0 HG3 GLN A 8 7.263 -2.038 3.648 1.00 4.14 H new ATOM 0 HE21 GLN A 8 6.594 -4.604 3.146 1.00 60.21 H new ATOM 0 HE22 GLN A 8 4.843 -4.780 2.985 1.00 60.21 H new ATOM 120 N ILE A 9 9.260 0.559 0.829 1.00 41.43 N ATOM 121 CA ILE A 9 10.546 0.411 0.160 1.00 65.44 C ATOM 122 C ILE A 9 11.634 1.203 0.877 1.00 22.42 C ATOM 123 O ILE A 9 12.779 0.760 0.971 1.00 52.43 O ATOM 124 CB ILE A 9 10.474 0.872 -1.308 1.00 5.41 C ATOM 125 CG1 ILE A 9 9.341 0.149 -2.038 1.00 15.53 C ATOM 126 CG2 ILE A 9 11.803 0.626 -2.006 1.00 63.15 C ATOM 127 CD1 ILE A 9 9.088 0.676 -3.433 1.00 60.43 C ATOM 0 H ILE A 9 8.552 1.046 0.279 1.00 41.43 H new ATOM 0 HA ILE A 9 10.795 -0.650 0.187 1.00 65.44 H new ATOM 0 HB ILE A 9 10.268 1.942 -1.327 1.00 5.41 H new ATOM 0 HG12 ILE A 9 9.577 -0.913 -2.097 1.00 15.53 H new ATOM 0 HG13 ILE A 9 8.426 0.240 -1.452 1.00 15.53 H new ATOM 0 HG21 ILE A 9 11.736 0.957 -3.042 1.00 63.15 H new ATOM 0 HG22 ILE A 9 12.590 1.183 -1.497 1.00 63.15 H new ATOM 0 HG23 ILE A 9 12.037 -0.438 -1.979 1.00 63.15 H new ATOM 0 HD11 ILE A 9 8.272 0.117 -3.891 1.00 60.43 H new ATOM 0 HD12 ILE A 9 8.820 1.731 -3.380 1.00 60.43 H new ATOM 0 HD13 ILE A 9 9.989 0.560 -4.035 1.00 60.43 H new ATOM 139 N ALA A 10 11.268 2.375 1.384 1.00 11.22 N ATOM 140 CA ALA A 10 12.211 3.227 2.097 1.00 2.33 C ATOM 141 C ALA A 10 12.878 2.471 3.242 1.00 54.14 C ATOM 142 O ALA A 10 14.103 2.452 3.354 1.00 72.32 O ATOM 143 CB ALA A 10 11.507 4.470 2.622 1.00 24.24 C ATOM 0 H ALA A 10 10.325 2.756 1.314 1.00 11.22 H new ATOM 0 HA ALA A 10 12.988 3.532 1.396 1.00 2.33 H new ATOM 0 HB1 ALA A 10 12.223 5.097 3.152 1.00 24.24 H new ATOM 0 HB2 ALA A 10 11.084 5.029 1.787 1.00 24.24 H new ATOM 0 HB3 ALA A 10 10.709 4.176 3.303 1.00 24.24 H new ATOM 149 N GLU A 11 12.062 1.850 4.089 1.00 45.43 N ATOM 150 CA GLU A 11 12.575 1.094 5.225 1.00 12.13 C ATOM 151 C GLU A 11 13.435 -0.076 4.757 1.00 33.30 C ATOM 152 O GLU A 11 14.550 -0.274 5.240 1.00 71.11 O ATOM 153 CB GLU A 11 11.419 0.580 6.087 1.00 64.24 C ATOM 154 CG GLU A 11 10.934 1.585 7.117 1.00 2.15 C ATOM 155 CD GLU A 11 10.041 2.653 6.516 1.00 72.50 C ATOM 156 OE1 GLU A 11 10.578 3.629 5.953 1.00 64.32 O ATOM 157 OE2 GLU A 11 8.803 2.511 6.609 1.00 64.24 O ATOM 0 H GLU A 11 11.045 1.856 4.010 1.00 45.43 H new ATOM 0 HA GLU A 11 13.196 1.761 5.823 1.00 12.13 H new ATOM 0 HB2 GLU A 11 10.587 0.307 5.438 1.00 64.24 H new ATOM 0 HB3 GLU A 11 11.735 -0.329 6.599 1.00 64.24 H new ATOM 0 HG2 GLU A 11 10.389 1.061 7.902 1.00 2.15 H new ATOM 0 HG3 GLU A 11 11.794 2.060 7.589 1.00 2.15 H new ATOM 164 N PHE A 12 12.908 -0.850 3.814 1.00 53.34 N ATOM 165 CA PHE A 12 13.625 -2.002 3.280 1.00 4.32 C ATOM 166 C PHE A 12 14.990 -1.588 2.736 1.00 32.33 C ATOM 167 O PHE A 12 16.001 -2.239 3.003 1.00 54.14 O ATOM 168 CB PHE A 12 12.806 -2.673 2.176 1.00 30.44 C ATOM 169 CG PHE A 12 11.814 -3.676 2.692 1.00 33.13 C ATOM 170 CD1 PHE A 12 12.236 -4.779 3.417 1.00 63.14 C ATOM 171 CD2 PHE A 12 10.458 -3.515 2.453 1.00 24.34 C ATOM 172 CE1 PHE A 12 11.325 -5.703 3.892 1.00 63.53 C ATOM 173 CE2 PHE A 12 9.543 -4.436 2.926 1.00 34.33 C ATOM 174 CZ PHE A 12 9.977 -5.531 3.647 1.00 32.34 C ATOM 0 H PHE A 12 11.986 -0.700 3.404 1.00 53.34 H new ATOM 0 HA PHE A 12 13.777 -2.713 4.093 1.00 4.32 H new ATOM 0 HB2 PHE A 12 12.275 -1.906 1.611 1.00 30.44 H new ATOM 0 HB3 PHE A 12 13.484 -3.169 1.481 1.00 30.44 H new ATOM 0 HD1 PHE A 12 13.289 -4.918 3.613 1.00 63.14 H new ATOM 0 HD2 PHE A 12 10.113 -2.660 1.891 1.00 24.34 H new ATOM 0 HE1 PHE A 12 11.667 -6.559 4.455 1.00 63.53 H new ATOM 0 HE2 PHE A 12 8.489 -4.300 2.732 1.00 34.33 H new ATOM 0 HZ PHE A 12 9.263 -6.251 4.019 1.00 32.34 H new ATOM 184 N LYS A 13 15.011 -0.502 1.972 1.00 52.22 N ATOM 185 CA LYS A 13 16.249 0.001 1.390 1.00 64.14 C ATOM 186 C LYS A 13 17.297 0.250 2.470 1.00 32.23 C ATOM 187 O LYS A 13 18.497 0.209 2.204 1.00 4.00 O ATOM 188 CB LYS A 13 15.985 1.293 0.614 1.00 52.22 C ATOM 189 CG LYS A 13 17.250 1.996 0.153 1.00 60.11 C ATOM 190 CD LYS A 13 16.982 2.907 -1.034 1.00 35.55 C ATOM 191 CE LYS A 13 16.167 4.125 -0.628 1.00 0.24 C ATOM 192 NZ LYS A 13 16.321 5.244 -1.599 1.00 34.42 N ATOM 0 H LYS A 13 14.183 0.048 1.741 1.00 52.22 H new ATOM 0 HA LYS A 13 16.631 -0.755 0.705 1.00 64.14 H new ATOM 0 HB2 LYS A 13 15.369 1.065 -0.256 1.00 52.22 H new ATOM 0 HB3 LYS A 13 15.410 1.973 1.242 1.00 52.22 H new ATOM 0 HG2 LYS A 13 17.663 2.581 0.975 1.00 60.11 H new ATOM 0 HG3 LYS A 13 18.001 1.254 -0.119 1.00 60.11 H new ATOM 0 HD2 LYS A 13 17.929 3.229 -1.468 1.00 35.55 H new ATOM 0 HD3 LYS A 13 16.450 2.353 -1.807 1.00 35.55 H new ATOM 0 HE2 LYS A 13 15.115 3.850 -0.555 1.00 0.24 H new ATOM 0 HE3 LYS A 13 16.479 4.458 0.362 1.00 0.24 H new ATOM 0 HZ1 LYS A 13 15.750 6.055 -1.287 1.00 34.42 H new ATOM 0 HZ2 LYS A 13 17.321 5.524 -1.650 1.00 34.42 H new ATOM 0 HZ3 LYS A 13 15.999 4.935 -2.538 1.00 34.42 H new ATOM 206 N GLU A 14 16.833 0.506 3.690 1.00 62.14 N ATOM 207 CA GLU A 14 17.732 0.761 4.810 1.00 75.43 C ATOM 208 C GLU A 14 18.376 -0.535 5.296 1.00 53.41 C ATOM 209 O GLU A 14 19.506 -0.533 5.783 1.00 71.54 O ATOM 210 CB GLU A 14 16.973 1.429 5.959 1.00 63.53 C ATOM 211 CG GLU A 14 17.878 2.127 6.960 1.00 32.33 C ATOM 212 CD GLU A 14 17.135 3.138 7.811 1.00 12.13 C ATOM 213 OE1 GLU A 14 16.112 2.762 8.422 1.00 64.40 O ATOM 214 OE2 GLU A 14 17.575 4.305 7.867 1.00 51.34 O ATOM 0 H GLU A 14 15.842 0.542 3.927 1.00 62.14 H new ATOM 0 HA GLU A 14 18.520 1.431 4.466 1.00 75.43 H new ATOM 0 HB2 GLU A 14 16.272 2.155 5.547 1.00 63.53 H new ATOM 0 HB3 GLU A 14 16.382 0.676 6.480 1.00 63.53 H new ATOM 0 HG2 GLU A 14 18.340 1.382 7.608 1.00 32.33 H new ATOM 0 HG3 GLU A 14 18.685 2.630 6.426 1.00 32.33 H new ATOM 221 N ALA A 15 17.647 -1.638 5.160 1.00 3.14 N ATOM 222 CA ALA A 15 18.147 -2.940 5.584 1.00 61.02 C ATOM 223 C ALA A 15 19.262 -3.426 4.664 1.00 3.40 C ATOM 224 O ALA A 15 20.193 -4.101 5.103 1.00 2.04 O ATOM 225 CB ALA A 15 17.013 -3.954 5.622 1.00 1.31 C ATOM 0 H ALA A 15 16.709 -1.656 4.760 1.00 3.14 H new ATOM 0 HA ALA A 15 18.559 -2.834 6.587 1.00 61.02 H new ATOM 0 HB1 ALA A 15 17.401 -4.922 5.940 1.00 1.31 H new ATOM 0 HB2 ALA A 15 16.250 -3.620 6.325 1.00 1.31 H new ATOM 0 HB3 ALA A 15 16.575 -4.048 4.628 1.00 1.31 H new ATOM 231 N PHE A 16 19.162 -3.078 3.385 1.00 13.03 N ATOM 232 CA PHE A 16 20.161 -3.480 2.403 1.00 65.31 C ATOM 233 C PHE A 16 21.432 -2.648 2.548 1.00 23.20 C ATOM 234 O PHE A 16 22.528 -3.189 2.693 1.00 23.50 O ATOM 235 CB PHE A 16 19.602 -3.335 0.986 1.00 3.10 C ATOM 236 CG PHE A 16 20.596 -3.674 -0.088 1.00 51.42 C ATOM 237 CD1 PHE A 16 20.899 -4.994 -0.379 1.00 2.14 C ATOM 238 CD2 PHE A 16 21.227 -2.671 -0.807 1.00 61.43 C ATOM 239 CE1 PHE A 16 21.813 -5.309 -1.367 1.00 31.12 C ATOM 240 CE2 PHE A 16 22.141 -2.980 -1.797 1.00 21.42 C ATOM 241 CZ PHE A 16 22.435 -4.301 -2.076 1.00 43.31 C ATOM 0 H PHE A 16 18.399 -2.518 3.005 1.00 13.03 H new ATOM 0 HA PHE A 16 20.410 -4.526 2.583 1.00 65.31 H new ATOM 0 HB2 PHE A 16 18.730 -3.981 0.880 1.00 3.10 H new ATOM 0 HB3 PHE A 16 19.259 -2.310 0.842 1.00 3.10 H new ATOM 0 HD1 PHE A 16 20.415 -5.787 0.173 1.00 2.14 H new ATOM 0 HD2 PHE A 16 21.002 -1.637 -0.591 1.00 61.43 H new ATOM 0 HE1 PHE A 16 22.040 -6.342 -1.584 1.00 31.12 H new ATOM 0 HE2 PHE A 16 22.625 -2.190 -2.352 1.00 21.42 H new ATOM 0 HZ PHE A 16 23.150 -4.545 -2.848 1.00 43.31 H new ATOM 251 N SER A 17 21.276 -1.329 2.507 1.00 4.23 N ATOM 252 CA SER A 17 22.411 -0.421 2.630 1.00 50.02 C ATOM 253 C SER A 17 23.222 -0.731 3.884 1.00 11.04 C ATOM 254 O SER A 17 24.433 -0.508 3.926 1.00 15.24 O ATOM 255 CB SER A 17 21.928 1.030 2.666 1.00 3.35 C ATOM 256 OG SER A 17 23.017 1.932 2.570 1.00 52.43 O ATOM 0 H SER A 17 20.375 -0.865 2.390 1.00 4.23 H new ATOM 0 HA SER A 17 23.053 -0.561 1.760 1.00 50.02 H new ATOM 0 HB2 SER A 17 21.233 1.206 1.845 1.00 3.35 H new ATOM 0 HB3 SER A 17 21.381 1.212 3.591 1.00 3.35 H new ATOM 0 HG SER A 17 22.682 2.853 2.594 1.00 52.43 H new ATOM 262 N LEU A 18 22.546 -1.247 4.905 1.00 2.32 N ATOM 263 CA LEU A 18 23.202 -1.588 6.163 1.00 63.34 C ATOM 264 C LEU A 18 24.234 -2.693 5.956 1.00 13.00 C ATOM 265 O LEU A 18 25.332 -2.643 6.511 1.00 73.13 O ATOM 266 CB LEU A 18 22.166 -2.029 7.198 1.00 62.41 C ATOM 267 CG LEU A 18 22.632 -2.031 8.654 1.00 34.34 C ATOM 268 CD1 LEU A 18 23.132 -0.653 9.057 1.00 42.23 C ATOM 269 CD2 LEU A 18 21.505 -2.481 9.574 1.00 41.24 C ATOM 0 H LEU A 18 21.544 -1.438 4.886 1.00 2.32 H new ATOM 0 HA LEU A 18 23.716 -0.699 6.529 1.00 63.34 H new ATOM 0 HB2 LEU A 18 21.298 -1.374 7.116 1.00 62.41 H new ATOM 0 HB3 LEU A 18 21.832 -3.035 6.943 1.00 62.41 H new ATOM 0 HG LEU A 18 23.457 -2.737 8.750 1.00 34.34 H new ATOM 0 HD11 LEU A 18 23.459 -0.674 10.096 1.00 42.23 H new ATOM 0 HD12 LEU A 18 23.969 -0.369 8.419 1.00 42.23 H new ATOM 0 HD13 LEU A 18 22.327 0.073 8.945 1.00 42.23 H new ATOM 0 HD21 LEU A 18 21.854 -2.476 10.606 1.00 41.24 H new ATOM 0 HD22 LEU A 18 20.660 -1.800 9.474 1.00 41.24 H new ATOM 0 HD23 LEU A 18 21.193 -3.489 9.301 1.00 41.24 H new ATOM 281 N PHE A 19 23.874 -3.689 5.153 1.00 51.31 N ATOM 282 CA PHE A 19 24.768 -4.805 4.872 1.00 64.53 C ATOM 283 C PHE A 19 25.836 -4.405 3.858 1.00 71.25 C ATOM 284 O PHE A 19 26.956 -4.916 3.885 1.00 72.04 O ATOM 285 CB PHE A 19 23.974 -6.003 4.347 1.00 71.30 C ATOM 286 CG PHE A 19 23.415 -6.875 5.435 1.00 52.20 C ATOM 287 CD1 PHE A 19 24.216 -7.806 6.076 1.00 44.41 C ATOM 288 CD2 PHE A 19 22.088 -6.763 5.817 1.00 13.22 C ATOM 289 CE1 PHE A 19 23.704 -8.609 7.077 1.00 61.22 C ATOM 290 CE2 PHE A 19 21.570 -7.564 6.818 1.00 52.51 C ATOM 291 CZ PHE A 19 22.380 -8.487 7.449 1.00 35.21 C ATOM 0 H PHE A 19 22.969 -3.745 4.686 1.00 51.31 H new ATOM 0 HA PHE A 19 25.262 -5.085 5.802 1.00 64.53 H new ATOM 0 HB2 PHE A 19 23.155 -5.642 3.725 1.00 71.30 H new ATOM 0 HB3 PHE A 19 24.619 -6.604 3.706 1.00 71.30 H new ATOM 0 HD1 PHE A 19 25.253 -7.905 5.790 1.00 44.41 H new ATOM 0 HD2 PHE A 19 21.451 -6.042 5.327 1.00 13.22 H new ATOM 0 HE1 PHE A 19 24.339 -9.332 7.568 1.00 61.22 H new ATOM 0 HE2 PHE A 19 20.534 -7.468 7.106 1.00 52.51 H new ATOM 0 HZ PHE A 19 21.979 -9.113 8.232 1.00 35.21 H new ATOM 301 N ASP A 20 25.480 -3.489 2.964 1.00 43.11 N ATOM 302 CA ASP A 20 26.407 -3.019 1.941 1.00 52.24 C ATOM 303 C ASP A 20 27.414 -2.037 2.530 1.00 44.43 C ATOM 304 O ASP A 20 27.119 -0.853 2.697 1.00 24.12 O ATOM 305 CB ASP A 20 25.641 -2.357 0.794 1.00 12.22 C ATOM 306 CG ASP A 20 26.350 -2.505 -0.538 1.00 2.45 C ATOM 307 OD1 ASP A 20 27.428 -3.134 -0.569 1.00 64.32 O ATOM 308 OD2 ASP A 20 25.827 -1.991 -1.548 1.00 73.42 O ATOM 0 H ASP A 20 24.557 -3.057 2.927 1.00 43.11 H new ATOM 0 HA ASP A 20 26.951 -3.881 1.555 1.00 52.24 H new ATOM 0 HB2 ASP A 20 24.646 -2.797 0.724 1.00 12.22 H new ATOM 0 HB3 ASP A 20 25.506 -1.298 1.015 1.00 12.22 H new ATOM 313 N LYS A 21 28.605 -2.536 2.844 1.00 42.54 N ATOM 314 CA LYS A 21 29.658 -1.703 3.414 1.00 33.32 C ATOM 315 C LYS A 21 30.138 -0.665 2.405 1.00 35.01 C ATOM 316 O LYS A 21 30.221 0.524 2.715 1.00 35.41 O ATOM 317 CB LYS A 21 30.834 -2.572 3.867 1.00 52.32 C ATOM 318 CG LYS A 21 31.601 -1.991 5.042 1.00 65.40 C ATOM 319 CD LYS A 21 30.987 -2.405 6.369 1.00 72.25 C ATOM 320 CE LYS A 21 32.032 -2.465 7.472 1.00 34.23 C ATOM 321 NZ LYS A 21 31.430 -2.254 8.818 1.00 54.01 N ATOM 0 H LYS A 21 28.865 -3.514 2.713 1.00 42.54 H new ATOM 0 HA LYS A 21 29.246 -1.180 4.277 1.00 33.32 H new ATOM 0 HB2 LYS A 21 30.462 -3.560 4.139 1.00 52.32 H new ATOM 0 HB3 LYS A 21 31.518 -2.709 3.029 1.00 52.32 H new ATOM 0 HG2 LYS A 21 32.638 -2.323 5.001 1.00 65.40 H new ATOM 0 HG3 LYS A 21 31.612 -0.904 4.969 1.00 65.40 H new ATOM 0 HD2 LYS A 21 30.205 -1.698 6.645 1.00 72.25 H new ATOM 0 HD3 LYS A 21 30.512 -3.380 6.263 1.00 72.25 H new ATOM 0 HE2 LYS A 21 32.533 -3.433 7.446 1.00 34.23 H new ATOM 0 HE3 LYS A 21 32.794 -1.707 7.292 1.00 34.23 H new ATOM 0 HZ1 LYS A 21 32.174 -2.302 9.543 1.00 54.01 H new ATOM 0 HZ2 LYS A 21 30.974 -1.320 8.852 1.00 54.01 H new ATOM 0 HZ3 LYS A 21 30.721 -2.992 9.001 1.00 54.01 H new ATOM 335 N ASP A 22 30.451 -1.121 1.197 1.00 34.24 N ATOM 336 CA ASP A 22 30.920 -0.231 0.142 1.00 75.03 C ATOM 337 C ASP A 22 29.747 0.460 -0.547 1.00 51.20 C ATOM 338 O ASP A 22 29.935 1.386 -1.335 1.00 72.23 O ATOM 339 CB ASP A 22 31.742 -1.011 -0.885 1.00 20.42 C ATOM 340 CG ASP A 22 30.886 -1.928 -1.737 1.00 10.14 C ATOM 341 OD1 ASP A 22 29.747 -2.231 -1.323 1.00 10.41 O ATOM 342 OD2 ASP A 22 31.355 -2.342 -2.817 1.00 54.24 O ATOM 0 H ASP A 22 30.388 -2.102 0.924 1.00 34.24 H new ATOM 0 HA ASP A 22 31.551 0.531 0.598 1.00 75.03 H new ATOM 0 HB2 ASP A 22 32.271 -0.310 -1.530 1.00 20.42 H new ATOM 0 HB3 ASP A 22 32.498 -1.602 -0.368 1.00 20.42 H new ATOM 347 N GLY A 23 28.536 0.003 -0.244 1.00 73.31 N ATOM 348 CA GLY A 23 27.350 0.588 -0.843 1.00 65.44 C ATOM 349 C GLY A 23 27.441 0.660 -2.355 1.00 34.02 C ATOM 350 O GLY A 23 27.106 1.681 -2.955 1.00 55.22 O ATOM 0 H GLY A 23 28.355 -0.762 0.406 1.00 73.31 H new ATOM 0 HA2 GLY A 23 26.477 -0.000 -0.562 1.00 65.44 H new ATOM 0 HA3 GLY A 23 27.201 1.591 -0.443 1.00 65.44 H new ATOM 354 N ASP A 24 27.896 -0.425 -2.971 1.00 74.23 N ATOM 355 CA ASP A 24 28.030 -0.481 -4.422 1.00 52.43 C ATOM 356 C ASP A 24 26.735 -0.962 -5.070 1.00 0.22 C ATOM 357 O ASP A 24 26.540 -0.814 -6.275 1.00 74.14 O ATOM 358 CB ASP A 24 29.184 -1.404 -4.814 1.00 44.12 C ATOM 359 CG ASP A 24 28.896 -2.858 -4.496 1.00 45.03 C ATOM 360 OD1 ASP A 24 28.019 -3.117 -3.646 1.00 72.32 O ATOM 361 OD2 ASP A 24 29.548 -3.737 -5.098 1.00 41.31 O ATOM 0 H ASP A 24 28.178 -1.278 -2.488 1.00 74.23 H new ATOM 0 HA ASP A 24 28.242 0.526 -4.781 1.00 52.43 H new ATOM 0 HB2 ASP A 24 29.382 -1.301 -5.881 1.00 44.12 H new ATOM 0 HB3 ASP A 24 30.088 -1.093 -4.291 1.00 44.12 H new ATOM 366 N GLY A 25 25.853 -1.540 -4.260 1.00 1.34 N ATOM 367 CA GLY A 25 24.589 -2.035 -4.772 1.00 31.23 C ATOM 368 C GLY A 25 24.557 -3.547 -4.873 1.00 61.32 C ATOM 369 O GLY A 25 23.499 -4.141 -5.085 1.00 64.44 O ATOM 0 H GLY A 25 25.992 -1.674 -3.258 1.00 1.34 H new ATOM 0 HA2 GLY A 25 23.781 -1.700 -4.122 1.00 31.23 H new ATOM 0 HA3 GLY A 25 24.405 -1.604 -5.756 1.00 31.23 H new ATOM 373 N THR A 26 25.720 -4.174 -4.723 1.00 41.41 N ATOM 374 CA THR A 26 25.822 -5.625 -4.802 1.00 22.30 C ATOM 375 C THR A 26 26.592 -6.188 -3.613 1.00 2.23 C ATOM 376 O THR A 26 27.680 -5.712 -3.285 1.00 33.24 O ATOM 377 CB THR A 26 26.515 -6.070 -6.104 1.00 54.11 C ATOM 378 OG1 THR A 26 27.757 -5.376 -6.260 1.00 1.50 O ATOM 379 CG2 THR A 26 25.624 -5.803 -7.309 1.00 24.54 C ATOM 0 H THR A 26 26.605 -3.698 -4.546 1.00 41.41 H new ATOM 0 HA THR A 26 24.804 -6.014 -4.789 1.00 22.30 H new ATOM 0 HB THR A 26 26.704 -7.142 -6.041 1.00 54.11 H new ATOM 0 HG1 THR A 26 28.120 -5.153 -5.378 1.00 1.50 H new ATOM 0 HG21 THR A 26 26.134 -6.125 -8.217 1.00 24.54 H new ATOM 0 HG22 THR A 26 24.691 -6.356 -7.201 1.00 24.54 H new ATOM 0 HG23 THR A 26 25.408 -4.736 -7.373 1.00 24.54 H new ATOM 387 N ILE A 27 26.022 -7.202 -2.971 1.00 65.42 N ATOM 388 CA ILE A 27 26.657 -7.830 -1.819 1.00 64.32 C ATOM 389 C ILE A 27 27.431 -9.078 -2.230 1.00 61.44 C ATOM 390 O ILE A 27 26.844 -10.079 -2.643 1.00 20.43 O ATOM 391 CB ILE A 27 25.622 -8.212 -0.745 1.00 23.52 C ATOM 392 CG1 ILE A 27 24.676 -7.040 -0.477 1.00 23.11 C ATOM 393 CG2 ILE A 27 26.322 -8.639 0.537 1.00 2.10 C ATOM 394 CD1 ILE A 27 23.589 -7.358 0.525 1.00 11.14 C ATOM 0 H ILE A 27 25.122 -7.606 -3.229 1.00 65.42 H new ATOM 0 HA ILE A 27 27.348 -7.098 -1.402 1.00 64.32 H new ATOM 0 HB ILE A 27 25.033 -9.053 -1.112 1.00 23.52 H new ATOM 0 HG12 ILE A 27 25.256 -6.191 -0.115 1.00 23.11 H new ATOM 0 HG13 ILE A 27 24.215 -6.734 -1.416 1.00 23.11 H new ATOM 0 HG21 ILE A 27 25.577 -8.906 1.287 1.00 2.10 H new ATOM 0 HG22 ILE A 27 26.958 -9.501 0.335 1.00 2.10 H new ATOM 0 HG23 ILE A 27 26.933 -7.817 0.909 1.00 2.10 H new ATOM 0 HD11 ILE A 27 22.956 -6.482 0.666 1.00 11.14 H new ATOM 0 HD12 ILE A 27 22.985 -8.186 0.156 1.00 11.14 H new ATOM 0 HD13 ILE A 27 24.042 -7.635 1.477 1.00 11.14 H new ATOM 406 N THR A 28 28.754 -9.013 -2.114 1.00 31.21 N ATOM 407 CA THR A 28 29.609 -10.138 -2.472 1.00 40.44 C ATOM 408 C THR A 28 29.951 -10.980 -1.249 1.00 23.11 C ATOM 409 O THR A 28 29.589 -10.636 -0.123 1.00 42.33 O ATOM 410 CB THR A 28 30.915 -9.661 -3.135 1.00 63.12 C ATOM 411 OG1 THR A 28 31.777 -9.074 -2.154 1.00 14.44 O ATOM 412 CG2 THR A 28 30.627 -8.650 -4.234 1.00 53.24 C ATOM 0 H THR A 28 29.257 -8.193 -1.775 1.00 31.21 H new ATOM 0 HA THR A 28 29.050 -10.747 -3.183 1.00 40.44 H new ATOM 0 HB THR A 28 31.407 -10.526 -3.579 1.00 63.12 H new ATOM 0 HG1 THR A 28 32.606 -8.775 -2.584 1.00 14.44 H new ATOM 0 HG21 THR A 28 31.565 -8.328 -4.687 1.00 53.24 H new ATOM 0 HG22 THR A 28 29.995 -9.109 -4.994 1.00 53.24 H new ATOM 0 HG23 THR A 28 30.114 -7.787 -3.809 1.00 53.24 H new ATOM 420 N THR A 29 30.652 -12.087 -1.475 1.00 42.13 N ATOM 421 CA THR A 29 31.043 -12.979 -0.391 1.00 62.13 C ATOM 422 C THR A 29 31.921 -12.258 0.625 1.00 42.12 C ATOM 423 O THR A 29 31.819 -12.495 1.829 1.00 52.23 O ATOM 424 CB THR A 29 31.799 -14.211 -0.923 1.00 61.40 C ATOM 425 OG1 THR A 29 33.012 -13.803 -1.565 1.00 1.21 O ATOM 426 CG2 THR A 29 30.938 -14.992 -1.904 1.00 63.54 C ATOM 0 H THR A 29 30.961 -12.387 -2.400 1.00 42.13 H new ATOM 0 HA THR A 29 30.124 -13.307 0.095 1.00 62.13 H new ATOM 0 HB THR A 29 32.036 -14.857 -0.078 1.00 61.40 H new ATOM 0 HG1 THR A 29 33.487 -14.593 -1.899 1.00 1.21 H new ATOM 0 HG21 THR A 29 31.493 -15.857 -2.266 1.00 63.54 H new ATOM 0 HG22 THR A 29 30.029 -15.327 -1.404 1.00 63.54 H new ATOM 0 HG23 THR A 29 30.674 -14.352 -2.746 1.00 63.54 H new ATOM 434 N LYS A 30 32.785 -11.376 0.133 1.00 14.42 N ATOM 435 CA LYS A 30 33.680 -10.617 0.998 1.00 23.12 C ATOM 436 C LYS A 30 32.890 -9.767 1.988 1.00 43.10 C ATOM 437 O LYS A 30 33.150 -9.797 3.190 1.00 11.33 O ATOM 438 CB LYS A 30 34.597 -9.723 0.160 1.00 73.24 C ATOM 439 CG LYS A 30 35.389 -10.481 -0.892 1.00 4.35 C ATOM 440 CD LYS A 30 36.607 -11.161 -0.289 1.00 20.12 C ATOM 441 CE LYS A 30 37.721 -10.164 -0.008 1.00 71.04 C ATOM 442 NZ LYS A 30 39.053 -10.826 0.066 1.00 74.44 N ATOM 0 H LYS A 30 32.884 -11.169 -0.861 1.00 14.42 H new ATOM 0 HA LYS A 30 34.288 -11.326 1.560 1.00 23.12 H new ATOM 0 HB2 LYS A 30 33.995 -8.958 -0.331 1.00 73.24 H new ATOM 0 HB3 LYS A 30 35.291 -9.206 0.823 1.00 73.24 H new ATOM 0 HG2 LYS A 30 34.749 -11.228 -1.362 1.00 4.35 H new ATOM 0 HG3 LYS A 30 35.706 -9.793 -1.676 1.00 4.35 H new ATOM 0 HD2 LYS A 30 36.324 -11.662 0.637 1.00 20.12 H new ATOM 0 HD3 LYS A 30 36.970 -11.931 -0.970 1.00 20.12 H new ATOM 0 HE2 LYS A 30 37.735 -9.406 -0.791 1.00 71.04 H new ATOM 0 HE3 LYS A 30 37.519 -9.649 0.931 1.00 71.04 H new ATOM 0 HZ1 LYS A 30 39.785 -10.113 0.259 1.00 74.44 H new ATOM 0 HZ2 LYS A 30 39.048 -11.532 0.830 1.00 74.44 H new ATOM 0 HZ3 LYS A 30 39.258 -11.296 -0.839 1.00 74.44 H new ATOM 456 N GLU A 31 31.925 -9.012 1.474 1.00 52.53 N ATOM 457 CA GLU A 31 31.097 -8.154 2.314 1.00 61.10 C ATOM 458 C GLU A 31 30.125 -8.984 3.148 1.00 64.20 C ATOM 459 O GLU A 31 29.786 -8.618 4.274 1.00 23.11 O ATOM 460 CB GLU A 31 30.322 -7.154 1.454 1.00 42.14 C ATOM 461 CG GLU A 31 31.175 -6.007 0.936 1.00 33.43 C ATOM 462 CD GLU A 31 30.403 -5.071 0.026 1.00 25.40 C ATOM 463 OE1 GLU A 31 29.226 -4.787 0.329 1.00 12.13 O ATOM 464 OE2 GLU A 31 30.977 -4.624 -0.989 1.00 32.01 O ATOM 0 H GLU A 31 31.697 -8.977 0.480 1.00 52.53 H new ATOM 0 HA GLU A 31 31.755 -7.607 2.990 1.00 61.10 H new ATOM 0 HB2 GLU A 31 29.882 -7.680 0.607 1.00 42.14 H new ATOM 0 HB3 GLU A 31 29.497 -6.747 2.039 1.00 42.14 H new ATOM 0 HG2 GLU A 31 31.570 -5.443 1.781 1.00 33.43 H new ATOM 0 HG3 GLU A 31 32.030 -6.411 0.394 1.00 33.43 H new ATOM 471 N LEU A 32 29.680 -10.103 2.587 1.00 25.22 N ATOM 472 CA LEU A 32 28.747 -10.986 3.278 1.00 60.42 C ATOM 473 C LEU A 32 29.412 -11.649 4.480 1.00 42.01 C ATOM 474 O LEU A 32 28.832 -11.721 5.562 1.00 35.20 O ATOM 475 CB LEU A 32 28.221 -12.055 2.318 1.00 33.23 C ATOM 476 CG LEU A 32 26.887 -12.699 2.697 1.00 33.24 C ATOM 477 CD1 LEU A 32 27.030 -13.511 3.976 1.00 52.25 C ATOM 478 CD2 LEU A 32 25.808 -11.638 2.856 1.00 51.35 C ATOM 0 H LEU A 32 29.950 -10.420 1.656 1.00 25.22 H new ATOM 0 HA LEU A 32 27.912 -10.384 3.635 1.00 60.42 H new ATOM 0 HB2 LEU A 32 28.118 -11.608 1.329 1.00 33.23 H new ATOM 0 HB3 LEU A 32 28.971 -12.842 2.236 1.00 33.23 H new ATOM 0 HG LEU A 32 26.590 -13.373 1.893 1.00 33.24 H new ATOM 0 HD11 LEU A 32 26.071 -13.962 4.230 1.00 52.25 H new ATOM 0 HD12 LEU A 32 27.772 -14.296 3.828 1.00 52.25 H new ATOM 0 HD13 LEU A 32 27.350 -12.858 4.788 1.00 52.25 H new ATOM 0 HD21 LEU A 32 24.866 -12.115 3.126 1.00 51.35 H new ATOM 0 HD22 LEU A 32 26.098 -10.939 3.640 1.00 51.35 H new ATOM 0 HD23 LEU A 32 25.686 -11.099 1.916 1.00 51.35 H new ATOM 490 N GLY A 33 30.636 -12.130 4.282 1.00 30.12 N ATOM 491 CA GLY A 33 31.361 -12.778 5.359 1.00 21.52 C ATOM 492 C GLY A 33 31.829 -11.798 6.416 1.00 42.53 C ATOM 493 O GLY A 33 31.986 -12.158 7.583 1.00 43.41 O ATOM 0 H GLY A 33 31.138 -12.082 3.395 1.00 30.12 H new ATOM 0 HA2 GLY A 33 30.722 -13.529 5.822 1.00 21.52 H new ATOM 0 HA3 GLY A 33 32.223 -13.303 4.948 1.00 21.52 H new ATOM 497 N THR A 34 32.055 -10.553 6.007 1.00 11.30 N ATOM 498 CA THR A 34 32.511 -9.517 6.926 1.00 73.31 C ATOM 499 C THR A 34 31.408 -9.124 7.902 1.00 53.12 C ATOM 500 O THR A 34 31.603 -9.145 9.117 1.00 23.50 O ATOM 501 CB THR A 34 32.982 -8.262 6.168 1.00 1.33 C ATOM 502 OG1 THR A 34 34.074 -8.593 5.303 1.00 51.21 O ATOM 503 CG2 THR A 34 33.411 -7.173 7.140 1.00 52.41 C ATOM 0 H THR A 34 31.930 -10.238 5.045 1.00 11.30 H new ATOM 0 HA THR A 34 33.352 -9.934 7.481 1.00 73.31 H new ATOM 0 HB THR A 34 32.148 -7.889 5.573 1.00 1.33 H new ATOM 0 HG1 THR A 34 33.730 -8.825 4.415 1.00 51.21 H new ATOM 0 HG21 THR A 34 33.740 -6.296 6.582 1.00 52.41 H new ATOM 0 HG22 THR A 34 32.570 -6.903 7.778 1.00 52.41 H new ATOM 0 HG23 THR A 34 34.231 -7.539 7.757 1.00 52.41 H new ATOM 511 N VAL A 35 30.247 -8.765 7.362 1.00 31.04 N ATOM 512 CA VAL A 35 29.111 -8.368 8.186 1.00 23.33 C ATOM 513 C VAL A 35 28.807 -9.421 9.246 1.00 75.32 C ATOM 514 O VAL A 35 28.699 -9.110 10.431 1.00 33.25 O ATOM 515 CB VAL A 35 27.851 -8.137 7.331 1.00 4.52 C ATOM 516 CG1 VAL A 35 26.701 -7.647 8.197 1.00 34.43 C ATOM 517 CG2 VAL A 35 28.143 -7.150 6.211 1.00 53.05 C ATOM 0 H VAL A 35 30.069 -8.741 6.358 1.00 31.04 H new ATOM 0 HA VAL A 35 29.385 -7.433 8.675 1.00 23.33 H new ATOM 0 HB VAL A 35 27.558 -9.086 6.882 1.00 4.52 H new ATOM 0 HG11 VAL A 35 25.819 -7.489 7.576 1.00 34.43 H new ATOM 0 HG12 VAL A 35 26.478 -8.392 8.961 1.00 34.43 H new ATOM 0 HG13 VAL A 35 26.980 -6.708 8.676 1.00 34.43 H new ATOM 0 HG21 VAL A 35 27.242 -6.998 5.616 1.00 53.05 H new ATOM 0 HG22 VAL A 35 28.461 -6.199 6.638 1.00 53.05 H new ATOM 0 HG23 VAL A 35 28.935 -7.545 5.575 1.00 53.05 H new ATOM 527 N MET A 36 28.669 -10.669 8.810 1.00 62.24 N ATOM 528 CA MET A 36 28.379 -11.769 9.721 1.00 35.45 C ATOM 529 C MET A 36 29.369 -11.790 10.881 1.00 21.43 C ATOM 530 O MET A 36 28.995 -12.055 12.024 1.00 24.11 O ATOM 531 CB MET A 36 28.421 -13.104 8.975 1.00 44.04 C ATOM 532 CG MET A 36 27.050 -13.617 8.567 1.00 14.31 C ATOM 533 SD MET A 36 26.155 -12.451 7.522 1.00 70.42 S ATOM 534 CE MET A 36 24.955 -13.537 6.755 1.00 74.22 C ATOM 0 H MET A 36 28.753 -10.943 7.831 1.00 62.24 H new ATOM 0 HA MET A 36 27.377 -11.618 10.124 1.00 35.45 H new ATOM 0 HB2 MET A 36 29.038 -12.993 8.083 1.00 44.04 H new ATOM 0 HB3 MET A 36 28.905 -13.849 9.607 1.00 44.04 H new ATOM 0 HG2 MET A 36 27.163 -14.562 8.036 1.00 14.31 H new ATOM 0 HG3 MET A 36 26.462 -13.823 9.462 1.00 14.31 H new ATOM 0 HE1 MET A 36 24.313 -12.958 6.091 1.00 74.22 H new ATOM 0 HE2 MET A 36 25.474 -14.304 6.180 1.00 74.22 H new ATOM 0 HE3 MET A 36 24.347 -14.010 7.526 1.00 74.22 H new ATOM 544 N ARG A 37 30.633 -11.510 10.580 1.00 73.44 N ATOM 545 CA ARG A 37 31.677 -11.499 11.597 1.00 13.12 C ATOM 546 C ARG A 37 31.332 -10.523 12.718 1.00 2.05 C ATOM 547 O ARG A 37 31.481 -10.840 13.899 1.00 72.25 O ATOM 548 CB ARG A 37 33.022 -11.122 10.974 1.00 51.11 C ATOM 549 CG ARG A 37 34.205 -11.338 11.903 1.00 65.43 C ATOM 550 CD ARG A 37 35.484 -11.606 11.123 1.00 15.13 C ATOM 551 NE ARG A 37 36.492 -12.276 11.940 1.00 44.34 N ATOM 552 CZ ARG A 37 37.231 -11.654 12.852 1.00 50.21 C ATOM 553 NH1 ARG A 37 37.074 -10.354 13.063 1.00 33.45 N ATOM 554 NH2 ARG A 37 38.129 -12.332 13.555 1.00 32.02 N ATOM 0 H ARG A 37 30.959 -11.288 9.639 1.00 73.44 H new ATOM 0 HA ARG A 37 31.749 -12.501 12.020 1.00 13.12 H new ATOM 0 HB2 ARG A 37 33.170 -11.709 10.068 1.00 51.11 H new ATOM 0 HB3 ARG A 37 32.993 -10.075 10.674 1.00 51.11 H new ATOM 0 HG2 ARG A 37 34.339 -10.459 12.533 1.00 65.43 H new ATOM 0 HG3 ARG A 37 33.999 -12.178 12.567 1.00 65.43 H new ATOM 0 HD2 ARG A 37 35.256 -12.221 10.252 1.00 15.13 H new ATOM 0 HD3 ARG A 37 35.886 -10.664 10.751 1.00 15.13 H new ATOM 0 HE ARG A 37 36.637 -13.276 11.803 1.00 44.34 H new ATOM 0 HH11 ARG A 37 36.385 -9.830 12.524 1.00 33.45 H new ATOM 0 HH12 ARG A 37 37.643 -9.879 13.764 1.00 33.45 H new ATOM 0 HH21 ARG A 37 38.253 -13.332 13.395 1.00 32.02 H new ATOM 0 HH22 ARG A 37 38.696 -11.853 14.255 1.00 32.02 H new ATOM 568 N SER A 38 30.872 -9.335 12.341 1.00 11.50 N ATOM 569 CA SER A 38 30.511 -8.310 13.314 1.00 35.52 C ATOM 570 C SER A 38 29.283 -8.732 14.117 1.00 64.54 C ATOM 571 O SER A 38 29.092 -8.300 15.254 1.00 31.10 O ATOM 572 CB SER A 38 30.240 -6.980 12.609 1.00 1.24 C ATOM 573 OG SER A 38 28.851 -6.780 12.412 1.00 21.05 O ATOM 0 H SER A 38 30.740 -9.058 11.368 1.00 11.50 H new ATOM 0 HA SER A 38 31.348 -8.185 14.001 1.00 35.52 H new ATOM 0 HB2 SER A 38 30.648 -6.161 13.202 1.00 1.24 H new ATOM 0 HB3 SER A 38 30.753 -6.964 11.647 1.00 1.24 H new ATOM 0 HG SER A 38 28.513 -7.440 11.771 1.00 21.05 H new ATOM 579 N LEU A 39 28.455 -9.580 13.516 1.00 13.53 N ATOM 580 CA LEU A 39 27.245 -10.062 14.174 1.00 52.53 C ATOM 581 C LEU A 39 27.546 -11.276 15.046 1.00 70.22 C ATOM 582 O LEU A 39 26.795 -11.594 15.967 1.00 55.43 O ATOM 583 CB LEU A 39 26.182 -10.418 13.132 1.00 4.14 C ATOM 584 CG LEU A 39 25.815 -9.312 12.143 1.00 52.41 C ATOM 585 CD1 LEU A 39 24.662 -9.752 11.254 1.00 10.21 C ATOM 586 CD2 LEU A 39 25.461 -8.030 12.883 1.00 34.02 C ATOM 0 H LEU A 39 28.599 -9.948 12.576 1.00 13.53 H new ATOM 0 HA LEU A 39 26.866 -9.265 14.813 1.00 52.53 H new ATOM 0 HB2 LEU A 39 26.531 -11.282 12.567 1.00 4.14 H new ATOM 0 HB3 LEU A 39 25.277 -10.724 13.656 1.00 4.14 H new ATOM 0 HG LEU A 39 26.680 -9.115 11.510 1.00 52.41 H new ATOM 0 HD11 LEU A 39 24.415 -8.952 10.556 1.00 10.21 H new ATOM 0 HD12 LEU A 39 24.952 -10.643 10.697 1.00 10.21 H new ATOM 0 HD13 LEU A 39 23.792 -9.977 11.871 1.00 10.21 H new ATOM 0 HD21 LEU A 39 25.202 -7.254 12.163 1.00 34.02 H new ATOM 0 HD22 LEU A 39 24.611 -8.212 13.541 1.00 34.02 H new ATOM 0 HD23 LEU A 39 26.316 -7.704 13.476 1.00 34.02 H new ATOM 598 N GLY A 40 28.653 -11.951 14.750 1.00 73.32 N ATOM 599 CA GLY A 40 29.035 -13.122 15.517 1.00 30.13 C ATOM 600 C GLY A 40 28.698 -14.417 14.805 1.00 24.33 C ATOM 601 O GLY A 40 28.408 -15.427 15.446 1.00 30.00 O ATOM 0 H GLY A 40 29.292 -11.708 13.993 1.00 73.32 H new ATOM 0 HA2 GLY A 40 30.106 -13.089 15.716 1.00 30.13 H new ATOM 0 HA3 GLY A 40 28.531 -13.100 16.483 1.00 30.13 H new ATOM 605 N GLN A 41 28.736 -14.388 13.477 1.00 10.31 N ATOM 606 CA GLN A 41 28.430 -15.568 12.678 1.00 31.52 C ATOM 607 C GLN A 41 29.624 -15.969 11.819 1.00 44.12 C ATOM 608 O GLN A 41 30.120 -15.175 11.020 1.00 24.42 O ATOM 609 CB GLN A 41 27.212 -15.308 11.790 1.00 1.41 C ATOM 610 CG GLN A 41 25.888 -15.628 12.464 1.00 13.42 C ATOM 611 CD GLN A 41 24.825 -16.075 11.480 1.00 21.50 C ATOM 612 OE1 GLN A 41 25.061 -16.123 10.272 1.00 3.35 O ATOM 613 NE2 GLN A 41 23.646 -16.408 11.992 1.00 12.41 N ATOM 0 H GLN A 41 28.976 -13.560 12.932 1.00 10.31 H new ATOM 0 HA GLN A 41 28.205 -16.388 13.360 1.00 31.52 H new ATOM 0 HB2 GLN A 41 27.212 -14.261 11.486 1.00 1.41 H new ATOM 0 HB3 GLN A 41 27.301 -15.904 10.882 1.00 1.41 H new ATOM 0 HG2 GLN A 41 26.043 -16.411 13.206 1.00 13.42 H new ATOM 0 HG3 GLN A 41 25.535 -14.747 12.999 1.00 13.42 H new ATOM 0 HE21 GLN A 41 23.494 -16.353 12.999 1.00 12.41 H new ATOM 0 HE22 GLN A 41 22.893 -16.718 11.378 1.00 12.41 H new ATOM 622 N ASN A 42 30.082 -17.205 11.989 1.00 73.21 N ATOM 623 CA ASN A 42 31.219 -17.711 11.229 1.00 2.31 C ATOM 624 C ASN A 42 30.774 -18.765 10.220 1.00 50.43 C ATOM 625 O ASN A 42 30.955 -19.966 10.419 1.00 73.12 O ATOM 626 CB ASN A 42 32.267 -18.303 12.173 1.00 21.33 C ATOM 627 CG ASN A 42 33.630 -18.426 11.520 1.00 23.13 C ATOM 628 OD1 ASN A 42 33.740 -18.796 10.351 1.00 12.31 O ATOM 629 ND2 ASN A 42 34.678 -18.116 12.275 1.00 31.02 N ATOM 0 H ASN A 42 29.683 -17.875 12.647 1.00 73.21 H new ATOM 0 HA ASN A 42 31.660 -16.876 10.684 1.00 2.31 H new ATOM 0 HB2 ASN A 42 32.348 -17.676 13.061 1.00 21.33 H new ATOM 0 HB3 ASN A 42 31.937 -19.287 12.507 1.00 21.33 H new ATOM 0 HD21 ASN A 42 35.621 -18.180 11.890 1.00 31.02 H new ATOM 0 HD22 ASN A 42 34.540 -17.814 13.239 1.00 31.02 H new ATOM 636 N PRO A 43 30.178 -18.306 9.109 1.00 0.21 N ATOM 637 CA PRO A 43 29.696 -19.192 8.046 1.00 73.12 C ATOM 638 C PRO A 43 30.837 -19.852 7.279 1.00 53.21 C ATOM 639 O PRO A 43 31.855 -19.220 6.995 1.00 62.30 O ATOM 640 CB PRO A 43 28.909 -18.251 7.130 1.00 61.44 C ATOM 641 CG PRO A 43 29.508 -16.907 7.363 1.00 70.35 C ATOM 642 CD PRO A 43 29.930 -16.886 8.806 1.00 72.43 C ATOM 0 HA PRO A 43 29.105 -20.018 8.441 1.00 73.12 H new ATOM 0 HB2 PRO A 43 28.999 -18.549 6.085 1.00 61.44 H new ATOM 0 HB3 PRO A 43 27.847 -18.259 7.373 1.00 61.44 H new ATOM 0 HG2 PRO A 43 30.361 -16.740 6.705 1.00 70.35 H new ATOM 0 HG3 PRO A 43 28.786 -16.117 7.156 1.00 70.35 H new ATOM 0 HD2 PRO A 43 30.825 -16.281 8.954 1.00 72.43 H new ATOM 0 HD3 PRO A 43 29.153 -16.468 9.446 1.00 72.43 H new ATOM 650 N THR A 44 30.660 -21.126 6.945 1.00 62.51 N ATOM 651 CA THR A 44 31.675 -21.872 6.211 1.00 1.04 C ATOM 652 C THR A 44 31.742 -21.424 4.756 1.00 53.02 C ATOM 653 O THR A 44 30.809 -20.805 4.245 1.00 43.32 O ATOM 654 CB THR A 44 31.403 -23.387 6.258 1.00 34.33 C ATOM 655 OG1 THR A 44 30.254 -23.703 5.464 1.00 61.44 O ATOM 656 CG2 THR A 44 31.179 -23.853 7.689 1.00 3.11 C ATOM 0 H THR A 44 29.823 -21.663 7.171 1.00 62.51 H new ATOM 0 HA THR A 44 32.630 -21.667 6.696 1.00 1.04 H new ATOM 0 HB THR A 44 32.275 -23.903 5.857 1.00 34.33 H new ATOM 0 HG1 THR A 44 30.089 -24.668 5.498 1.00 61.44 H new ATOM 0 HG21 THR A 44 30.989 -24.926 7.697 1.00 3.11 H new ATOM 0 HG22 THR A 44 32.066 -23.637 8.285 1.00 3.11 H new ATOM 0 HG23 THR A 44 30.322 -23.330 8.112 1.00 3.11 H new ATOM 664 N GLU A 45 32.850 -21.742 4.094 1.00 52.24 N ATOM 665 CA GLU A 45 33.036 -21.371 2.696 1.00 45.12 C ATOM 666 C GLU A 45 31.848 -21.819 1.851 1.00 72.25 C ATOM 667 O GLU A 45 31.367 -21.078 0.994 1.00 41.11 O ATOM 668 CB GLU A 45 34.326 -21.987 2.149 1.00 21.05 C ATOM 669 CG GLU A 45 34.715 -21.467 0.776 1.00 51.31 C ATOM 670 CD GLU A 45 36.160 -21.766 0.426 1.00 33.11 C ATOM 671 OE1 GLU A 45 36.844 -22.423 1.239 1.00 53.53 O ATOM 672 OE2 GLU A 45 36.606 -21.344 -0.661 1.00 50.52 O ATOM 0 H GLU A 45 33.631 -22.255 4.502 1.00 52.24 H new ATOM 0 HA GLU A 45 33.109 -20.285 2.642 1.00 45.12 H new ATOM 0 HB2 GLU A 45 35.139 -21.787 2.847 1.00 21.05 H new ATOM 0 HB3 GLU A 45 34.209 -23.069 2.098 1.00 21.05 H new ATOM 0 HG2 GLU A 45 34.063 -21.913 0.025 1.00 51.31 H new ATOM 0 HG3 GLU A 45 34.552 -20.390 0.740 1.00 51.31 H new ATOM 679 N ALA A 46 31.379 -23.038 2.098 1.00 24.01 N ATOM 680 CA ALA A 46 30.247 -23.585 1.362 1.00 72.33 C ATOM 681 C ALA A 46 28.941 -22.924 1.791 1.00 25.45 C ATOM 682 O ALA A 46 28.017 -22.780 0.993 1.00 52.53 O ATOM 683 CB ALA A 46 30.168 -25.092 1.559 1.00 54.04 C ATOM 0 H ALA A 46 31.766 -23.665 2.803 1.00 24.01 H new ATOM 0 HA ALA A 46 30.399 -23.375 0.303 1.00 72.33 H new ATOM 0 HB1 ALA A 46 29.318 -25.487 1.004 1.00 54.04 H new ATOM 0 HB2 ALA A 46 31.086 -25.555 1.196 1.00 54.04 H new ATOM 0 HB3 ALA A 46 30.044 -25.314 2.619 1.00 54.04 H new ATOM 689 N GLU A 47 28.874 -22.526 3.058 1.00 30.31 N ATOM 690 CA GLU A 47 27.680 -21.882 3.593 1.00 22.10 C ATOM 691 C GLU A 47 27.456 -20.522 2.938 1.00 2.03 C ATOM 692 O GLU A 47 26.361 -20.222 2.462 1.00 74.42 O ATOM 693 CB GLU A 47 27.799 -21.717 5.110 1.00 51.04 C ATOM 694 CG GLU A 47 26.477 -21.412 5.794 1.00 42.51 C ATOM 695 CD GLU A 47 26.546 -21.584 7.299 1.00 72.01 C ATOM 696 OE1 GLU A 47 27.516 -22.206 7.780 1.00 33.43 O ATOM 697 OE2 GLU A 47 25.630 -21.097 7.995 1.00 65.32 O ATOM 0 H GLU A 47 29.631 -22.638 3.732 1.00 30.31 H new ATOM 0 HA GLU A 47 26.824 -22.519 3.370 1.00 22.10 H new ATOM 0 HB2 GLU A 47 28.216 -22.630 5.535 1.00 51.04 H new ATOM 0 HB3 GLU A 47 28.504 -20.914 5.326 1.00 51.04 H new ATOM 0 HG2 GLU A 47 26.180 -20.389 5.562 1.00 42.51 H new ATOM 0 HG3 GLU A 47 25.704 -22.068 5.392 1.00 42.51 H new ATOM 704 N LEU A 48 28.501 -19.702 2.919 1.00 23.21 N ATOM 705 CA LEU A 48 28.420 -18.373 2.324 1.00 41.14 C ATOM 706 C LEU A 48 27.938 -18.452 0.879 1.00 70.03 C ATOM 707 O LEU A 48 27.048 -17.707 0.470 1.00 11.33 O ATOM 708 CB LEU A 48 29.784 -17.683 2.381 1.00 10.40 C ATOM 709 CG LEU A 48 30.281 -17.292 3.774 1.00 75.14 C ATOM 710 CD1 LEU A 48 31.784 -17.062 3.759 1.00 32.32 C ATOM 711 CD2 LEU A 48 29.554 -16.051 4.270 1.00 0.41 C ATOM 0 H LEU A 48 29.414 -19.934 3.309 1.00 23.21 H new ATOM 0 HA LEU A 48 27.700 -17.789 2.897 1.00 41.14 H new ATOM 0 HB2 LEU A 48 30.522 -18.343 1.926 1.00 10.40 H new ATOM 0 HB3 LEU A 48 29.740 -16.783 1.767 1.00 10.40 H new ATOM 0 HG LEU A 48 30.067 -18.112 4.459 1.00 75.14 H new ATOM 0 HD11 LEU A 48 32.120 -16.785 4.758 1.00 32.32 H new ATOM 0 HD12 LEU A 48 32.289 -17.976 3.447 1.00 32.32 H new ATOM 0 HD13 LEU A 48 32.022 -16.260 3.061 1.00 32.32 H new ATOM 0 HD21 LEU A 48 29.920 -15.787 5.262 1.00 0.41 H new ATOM 0 HD22 LEU A 48 29.737 -15.224 3.584 1.00 0.41 H new ATOM 0 HD23 LEU A 48 28.484 -16.252 4.320 1.00 0.41 H new ATOM 723 N GLN A 49 28.530 -19.361 0.112 1.00 65.45 N ATOM 724 CA GLN A 49 28.160 -19.538 -1.288 1.00 32.55 C ATOM 725 C GLN A 49 26.735 -20.069 -1.410 1.00 41.23 C ATOM 726 O GLN A 49 26.047 -19.804 -2.396 1.00 73.51 O ATOM 727 CB GLN A 49 29.134 -20.495 -1.978 1.00 52.30 C ATOM 728 CG GLN A 49 28.984 -20.529 -3.490 1.00 54.24 C ATOM 729 CD GLN A 49 29.197 -19.170 -4.129 1.00 34.42 C ATOM 730 OE1 GLN A 49 28.119 -18.408 -4.272 1.00 24.20 O flip ATOM 731 NE2 GLN A 49 30.317 -18.810 -4.490 1.00 1.44 N flip ATOM 0 H GLN A 49 29.268 -19.987 0.436 1.00 65.45 H new ATOM 0 HA GLN A 49 28.210 -18.565 -1.777 1.00 32.55 H new ATOM 0 HB2 GLN A 49 30.154 -20.204 -1.729 1.00 52.30 H new ATOM 0 HB3 GLN A 49 28.984 -21.500 -1.584 1.00 52.30 H new ATOM 0 HG2 GLN A 49 29.700 -21.238 -3.906 1.00 54.24 H new ATOM 0 HG3 GLN A 49 27.989 -20.894 -3.744 1.00 54.24 H new ATOM 0 HE21 GLN A 49 31.118 -19.428 -4.361 1.00 1.44 H new ATOM 0 HE22 GLN A 49 30.445 -17.893 -4.919 1.00 1.44 H new ATOM 740 N ASP A 50 26.299 -20.818 -0.404 1.00 24.04 N ATOM 741 CA ASP A 50 24.956 -21.385 -0.398 1.00 71.22 C ATOM 742 C ASP A 50 23.907 -20.296 -0.195 1.00 21.33 C ATOM 743 O ASP A 50 22.930 -20.216 -0.938 1.00 52.31 O ATOM 744 CB ASP A 50 24.830 -22.443 0.699 1.00 22.21 C ATOM 745 CG ASP A 50 23.630 -23.347 0.497 1.00 63.41 C ATOM 746 OD1 ASP A 50 23.048 -23.321 -0.607 1.00 74.21 O ATOM 747 OD2 ASP A 50 23.273 -24.081 1.443 1.00 43.31 O ATOM 0 H ASP A 50 26.857 -21.047 0.419 1.00 24.04 H new ATOM 0 HA ASP A 50 24.783 -21.855 -1.366 1.00 71.22 H new ATOM 0 HB2 ASP A 50 25.737 -23.048 0.722 1.00 22.21 H new ATOM 0 HB3 ASP A 50 24.751 -21.950 1.668 1.00 22.21 H new ATOM 752 N MET A 51 24.117 -19.461 0.818 1.00 61.52 N ATOM 753 CA MET A 51 23.190 -18.377 1.119 1.00 75.23 C ATOM 754 C MET A 51 23.058 -17.429 -0.069 1.00 3.33 C ATOM 755 O MET A 51 21.961 -17.215 -0.586 1.00 3.14 O ATOM 756 CB MET A 51 23.657 -17.605 2.354 1.00 64.12 C ATOM 757 CG MET A 51 23.773 -18.466 3.601 1.00 34.12 C ATOM 758 SD MET A 51 24.172 -17.505 5.074 1.00 75.40 S ATOM 759 CE MET A 51 22.561 -17.388 5.848 1.00 55.51 C ATOM 0 H MET A 51 24.921 -19.515 1.444 1.00 61.52 H new ATOM 0 HA MET A 51 22.213 -18.814 1.322 1.00 75.23 H new ATOM 0 HB2 MET A 51 24.626 -17.152 2.144 1.00 64.12 H new ATOM 0 HB3 MET A 51 22.959 -16.790 2.548 1.00 64.12 H new ATOM 0 HG2 MET A 51 22.834 -18.996 3.761 1.00 34.12 H new ATOM 0 HG3 MET A 51 24.543 -19.222 3.446 1.00 34.12 H new ATOM 0 HE1 MET A 51 22.392 -16.365 6.184 1.00 55.51 H new ATOM 0 HE2 MET A 51 21.791 -17.666 5.129 1.00 55.51 H new ATOM 0 HE3 MET A 51 22.518 -18.062 6.703 1.00 55.51 H new ATOM 769 N ILE A 52 24.182 -16.863 -0.495 1.00 64.14 N ATOM 770 CA ILE A 52 24.192 -15.938 -1.622 1.00 73.52 C ATOM 771 C ILE A 52 23.523 -16.556 -2.846 1.00 24.12 C ATOM 772 O ILE A 52 22.736 -15.905 -3.530 1.00 51.34 O ATOM 773 CB ILE A 52 25.626 -15.517 -1.993 1.00 10.04 C ATOM 774 CG1 ILE A 52 26.311 -14.855 -0.796 1.00 5.14 C ATOM 775 CG2 ILE A 52 25.609 -14.576 -3.188 1.00 4.33 C ATOM 776 CD1 ILE A 52 27.732 -14.419 -1.078 1.00 22.01 C ATOM 0 H ILE A 52 25.098 -17.029 -0.077 1.00 64.14 H new ATOM 0 HA ILE A 52 23.632 -15.056 -1.311 1.00 73.52 H new ATOM 0 HB ILE A 52 26.192 -16.408 -2.265 1.00 10.04 H new ATOM 0 HG12 ILE A 52 25.728 -13.987 -0.488 1.00 5.14 H new ATOM 0 HG13 ILE A 52 26.313 -15.552 0.042 1.00 5.14 H new ATOM 0 HG21 ILE A 52 26.630 -14.287 -3.438 1.00 4.33 H new ATOM 0 HG22 ILE A 52 25.155 -15.080 -4.041 1.00 4.33 H new ATOM 0 HG23 ILE A 52 25.030 -13.686 -2.942 1.00 4.33 H new ATOM 0 HD11 ILE A 52 28.155 -13.958 -0.185 1.00 22.01 H new ATOM 0 HD12 ILE A 52 28.330 -15.286 -1.357 1.00 22.01 H new ATOM 0 HD13 ILE A 52 27.736 -13.698 -1.895 1.00 22.01 H new ATOM 788 N ASN A 53 23.842 -17.818 -3.113 1.00 62.44 N ATOM 789 CA ASN A 53 23.271 -18.525 -4.254 1.00 65.42 C ATOM 790 C ASN A 53 21.762 -18.679 -4.099 1.00 34.53 C ATOM 791 O ASN A 53 21.013 -18.561 -5.068 1.00 41.41 O ATOM 792 CB ASN A 53 23.923 -19.901 -4.406 1.00 31.53 C ATOM 793 CG ASN A 53 25.275 -19.829 -5.089 1.00 31.11 C ATOM 794 OD1 ASN A 53 25.684 -18.772 -5.569 1.00 63.13 O ATOM 795 ND2 ASN A 53 25.975 -20.956 -5.135 1.00 63.43 N ATOM 0 H ASN A 53 24.492 -18.372 -2.556 1.00 62.44 H new ATOM 0 HA ASN A 53 23.468 -17.936 -5.150 1.00 65.42 H new ATOM 0 HB2 ASN A 53 24.040 -20.355 -3.422 1.00 31.53 H new ATOM 0 HB3 ASN A 53 23.263 -20.551 -4.981 1.00 31.53 H new ATOM 0 HD21 ASN A 53 26.892 -20.969 -5.582 1.00 63.43 H new ATOM 0 HD22 ASN A 53 25.596 -21.809 -4.724 1.00 63.43 H new ATOM 802 N GLU A 54 21.322 -18.944 -2.872 1.00 64.12 N ATOM 803 CA GLU A 54 19.902 -19.114 -2.590 1.00 72.45 C ATOM 804 C GLU A 54 19.124 -17.847 -2.932 1.00 13.22 C ATOM 805 O GLU A 54 17.961 -17.907 -3.332 1.00 61.40 O ATOM 806 CB GLU A 54 19.691 -19.475 -1.118 1.00 53.34 C ATOM 807 CG GLU A 54 20.103 -20.896 -0.775 1.00 31.14 C ATOM 808 CD GLU A 54 20.571 -21.037 0.661 1.00 44.33 C ATOM 809 OE1 GLU A 54 20.326 -20.107 1.458 1.00 34.20 O ATOM 810 OE2 GLU A 54 21.184 -22.075 0.987 1.00 54.03 O ATOM 0 H GLU A 54 21.929 -19.045 -2.058 1.00 64.12 H new ATOM 0 HA GLU A 54 19.529 -19.927 -3.212 1.00 72.45 H new ATOM 0 HB2 GLU A 54 20.258 -18.781 -0.498 1.00 53.34 H new ATOM 0 HB3 GLU A 54 18.639 -19.340 -0.867 1.00 53.34 H new ATOM 0 HG2 GLU A 54 19.260 -21.566 -0.946 1.00 31.14 H new ATOM 0 HG3 GLU A 54 20.902 -21.211 -1.446 1.00 31.14 H new ATOM 817 N VAL A 55 19.774 -16.699 -2.770 1.00 51.30 N ATOM 818 CA VAL A 55 19.145 -15.416 -3.061 1.00 74.11 C ATOM 819 C VAL A 55 19.674 -14.828 -4.364 1.00 55.42 C ATOM 820 O VAL A 55 19.476 -13.646 -4.649 1.00 71.30 O ATOM 821 CB VAL A 55 19.377 -14.406 -1.922 1.00 43.53 C ATOM 822 CG1 VAL A 55 18.664 -14.854 -0.656 1.00 54.21 C ATOM 823 CG2 VAL A 55 20.866 -14.223 -1.669 1.00 1.22 C ATOM 0 H VAL A 55 20.736 -16.631 -2.439 1.00 51.30 H new ATOM 0 HA VAL A 55 18.075 -15.602 -3.158 1.00 74.11 H new ATOM 0 HB VAL A 55 18.961 -13.444 -2.222 1.00 43.53 H new ATOM 0 HG11 VAL A 55 18.840 -14.127 0.137 1.00 54.21 H new ATOM 0 HG12 VAL A 55 17.594 -14.929 -0.848 1.00 54.21 H new ATOM 0 HG13 VAL A 55 19.046 -15.827 -0.348 1.00 54.21 H new ATOM 0 HG21 VAL A 55 21.012 -13.506 -0.861 1.00 1.22 H new ATOM 0 HG22 VAL A 55 21.308 -15.180 -1.390 1.00 1.22 H new ATOM 0 HG23 VAL A 55 21.346 -13.852 -2.575 1.00 1.22 H new ATOM 833 N ASP A 56 20.346 -15.659 -5.152 1.00 41.02 N ATOM 834 CA ASP A 56 20.903 -15.222 -6.427 1.00 51.22 C ATOM 835 C ASP A 56 19.897 -15.422 -7.557 1.00 22.14 C ATOM 836 O ASP A 56 19.732 -16.531 -8.065 1.00 2.34 O ATOM 837 CB ASP A 56 22.192 -15.986 -6.734 1.00 11.21 C ATOM 838 CG ASP A 56 23.055 -15.277 -7.760 1.00 35.42 C ATOM 839 OD1 ASP A 56 22.652 -14.190 -8.225 1.00 21.31 O ATOM 840 OD2 ASP A 56 24.133 -15.810 -8.097 1.00 15.41 O ATOM 0 H ASP A 56 20.519 -16.640 -4.931 1.00 41.02 H new ATOM 0 HA ASP A 56 21.130 -14.159 -6.351 1.00 51.22 H new ATOM 0 HB2 ASP A 56 22.761 -16.118 -5.814 1.00 11.21 H new ATOM 0 HB3 ASP A 56 21.942 -16.982 -7.100 1.00 11.21 H new ATOM 845 N ALA A 57 19.227 -14.342 -7.944 1.00 12.34 N ATOM 846 CA ALA A 57 18.238 -14.399 -9.013 1.00 41.31 C ATOM 847 C ALA A 57 18.888 -14.176 -10.374 1.00 64.23 C ATOM 848 O ALA A 57 18.616 -14.903 -11.330 1.00 34.45 O ATOM 849 CB ALA A 57 17.143 -13.370 -8.775 1.00 11.33 C ATOM 0 H ALA A 57 19.351 -13.417 -7.533 1.00 12.34 H new ATOM 0 HA ALA A 57 17.793 -15.394 -9.010 1.00 41.31 H new ATOM 0 HB1 ALA A 57 16.411 -13.424 -9.581 1.00 11.33 H new ATOM 0 HB2 ALA A 57 16.651 -13.575 -7.824 1.00 11.33 H new ATOM 0 HB3 ALA A 57 17.581 -12.372 -8.749 1.00 11.33 H new ATOM 855 N ASP A 58 19.748 -13.167 -10.456 1.00 24.11 N ATOM 856 CA ASP A 58 20.438 -12.849 -11.701 1.00 22.02 C ATOM 857 C ASP A 58 21.650 -13.754 -11.897 1.00 62.41 C ATOM 858 O ASP A 58 22.365 -13.645 -12.893 1.00 33.13 O ATOM 859 CB ASP A 58 20.875 -11.383 -11.707 1.00 33.21 C ATOM 860 CG ASP A 58 22.052 -11.126 -10.787 1.00 11.21 C ATOM 861 OD1 ASP A 58 22.270 -11.935 -9.861 1.00 71.40 O ATOM 862 OD2 ASP A 58 22.756 -10.115 -10.993 1.00 73.42 O ATOM 0 H ASP A 58 19.984 -12.555 -9.675 1.00 24.11 H new ATOM 0 HA ASP A 58 19.744 -13.017 -12.525 1.00 22.02 H new ATOM 0 HB2 ASP A 58 21.141 -11.090 -12.723 1.00 33.21 H new ATOM 0 HB3 ASP A 58 20.037 -10.756 -11.404 1.00 33.21 H new ATOM 867 N GLY A 59 21.876 -14.648 -10.939 1.00 63.42 N ATOM 868 CA GLY A 59 23.003 -15.559 -11.025 1.00 42.22 C ATOM 869 C GLY A 59 24.317 -14.836 -11.245 1.00 41.14 C ATOM 870 O GLY A 59 25.030 -15.110 -12.210 1.00 21.44 O ATOM 0 H GLY A 59 21.299 -14.758 -10.105 1.00 63.42 H new ATOM 0 HA2 GLY A 59 23.063 -16.145 -10.108 1.00 42.22 H new ATOM 0 HA3 GLY A 59 22.837 -16.261 -11.842 1.00 42.22 H new ATOM 874 N ASN A 60 24.637 -13.908 -10.350 1.00 5.33 N ATOM 875 CA ASN A 60 25.874 -13.141 -10.452 1.00 52.03 C ATOM 876 C ASN A 60 26.808 -13.457 -9.288 1.00 62.24 C ATOM 877 O ASN A 60 27.998 -13.148 -9.332 1.00 41.22 O ATOM 878 CB ASN A 60 25.568 -11.642 -10.483 1.00 32.25 C ATOM 879 CG ASN A 60 24.882 -11.166 -9.216 1.00 62.43 C ATOM 880 OD1 ASN A 60 24.500 -11.969 -8.365 1.00 73.30 O ATOM 881 ND2 ASN A 60 24.723 -9.854 -9.087 1.00 25.31 N ATOM 0 H ASN A 60 24.057 -13.668 -9.546 1.00 5.33 H new ATOM 0 HA ASN A 60 26.371 -13.423 -11.380 1.00 52.03 H new ATOM 0 HB2 ASN A 60 26.496 -11.087 -10.621 1.00 32.25 H new ATOM 0 HB3 ASN A 60 24.934 -11.421 -11.341 1.00 32.25 H new ATOM 0 HD21 ASN A 60 24.268 -9.475 -8.257 1.00 25.31 H new ATOM 0 HD22 ASN A 60 25.056 -9.226 -9.818 1.00 25.31 H new ATOM 888 N GLY A 61 26.260 -14.077 -8.248 1.00 12.24 N ATOM 889 CA GLY A 61 27.058 -14.425 -7.087 1.00 30.32 C ATOM 890 C GLY A 61 27.041 -13.343 -6.025 1.00 71.24 C ATOM 891 O GLY A 61 27.874 -13.338 -5.119 1.00 22.34 O ATOM 0 H GLY A 61 25.278 -14.345 -8.189 1.00 12.24 H new ATOM 0 HA2 GLY A 61 26.685 -15.355 -6.659 1.00 30.32 H new ATOM 0 HA3 GLY A 61 28.086 -14.608 -7.399 1.00 30.32 H new ATOM 895 N THR A 62 26.090 -12.421 -6.137 1.00 74.25 N ATOM 896 CA THR A 62 25.969 -11.327 -5.182 1.00 31.40 C ATOM 897 C THR A 62 24.513 -10.911 -5.004 1.00 44.10 C ATOM 898 O THR A 62 23.656 -11.253 -5.819 1.00 42.12 O ATOM 899 CB THR A 62 26.791 -10.102 -5.624 1.00 23.22 C ATOM 900 OG1 THR A 62 26.218 -9.526 -6.803 1.00 32.52 O ATOM 901 CG2 THR A 62 28.237 -10.490 -5.895 1.00 2.05 C ATOM 0 H THR A 62 25.392 -12.410 -6.881 1.00 74.25 H new ATOM 0 HA THR A 62 26.358 -11.692 -4.232 1.00 31.40 H new ATOM 0 HB THR A 62 26.772 -9.370 -4.817 1.00 23.22 H new ATOM 0 HG1 THR A 62 26.888 -8.972 -7.255 1.00 32.52 H new ATOM 0 HG21 THR A 62 28.798 -9.609 -6.206 1.00 2.05 H new ATOM 0 HG22 THR A 62 28.680 -10.901 -4.988 1.00 2.05 H new ATOM 0 HG23 THR A 62 28.271 -11.239 -6.686 1.00 2.05 H new ATOM 909 N ILE A 63 24.241 -10.171 -3.935 1.00 3.34 N ATOM 910 CA ILE A 63 22.889 -9.706 -3.652 1.00 31.22 C ATOM 911 C ILE A 63 22.704 -8.256 -4.086 1.00 33.14 C ATOM 912 O ILE A 63 23.254 -7.340 -3.475 1.00 40.40 O ATOM 913 CB ILE A 63 22.553 -9.829 -2.154 1.00 4.13 C ATOM 914 CG1 ILE A 63 22.934 -11.218 -1.636 1.00 15.54 C ATOM 915 CG2 ILE A 63 21.075 -9.556 -1.918 1.00 4.01 C ATOM 916 CD1 ILE A 63 22.651 -11.411 -0.162 1.00 75.23 C ATOM 0 H ILE A 63 24.939 -9.880 -3.250 1.00 3.34 H new ATOM 0 HA ILE A 63 22.211 -10.342 -4.221 1.00 31.22 H new ATOM 0 HB ILE A 63 23.131 -9.086 -1.605 1.00 4.13 H new ATOM 0 HG12 ILE A 63 22.388 -11.971 -2.204 1.00 15.54 H new ATOM 0 HG13 ILE A 63 23.995 -11.387 -1.819 1.00 15.54 H new ATOM 0 HG21 ILE A 63 20.853 -9.647 -0.855 1.00 4.01 H new ATOM 0 HG22 ILE A 63 20.833 -8.548 -2.254 1.00 4.01 H new ATOM 0 HG23 ILE A 63 20.478 -10.278 -2.476 1.00 4.01 H new ATOM 0 HD11 ILE A 63 22.945 -12.417 0.136 1.00 75.23 H new ATOM 0 HD12 ILE A 63 23.218 -10.681 0.416 1.00 75.23 H new ATOM 0 HD13 ILE A 63 21.586 -11.274 0.025 1.00 75.23 H new ATOM 928 N ASP A 64 21.924 -8.056 -5.142 1.00 40.33 N ATOM 929 CA ASP A 64 21.663 -6.716 -5.657 1.00 20.31 C ATOM 930 C ASP A 64 20.677 -5.973 -4.761 1.00 44.51 C ATOM 931 O ASP A 64 20.312 -6.454 -3.688 1.00 71.05 O ATOM 932 CB ASP A 64 21.117 -6.792 -7.084 1.00 24.43 C ATOM 933 CG ASP A 64 21.667 -5.695 -7.973 1.00 43.31 C ATOM 934 OD1 ASP A 64 22.223 -4.715 -7.433 1.00 23.43 O ATOM 935 OD2 ASP A 64 21.542 -5.815 -9.210 1.00 24.24 O ATOM 0 H ASP A 64 21.461 -8.804 -5.659 1.00 40.33 H new ATOM 0 HA ASP A 64 22.604 -6.167 -5.666 1.00 20.31 H new ATOM 0 HB2 ASP A 64 21.365 -7.763 -7.514 1.00 24.43 H new ATOM 0 HB3 ASP A 64 20.029 -6.724 -7.058 1.00 24.43 H new ATOM 940 N PHE A 65 20.252 -4.796 -5.208 1.00 14.31 N ATOM 941 CA PHE A 65 19.310 -3.984 -4.446 1.00 12.11 C ATOM 942 C PHE A 65 17.954 -4.677 -4.342 1.00 4.01 C ATOM 943 O PHE A 65 17.450 -4.949 -3.252 1.00 72.23 O ATOM 944 CB PHE A 65 19.144 -2.610 -5.098 1.00 50.22 C ATOM 945 CG PHE A 65 17.828 -1.955 -4.790 1.00 1.33 C ATOM 946 CD1 PHE A 65 17.422 -1.769 -3.478 1.00 23.01 C ATOM 947 CD2 PHE A 65 16.997 -1.524 -5.811 1.00 41.03 C ATOM 948 CE1 PHE A 65 16.212 -1.167 -3.191 1.00 74.24 C ATOM 949 CE2 PHE A 65 15.785 -0.921 -5.531 1.00 24.01 C ATOM 950 CZ PHE A 65 15.393 -0.742 -4.219 1.00 53.41 C ATOM 0 H PHE A 65 20.545 -4.383 -6.094 1.00 14.31 H new ATOM 0 HA PHE A 65 19.711 -3.855 -3.441 1.00 12.11 H new ATOM 0 HB2 PHE A 65 19.952 -1.959 -4.764 1.00 50.22 H new ATOM 0 HB3 PHE A 65 19.244 -2.715 -6.178 1.00 50.22 H new ATOM 0 HD1 PHE A 65 18.059 -2.099 -2.670 1.00 23.01 H new ATOM 0 HD2 PHE A 65 17.300 -1.661 -6.839 1.00 41.03 H new ATOM 0 HE1 PHE A 65 15.907 -1.029 -2.164 1.00 74.24 H new ATOM 0 HE2 PHE A 65 15.146 -0.591 -6.337 1.00 24.01 H new ATOM 0 HZ PHE A 65 14.447 -0.270 -3.997 1.00 53.41 H new ATOM 960 N PRO A 66 17.349 -4.969 -5.503 1.00 24.32 N ATOM 961 CA PRO A 66 16.045 -5.634 -5.570 1.00 15.00 C ATOM 962 C PRO A 66 16.113 -7.091 -5.126 1.00 33.12 C ATOM 963 O PRO A 66 15.118 -7.659 -4.675 1.00 3.40 O ATOM 964 CB PRO A 66 15.676 -5.544 -7.053 1.00 44.30 C ATOM 965 CG PRO A 66 16.982 -5.437 -7.762 1.00 5.53 C ATOM 966 CD PRO A 66 17.893 -4.674 -6.839 1.00 52.01 C ATOM 0 HA PRO A 66 15.316 -5.169 -4.906 1.00 15.00 H new ATOM 0 HB2 PRO A 66 15.121 -6.424 -7.377 1.00 44.30 H new ATOM 0 HB3 PRO A 66 15.045 -4.678 -7.252 1.00 44.30 H new ATOM 0 HG2 PRO A 66 17.388 -6.424 -7.983 1.00 5.53 H new ATOM 0 HG3 PRO A 66 16.868 -4.919 -8.714 1.00 5.53 H new ATOM 0 HD2 PRO A 66 18.928 -5.003 -6.933 1.00 52.01 H new ATOM 0 HD3 PRO A 66 17.878 -3.605 -7.052 1.00 52.01 H new ATOM 974 N GLU A 67 17.292 -7.690 -5.256 1.00 22.30 N ATOM 975 CA GLU A 67 17.488 -9.082 -4.868 1.00 23.13 C ATOM 976 C GLU A 67 17.225 -9.273 -3.377 1.00 33.32 C ATOM 977 O GLU A 67 16.575 -10.236 -2.968 1.00 63.33 O ATOM 978 CB GLU A 67 18.910 -9.534 -5.207 1.00 61.15 C ATOM 979 CG GLU A 67 19.138 -9.761 -6.692 1.00 41.25 C ATOM 980 CD GLU A 67 20.109 -10.892 -6.968 1.00 23.45 C ATOM 981 OE1 GLU A 67 20.767 -11.354 -6.012 1.00 23.14 O ATOM 982 OE2 GLU A 67 20.212 -11.316 -8.138 1.00 34.14 O ATOM 0 H GLU A 67 18.126 -7.234 -5.627 1.00 22.30 H new ATOM 0 HA GLU A 67 16.778 -9.691 -5.427 1.00 23.13 H new ATOM 0 HB2 GLU A 67 19.616 -8.784 -4.850 1.00 61.15 H new ATOM 0 HB3 GLU A 67 19.127 -10.457 -4.669 1.00 61.15 H new ATOM 0 HG2 GLU A 67 18.185 -9.981 -7.173 1.00 41.25 H new ATOM 0 HG3 GLU A 67 19.518 -8.844 -7.142 1.00 41.25 H new ATOM 989 N PHE A 68 17.734 -8.349 -2.569 1.00 32.33 N ATOM 990 CA PHE A 68 17.555 -8.416 -1.123 1.00 4.10 C ATOM 991 C PHE A 68 16.111 -8.109 -0.738 1.00 71.45 C ATOM 992 O PHE A 68 15.568 -8.697 0.198 1.00 15.20 O ATOM 993 CB PHE A 68 18.500 -7.435 -0.425 1.00 52.35 C ATOM 994 CG PHE A 68 18.684 -7.718 1.038 1.00 43.10 C ATOM 995 CD1 PHE A 68 17.766 -7.256 1.968 1.00 65.24 C ATOM 996 CD2 PHE A 68 19.776 -8.445 1.484 1.00 20.21 C ATOM 997 CE1 PHE A 68 17.933 -7.515 3.315 1.00 21.31 C ATOM 998 CE2 PHE A 68 19.948 -8.708 2.830 1.00 14.31 C ATOM 999 CZ PHE A 68 19.026 -8.241 3.747 1.00 72.22 C ATOM 0 H PHE A 68 18.273 -7.545 -2.891 1.00 32.33 H new ATOM 0 HA PHE A 68 17.791 -9.430 -0.800 1.00 4.10 H new ATOM 0 HB2 PHE A 68 19.472 -7.466 -0.918 1.00 52.35 H new ATOM 0 HB3 PHE A 68 18.114 -6.423 -0.545 1.00 52.35 H new ATOM 0 HD1 PHE A 68 16.910 -6.687 1.636 1.00 65.24 H new ATOM 0 HD2 PHE A 68 20.501 -8.810 0.772 1.00 20.21 H new ATOM 0 HE1 PHE A 68 17.210 -7.150 4.029 1.00 21.31 H new ATOM 0 HE2 PHE A 68 20.802 -9.278 3.165 1.00 14.31 H new ATOM 0 HZ PHE A 68 19.160 -8.443 4.799 1.00 72.22 H new ATOM 1009 N LEU A 69 15.495 -7.186 -1.467 1.00 55.53 N ATOM 1010 CA LEU A 69 14.113 -6.799 -1.204 1.00 33.35 C ATOM 1011 C LEU A 69 13.169 -7.981 -1.405 1.00 1.32 C ATOM 1012 O LEU A 69 12.389 -8.325 -0.516 1.00 61.43 O ATOM 1013 CB LEU A 69 13.702 -5.643 -2.117 1.00 5.10 C ATOM 1014 CG LEU A 69 12.355 -4.989 -1.808 1.00 71.45 C ATOM 1015 CD1 LEU A 69 12.286 -4.573 -0.347 1.00 74.24 C ATOM 1016 CD2 LEU A 69 12.122 -3.792 -2.718 1.00 5.52 C ATOM 0 H LEU A 69 15.930 -6.691 -2.245 1.00 55.53 H new ATOM 0 HA LEU A 69 14.045 -6.475 -0.166 1.00 33.35 H new ATOM 0 HB2 LEU A 69 14.475 -4.876 -2.069 1.00 5.10 H new ATOM 0 HB3 LEU A 69 13.679 -6.008 -3.144 1.00 5.10 H new ATOM 0 HG LEU A 69 11.567 -5.719 -1.993 1.00 71.45 H new ATOM 0 HD11 LEU A 69 11.320 -4.109 -0.146 1.00 74.24 H new ATOM 0 HD12 LEU A 69 12.406 -5.451 0.287 1.00 74.24 H new ATOM 0 HD13 LEU A 69 13.082 -3.860 -0.134 1.00 74.24 H new ATOM 0 HD21 LEU A 69 11.159 -3.339 -2.484 1.00 5.52 H new ATOM 0 HD22 LEU A 69 12.914 -3.059 -2.565 1.00 5.52 H new ATOM 0 HD23 LEU A 69 12.126 -4.119 -3.758 1.00 5.52 H new ATOM 1028 N THR A 70 13.247 -8.600 -2.579 1.00 34.24 N ATOM 1029 CA THR A 70 12.401 -9.744 -2.897 1.00 10.25 C ATOM 1030 C THR A 70 12.643 -10.893 -1.925 1.00 60.53 C ATOM 1031 O THR A 70 11.736 -11.672 -1.632 1.00 41.02 O ATOM 1032 CB THR A 70 12.645 -10.241 -4.334 1.00 4.12 C ATOM 1033 OG1 THR A 70 11.737 -11.303 -4.646 1.00 52.32 O ATOM 1034 CG2 THR A 70 14.077 -10.726 -4.503 1.00 3.15 C ATOM 0 H THR A 70 13.887 -8.328 -3.325 1.00 34.24 H new ATOM 0 HA THR A 70 11.368 -9.408 -2.808 1.00 10.25 H new ATOM 0 HB THR A 70 12.477 -9.408 -5.016 1.00 4.12 H new ATOM 0 HG1 THR A 70 11.898 -11.612 -5.562 1.00 52.32 H new ATOM 0 HG21 THR A 70 14.226 -11.072 -5.526 1.00 3.15 H new ATOM 0 HG22 THR A 70 14.766 -9.907 -4.293 1.00 3.15 H new ATOM 0 HG23 THR A 70 14.267 -11.546 -3.811 1.00 3.15 H new ATOM 1042 N MET A 71 13.872 -10.994 -1.429 1.00 13.33 N ATOM 1043 CA MET A 71 14.232 -12.048 -0.488 1.00 74.40 C ATOM 1044 C MET A 71 13.406 -11.942 0.790 1.00 33.10 C ATOM 1045 O MET A 71 12.870 -12.937 1.278 1.00 52.31 O ATOM 1046 CB MET A 71 15.723 -11.975 -0.153 1.00 74.41 C ATOM 1047 CG MET A 71 16.132 -12.879 0.999 1.00 54.12 C ATOM 1048 SD MET A 71 16.354 -11.977 2.544 1.00 14.21 S ATOM 1049 CE MET A 71 17.977 -11.264 2.290 1.00 52.22 C ATOM 0 H MET A 71 14.635 -10.359 -1.663 1.00 13.33 H new ATOM 0 HA MET A 71 14.019 -13.008 -0.958 1.00 74.40 H new ATOM 0 HB2 MET A 71 16.299 -12.245 -1.038 1.00 74.41 H new ATOM 0 HB3 MET A 71 15.981 -10.945 0.094 1.00 74.41 H new ATOM 0 HG2 MET A 71 15.374 -13.649 1.138 1.00 54.12 H new ATOM 0 HG3 MET A 71 17.061 -13.389 0.744 1.00 54.12 H new ATOM 0 HE1 MET A 71 18.414 -11.002 3.254 1.00 52.22 H new ATOM 0 HE2 MET A 71 18.617 -11.988 1.786 1.00 52.22 H new ATOM 0 HE3 MET A 71 17.889 -10.368 1.676 1.00 52.22 H new ATOM 1059 N MET A 72 13.308 -10.730 1.327 1.00 31.40 N ATOM 1060 CA MET A 72 12.546 -10.495 2.548 1.00 22.42 C ATOM 1061 C MET A 72 11.048 -10.498 2.263 1.00 34.23 C ATOM 1062 O MET A 72 10.276 -11.159 2.958 1.00 53.23 O ATOM 1063 CB MET A 72 12.954 -9.164 3.181 1.00 43.41 C ATOM 1064 CG MET A 72 14.022 -9.302 4.254 1.00 71.50 C ATOM 1065 SD MET A 72 13.695 -8.272 5.697 1.00 75.10 S ATOM 1066 CE MET A 72 14.051 -9.423 7.023 1.00 52.25 C ATOM 0 H MET A 72 13.746 -9.896 0.936 1.00 31.40 H new ATOM 0 HA MET A 72 12.767 -11.303 3.245 1.00 22.42 H new ATOM 0 HB2 MET A 72 13.319 -8.497 2.400 1.00 43.41 H new ATOM 0 HB3 MET A 72 12.073 -8.693 3.616 1.00 43.41 H new ATOM 0 HG2 MET A 72 14.087 -10.345 4.564 1.00 71.50 H new ATOM 0 HG3 MET A 72 14.991 -9.034 3.833 1.00 71.50 H new ATOM 0 HE1 MET A 72 14.347 -8.870 7.915 1.00 52.25 H new ATOM 0 HE2 MET A 72 13.161 -10.014 7.241 1.00 52.25 H new ATOM 0 HE3 MET A 72 14.862 -10.086 6.721 1.00 52.25 H new ATOM 1076 N ALA A 73 10.643 -9.756 1.238 1.00 3.40 N ATOM 1077 CA ALA A 73 9.238 -9.675 0.861 1.00 53.51 C ATOM 1078 C ALA A 73 8.663 -11.060 0.584 1.00 52.51 C ATOM 1079 O ALA A 73 7.467 -11.293 0.762 1.00 41.54 O ATOM 1080 CB ALA A 73 9.069 -8.778 -0.357 1.00 12.34 C ATOM 0 H ALA A 73 11.269 -9.202 0.653 1.00 3.40 H new ATOM 0 HA ALA A 73 8.688 -9.242 1.697 1.00 53.51 H new ATOM 0 HB1 ALA A 73 8.014 -8.727 -0.628 1.00 12.34 H new ATOM 0 HB2 ALA A 73 9.433 -7.777 -0.125 1.00 12.34 H new ATOM 0 HB3 ALA A 73 9.638 -9.187 -1.192 1.00 12.34 H new ATOM 1265 N ILE A 85 9.938 -29.365 6.799 1.00 4.43 N ATOM 1266 CA ILE A 85 10.306 -30.748 6.524 1.00 45.24 C ATOM 1267 C ILE A 85 11.709 -31.056 7.038 1.00 75.53 C ATOM 1268 O ILE A 85 11.977 -32.159 7.516 1.00 15.32 O ATOM 1269 CB ILE A 85 10.245 -31.057 5.016 1.00 0.01 C ATOM 1270 CG1 ILE A 85 8.844 -30.773 4.472 1.00 75.12 C ATOM 1271 CG2 ILE A 85 10.637 -32.504 4.756 1.00 43.33 C ATOM 1272 CD1 ILE A 85 8.780 -30.729 2.961 1.00 15.41 C ATOM 0 HA ILE A 85 9.584 -31.377 7.045 1.00 45.24 H new ATOM 0 HB ILE A 85 10.953 -30.410 4.498 1.00 0.01 H new ATOM 0 HG12 ILE A 85 8.160 -31.540 4.834 1.00 75.12 H new ATOM 0 HG13 ILE A 85 8.495 -29.820 4.870 1.00 75.12 H new ATOM 0 HG21 ILE A 85 10.589 -32.707 3.686 1.00 43.33 H new ATOM 0 HG22 ILE A 85 11.653 -32.676 5.113 1.00 43.33 H new ATOM 0 HG23 ILE A 85 9.951 -33.167 5.282 1.00 43.33 H new ATOM 0 HD11 ILE A 85 7.757 -30.523 2.646 1.00 15.41 H new ATOM 0 HD12 ILE A 85 9.438 -29.943 2.592 1.00 15.41 H new ATOM 0 HD13 ILE A 85 9.098 -31.689 2.555 1.00 15.41 H new ATOM 1284 N ARG A 86 12.599 -30.075 6.937 1.00 21.20 N ATOM 1285 CA ARG A 86 13.974 -30.242 7.392 1.00 0.45 C ATOM 1286 C ARG A 86 14.034 -30.343 8.914 1.00 44.52 C ATOM 1287 O ARG A 86 14.894 -31.028 9.466 1.00 45.22 O ATOM 1288 CB ARG A 86 14.837 -29.073 6.914 1.00 44.04 C ATOM 1289 CG ARG A 86 16.327 -29.290 7.123 1.00 20.40 C ATOM 1290 CD ARG A 86 17.016 -28.017 7.590 1.00 74.43 C ATOM 1291 NE ARG A 86 18.212 -27.724 6.806 1.00 44.41 N ATOM 1292 CZ ARG A 86 18.182 -27.337 5.535 1.00 2.25 C ATOM 1293 NH1 ARG A 86 17.022 -27.197 4.909 1.00 62.52 N ATOM 1294 NH2 ARG A 86 19.314 -27.088 4.889 1.00 2.14 N ATOM 0 H ARG A 86 12.393 -29.156 6.544 1.00 21.20 H new ATOM 0 HA ARG A 86 14.361 -31.168 6.967 1.00 0.45 H new ATOM 0 HB2 ARG A 86 14.648 -28.903 5.854 1.00 44.04 H new ATOM 0 HB3 ARG A 86 14.533 -28.169 7.441 1.00 44.04 H new ATOM 0 HG2 ARG A 86 16.481 -30.079 7.859 1.00 20.40 H new ATOM 0 HG3 ARG A 86 16.780 -29.630 6.192 1.00 20.40 H new ATOM 0 HD2 ARG A 86 16.321 -27.181 7.517 1.00 74.43 H new ATOM 0 HD3 ARG A 86 17.287 -28.116 8.641 1.00 74.43 H new ATOM 0 HE ARG A 86 19.121 -27.822 7.259 1.00 44.41 H new ATOM 0 HH11 ARG A 86 16.150 -27.386 5.403 1.00 62.52 H new ATOM 0 HH12 ARG A 86 17.002 -26.900 3.933 1.00 62.52 H new ATOM 0 HH21 ARG A 86 20.208 -27.194 5.368 1.00 2.14 H new ATOM 0 HH22 ARG A 86 19.290 -26.791 3.913 1.00 2.14 H new ATOM 1308 N GLU A 87 13.115 -29.655 9.584 1.00 5.44 N ATOM 1309 CA GLU A 87 13.066 -29.666 11.042 1.00 70.43 C ATOM 1310 C GLU A 87 12.482 -30.979 11.556 1.00 61.34 C ATOM 1311 O GLU A 87 13.073 -31.642 12.408 1.00 71.13 O ATOM 1312 CB GLU A 87 12.234 -28.490 11.555 1.00 13.34 C ATOM 1313 CG GLU A 87 12.652 -28.004 12.933 1.00 12.01 C ATOM 1314 CD GLU A 87 11.954 -28.753 14.052 1.00 5.21 C ATOM 1315 OE1 GLU A 87 10.807 -29.199 13.843 1.00 1.14 O ATOM 1316 OE2 GLU A 87 12.557 -28.893 15.137 1.00 2.21 O ATOM 0 H GLU A 87 12.395 -29.084 9.142 1.00 5.44 H new ATOM 0 HA GLU A 87 14.086 -29.570 11.415 1.00 70.43 H new ATOM 0 HB2 GLU A 87 12.313 -27.664 10.848 1.00 13.34 H new ATOM 0 HB3 GLU A 87 11.185 -28.784 11.585 1.00 13.34 H new ATOM 0 HG2 GLU A 87 13.731 -28.117 13.042 1.00 12.01 H new ATOM 0 HG3 GLU A 87 12.433 -26.940 13.021 1.00 12.01 H new ATOM 1323 N ALA A 88 11.318 -31.348 11.031 1.00 12.33 N ATOM 1324 CA ALA A 88 10.654 -32.581 11.435 1.00 23.10 C ATOM 1325 C ALA A 88 11.580 -33.782 11.270 1.00 12.32 C ATOM 1326 O ALA A 88 11.754 -34.575 12.195 1.00 22.32 O ATOM 1327 CB ALA A 88 9.378 -32.782 10.631 1.00 42.51 C ATOM 0 H ALA A 88 10.815 -30.810 10.325 1.00 12.33 H new ATOM 0 HA ALA A 88 10.395 -32.496 12.490 1.00 23.10 H new ATOM 0 HB1 ALA A 88 8.893 -33.707 10.944 1.00 42.51 H new ATOM 0 HB2 ALA A 88 8.704 -31.943 10.802 1.00 42.51 H new ATOM 0 HB3 ALA A 88 9.622 -32.841 9.570 1.00 42.51 H new ATOM 1333 N PHE A 89 12.171 -33.909 10.087 1.00 75.53 N ATOM 1334 CA PHE A 89 13.077 -35.015 9.800 1.00 4.03 C ATOM 1335 C PHE A 89 14.179 -35.101 10.852 1.00 22.24 C ATOM 1336 O PHE A 89 14.506 -36.185 11.337 1.00 41.31 O ATOM 1337 CB PHE A 89 13.696 -34.848 8.411 1.00 74.44 C ATOM 1338 CG PHE A 89 14.317 -36.107 7.876 1.00 75.20 C ATOM 1339 CD1 PHE A 89 13.535 -37.217 7.598 1.00 31.12 C ATOM 1340 CD2 PHE A 89 15.682 -36.181 7.651 1.00 54.54 C ATOM 1341 CE1 PHE A 89 14.104 -38.377 7.107 1.00 50.20 C ATOM 1342 CE2 PHE A 89 16.256 -37.338 7.159 1.00 3.50 C ATOM 1343 CZ PHE A 89 15.466 -38.437 6.886 1.00 41.31 C ATOM 0 H PHE A 89 12.039 -33.260 9.311 1.00 75.53 H new ATOM 0 HA PHE A 89 12.501 -35.940 9.825 1.00 4.03 H new ATOM 0 HB2 PHE A 89 12.927 -34.509 7.717 1.00 74.44 H new ATOM 0 HB3 PHE A 89 14.455 -34.067 8.452 1.00 74.44 H new ATOM 0 HD1 PHE A 89 12.469 -37.175 7.767 1.00 31.12 H new ATOM 0 HD2 PHE A 89 16.305 -35.324 7.863 1.00 54.54 H new ATOM 0 HE1 PHE A 89 13.484 -39.236 6.896 1.00 50.20 H new ATOM 0 HE2 PHE A 89 17.321 -37.382 6.988 1.00 3.50 H new ATOM 0 HZ PHE A 89 15.912 -39.342 6.500 1.00 41.31 H new ATOM 1353 N ARG A 90 14.748 -33.952 11.200 1.00 1.43 N ATOM 1354 CA ARG A 90 15.814 -33.896 12.193 1.00 23.41 C ATOM 1355 C ARG A 90 15.292 -34.282 13.574 1.00 70.41 C ATOM 1356 O ARG A 90 15.914 -35.070 14.287 1.00 43.31 O ATOM 1357 CB ARG A 90 16.424 -32.494 12.240 1.00 21.24 C ATOM 1358 CG ARG A 90 17.782 -32.443 12.922 1.00 35.12 C ATOM 1359 CD ARG A 90 17.647 -32.167 14.412 1.00 72.24 C ATOM 1360 NE ARG A 90 17.681 -30.738 14.709 1.00 51.33 N ATOM 1361 CZ ARG A 90 18.787 -30.004 14.665 1.00 65.21 C ATOM 1362 NH1 ARG A 90 19.944 -30.563 14.337 1.00 5.33 N ATOM 1363 NH2 ARG A 90 18.738 -28.709 14.949 1.00 51.14 N ATOM 0 H ARG A 90 14.488 -33.046 10.809 1.00 1.43 H new ATOM 0 HA ARG A 90 16.584 -34.610 11.902 1.00 23.41 H new ATOM 0 HB2 ARG A 90 16.523 -32.116 11.223 1.00 21.24 H new ATOM 0 HB3 ARG A 90 15.739 -31.826 12.763 1.00 21.24 H new ATOM 0 HG2 ARG A 90 18.302 -33.389 12.772 1.00 35.12 H new ATOM 0 HG3 ARG A 90 18.393 -31.667 12.461 1.00 35.12 H new ATOM 0 HD2 ARG A 90 16.711 -32.591 14.776 1.00 72.24 H new ATOM 0 HD3 ARG A 90 18.453 -32.668 14.948 1.00 72.24 H new ATOM 0 HE ARG A 90 16.807 -30.278 14.964 1.00 51.33 H new ATOM 0 HH11 ARG A 90 19.986 -31.558 14.118 1.00 5.33 H new ATOM 0 HH12 ARG A 90 20.792 -29.998 14.304 1.00 5.33 H new ATOM 0 HH21 ARG A 90 17.850 -28.276 15.202 1.00 51.14 H new ATOM 0 HH22 ARG A 90 19.588 -28.147 14.915 1.00 51.14 H new ATOM 1377 N VAL A 91 14.145 -33.722 13.945 1.00 1.00 N ATOM 1378 CA VAL A 91 13.539 -34.007 15.240 1.00 75.52 C ATOM 1379 C VAL A 91 13.355 -35.507 15.442 1.00 72.32 C ATOM 1380 O VAL A 91 13.761 -36.061 16.464 1.00 74.43 O ATOM 1381 CB VAL A 91 12.173 -33.310 15.386 1.00 42.20 C ATOM 1382 CG1 VAL A 91 11.544 -33.644 16.730 1.00 73.13 C ATOM 1383 CG2 VAL A 91 12.323 -31.805 15.218 1.00 63.42 C ATOM 0 H VAL A 91 13.617 -33.068 13.367 1.00 1.00 H new ATOM 0 HA VAL A 91 14.219 -33.621 16.000 1.00 75.52 H new ATOM 0 HB VAL A 91 11.512 -33.677 14.601 1.00 42.20 H new ATOM 0 HG11 VAL A 91 10.580 -33.143 16.815 1.00 73.13 H new ATOM 0 HG12 VAL A 91 11.401 -34.722 16.807 1.00 73.13 H new ATOM 0 HG13 VAL A 91 12.200 -33.307 17.533 1.00 73.13 H new ATOM 0 HG21 VAL A 91 11.349 -31.328 15.324 1.00 63.42 H new ATOM 0 HG22 VAL A 91 13.000 -31.420 15.980 1.00 63.42 H new ATOM 0 HG23 VAL A 91 12.728 -31.588 14.229 1.00 63.42 H new ATOM 1393 N PHE A 92 12.741 -36.160 14.461 1.00 73.14 N ATOM 1394 CA PHE A 92 12.502 -37.597 14.530 1.00 22.03 C ATOM 1395 C PHE A 92 13.818 -38.369 14.499 1.00 41.13 C ATOM 1396 O PHE A 92 13.911 -39.480 15.020 1.00 30.31 O ATOM 1397 CB PHE A 92 11.608 -38.044 13.372 1.00 12.21 C ATOM 1398 CG PHE A 92 10.318 -37.279 13.281 1.00 45.13 C ATOM 1399 CD1 PHE A 92 9.548 -37.057 14.410 1.00 14.05 C ATOM 1400 CD2 PHE A 92 9.877 -36.782 12.065 1.00 70.11 C ATOM 1401 CE1 PHE A 92 8.361 -36.353 14.330 1.00 72.10 C ATOM 1402 CE2 PHE A 92 8.691 -36.077 11.978 1.00 24.24 C ATOM 1403 CZ PHE A 92 7.932 -35.864 13.112 1.00 53.50 C ATOM 0 H PHE A 92 12.400 -35.717 13.608 1.00 73.14 H new ATOM 0 HA PHE A 92 11.997 -37.811 15.472 1.00 22.03 H new ATOM 0 HB2 PHE A 92 12.155 -37.931 12.436 1.00 12.21 H new ATOM 0 HB3 PHE A 92 11.385 -39.105 13.484 1.00 12.21 H new ATOM 0 HD1 PHE A 92 9.879 -37.438 15.365 1.00 14.05 H new ATOM 0 HD2 PHE A 92 10.466 -36.947 11.175 1.00 70.11 H new ATOM 0 HE1 PHE A 92 7.770 -36.186 15.219 1.00 72.10 H new ATOM 0 HE2 PHE A 92 8.359 -35.693 11.025 1.00 24.24 H new ATOM 0 HZ PHE A 92 7.004 -35.316 13.046 1.00 53.50 H new ATOM 1413 N ASP A 93 14.832 -37.772 13.883 1.00 44.22 N ATOM 1414 CA ASP A 93 16.144 -38.402 13.783 1.00 51.32 C ATOM 1415 C ASP A 93 16.825 -38.457 15.146 1.00 24.54 C ATOM 1416 O ASP A 93 17.469 -37.498 15.571 1.00 41.42 O ATOM 1417 CB ASP A 93 17.024 -37.641 12.790 1.00 60.44 C ATOM 1418 CG ASP A 93 18.179 -38.481 12.279 1.00 52.51 C ATOM 1419 OD1 ASP A 93 18.248 -39.676 12.636 1.00 54.42 O ATOM 1420 OD2 ASP A 93 19.013 -37.943 11.522 1.00 42.43 O ATOM 0 H ASP A 93 14.771 -36.853 13.445 1.00 44.22 H new ATOM 0 HA ASP A 93 16.004 -39.422 13.425 1.00 51.32 H new ATOM 0 HB2 ASP A 93 16.416 -37.313 11.947 1.00 60.44 H new ATOM 0 HB3 ASP A 93 17.415 -36.743 13.269 1.00 60.44 H new ATOM 1425 N LYS A 94 16.679 -39.588 15.830 1.00 53.44 N ATOM 1426 CA LYS A 94 17.279 -39.770 17.146 1.00 65.25 C ATOM 1427 C LYS A 94 18.767 -40.084 17.026 1.00 45.44 C ATOM 1428 O LYS A 94 19.602 -39.426 17.648 1.00 70.30 O ATOM 1429 CB LYS A 94 16.570 -40.896 17.901 1.00 13.12 C ATOM 1430 CG LYS A 94 15.394 -40.420 18.737 1.00 21.31 C ATOM 1431 CD LYS A 94 14.239 -39.959 17.864 1.00 62.21 C ATOM 1432 CE LYS A 94 13.080 -39.441 18.701 1.00 51.11 C ATOM 1433 NZ LYS A 94 13.475 -38.268 19.530 1.00 73.34 N ATOM 0 H LYS A 94 16.150 -40.392 15.494 1.00 53.44 H new ATOM 0 HA LYS A 94 17.165 -38.839 17.702 1.00 65.25 H new ATOM 0 HB2 LYS A 94 16.219 -41.638 17.184 1.00 13.12 H new ATOM 0 HB3 LYS A 94 17.289 -41.395 18.551 1.00 13.12 H new ATOM 0 HG2 LYS A 94 15.059 -41.227 19.388 1.00 21.31 H new ATOM 0 HG3 LYS A 94 15.713 -39.601 19.382 1.00 21.31 H new ATOM 0 HD2 LYS A 94 14.582 -39.174 17.190 1.00 62.21 H new ATOM 0 HD3 LYS A 94 13.899 -40.787 17.242 1.00 62.21 H new ATOM 0 HE2 LYS A 94 12.255 -39.161 18.046 1.00 51.11 H new ATOM 0 HE3 LYS A 94 12.716 -40.238 19.349 1.00 51.11 H new ATOM 0 HZ1 LYS A 94 12.622 -37.800 19.898 1.00 73.34 H new ATOM 0 HZ2 LYS A 94 14.065 -38.587 20.324 1.00 73.34 H new ATOM 0 HZ3 LYS A 94 14.013 -37.596 18.947 1.00 73.34 H new ATOM 1447 N ASP A 95 19.092 -41.090 16.221 1.00 5.43 N ATOM 1448 CA ASP A 95 20.480 -41.488 16.018 1.00 64.04 C ATOM 1449 C ASP A 95 21.221 -40.463 15.164 1.00 15.44 C ATOM 1450 O ASP A 95 22.440 -40.528 15.016 1.00 50.13 O ATOM 1451 CB ASP A 95 20.546 -42.865 15.354 1.00 1.42 C ATOM 1452 CG ASP A 95 19.785 -42.913 14.044 1.00 14.12 C ATOM 1453 OD1 ASP A 95 19.353 -41.842 13.568 1.00 2.44 O ATOM 1454 OD2 ASP A 95 19.621 -44.022 13.494 1.00 13.23 O ATOM 0 H ASP A 95 18.413 -41.644 15.699 1.00 5.43 H new ATOM 0 HA ASP A 95 20.963 -41.539 16.994 1.00 64.04 H new ATOM 0 HB2 ASP A 95 21.588 -43.129 15.175 1.00 1.42 H new ATOM 0 HB3 ASP A 95 20.140 -43.613 16.035 1.00 1.42 H new ATOM 1459 N GLY A 96 20.473 -39.516 14.605 1.00 43.24 N ATOM 1460 CA GLY A 96 21.075 -38.491 13.772 1.00 5.01 C ATOM 1461 C GLY A 96 21.795 -39.069 12.570 1.00 75.34 C ATOM 1462 O GLY A 96 22.736 -38.469 12.053 1.00 21.03 O ATOM 0 H GLY A 96 19.462 -39.440 14.714 1.00 43.24 H new ATOM 0 HA2 GLY A 96 20.301 -37.803 13.432 1.00 5.01 H new ATOM 0 HA3 GLY A 96 21.779 -37.910 14.368 1.00 5.01 H new ATOM 1466 N ASN A 97 21.351 -40.240 12.123 1.00 31.04 N ATOM 1467 CA ASN A 97 21.960 -40.901 10.975 1.00 24.01 C ATOM 1468 C ASN A 97 21.418 -40.330 9.668 1.00 24.51 C ATOM 1469 O ASN A 97 22.000 -40.530 8.603 1.00 62.33 O ATOM 1470 CB ASN A 97 21.703 -42.408 11.032 1.00 22.21 C ATOM 1471 CG ASN A 97 20.246 -42.755 10.798 1.00 73.33 C ATOM 1472 OD1 ASN A 97 19.362 -41.913 10.957 1.00 21.14 O ATOM 1473 ND2 ASN A 97 19.988 -44.001 10.417 1.00 63.21 N ATOM 0 H ASN A 97 20.572 -40.750 12.539 1.00 31.04 H new ATOM 0 HA ASN A 97 23.034 -40.721 11.011 1.00 24.01 H new ATOM 0 HB2 ASN A 97 22.317 -42.907 10.283 1.00 22.21 H new ATOM 0 HB3 ASN A 97 22.013 -42.790 12.005 1.00 22.21 H new ATOM 0 HD21 ASN A 97 19.026 -44.293 10.244 1.00 63.21 H new ATOM 0 HD22 ASN A 97 20.752 -44.666 10.297 1.00 63.21 H new ATOM 1480 N GLY A 98 20.299 -39.618 9.759 1.00 43.05 N ATOM 1481 CA GLY A 98 19.698 -39.029 8.577 1.00 55.23 C ATOM 1482 C GLY A 98 18.798 -40.000 7.838 1.00 22.34 C ATOM 1483 O GLY A 98 18.488 -39.800 6.664 1.00 51.11 O ATOM 0 H GLY A 98 19.798 -39.439 10.629 1.00 43.05 H new ATOM 0 HA2 GLY A 98 19.120 -38.151 8.866 1.00 55.23 H new ATOM 0 HA3 GLY A 98 20.485 -38.685 7.906 1.00 55.23 H new ATOM 1487 N TYR A 99 18.380 -41.056 8.527 1.00 72.52 N ATOM 1488 CA TYR A 99 17.514 -42.065 7.928 1.00 70.13 C ATOM 1489 C TYR A 99 16.459 -42.538 8.923 1.00 31.21 C ATOM 1490 O TYR A 99 16.762 -42.802 10.087 1.00 10.01 O ATOM 1491 CB TYR A 99 18.343 -43.255 7.442 1.00 73.42 C ATOM 1492 CG TYR A 99 18.916 -43.068 6.055 1.00 32.42 C ATOM 1493 CD1 TYR A 99 20.011 -42.241 5.840 1.00 22.33 C ATOM 1494 CD2 TYR A 99 18.362 -43.720 4.960 1.00 62.11 C ATOM 1495 CE1 TYR A 99 20.537 -42.067 4.575 1.00 64.11 C ATOM 1496 CE2 TYR A 99 18.883 -43.553 3.691 1.00 13.11 C ATOM 1497 CZ TYR A 99 19.970 -42.725 3.504 1.00 71.13 C ATOM 1498 OH TYR A 99 20.492 -42.555 2.242 1.00 60.31 O ATOM 0 H TYR A 99 18.627 -41.236 9.500 1.00 72.52 H new ATOM 0 HA TYR A 99 17.006 -41.612 7.076 1.00 70.13 H new ATOM 0 HB2 TYR A 99 19.160 -43.429 8.143 1.00 73.42 H new ATOM 0 HB3 TYR A 99 17.720 -44.149 7.451 1.00 73.42 H new ATOM 0 HD1 TYR A 99 20.459 -41.725 6.677 1.00 22.33 H new ATOM 0 HD2 TYR A 99 17.510 -44.368 5.103 1.00 62.11 H new ATOM 0 HE1 TYR A 99 21.388 -41.419 4.425 1.00 64.11 H new ATOM 0 HE2 TYR A 99 18.442 -44.068 2.851 1.00 13.11 H new ATOM 0 HH TYR A 99 19.978 -43.089 1.601 1.00 60.31 H new ATOM 1508 N ILE A 100 15.220 -42.643 8.456 1.00 75.50 N ATOM 1509 CA ILE A 100 14.119 -43.086 9.303 1.00 23.24 C ATOM 1510 C ILE A 100 13.762 -44.542 9.025 1.00 64.42 C ATOM 1511 O ILE A 100 13.516 -44.924 7.881 1.00 52.22 O ATOM 1512 CB ILE A 100 12.866 -42.214 9.100 1.00 21.34 C ATOM 1513 CG1 ILE A 100 13.193 -40.743 9.366 1.00 61.34 C ATOM 1514 CG2 ILE A 100 11.741 -42.685 10.010 1.00 53.34 C ATOM 1515 CD1 ILE A 100 12.034 -39.809 9.099 1.00 34.14 C ATOM 0 H ILE A 100 14.953 -42.427 7.496 1.00 75.50 H new ATOM 0 HA ILE A 100 14.456 -42.988 10.335 1.00 23.24 H new ATOM 0 HB ILE A 100 12.536 -42.312 8.066 1.00 21.34 H new ATOM 0 HG12 ILE A 100 13.508 -40.631 10.404 1.00 61.34 H new ATOM 0 HG13 ILE A 100 14.038 -40.448 8.743 1.00 61.34 H new ATOM 0 HG21 ILE A 100 10.862 -42.059 9.856 1.00 53.34 H new ATOM 0 HG22 ILE A 100 11.494 -43.721 9.777 1.00 53.34 H new ATOM 0 HG23 ILE A 100 12.060 -42.613 11.050 1.00 53.34 H new ATOM 0 HD11 ILE A 100 12.338 -38.783 9.309 1.00 34.14 H new ATOM 0 HD12 ILE A 100 11.733 -39.892 8.055 1.00 34.14 H new ATOM 0 HD13 ILE A 100 11.195 -40.077 9.741 1.00 34.14 H new ATOM 1527 N SER A 101 13.735 -45.351 10.079 1.00 22.41 N ATOM 1528 CA SER A 101 13.410 -46.767 9.948 1.00 1.12 C ATOM 1529 C SER A 101 12.065 -47.078 10.599 1.00 44.24 C ATOM 1530 O SER A 101 11.360 -46.177 11.053 1.00 63.42 O ATOM 1531 CB SER A 101 14.507 -47.625 10.582 1.00 13.55 C ATOM 1532 OG SER A 101 14.392 -47.636 11.995 1.00 43.01 O ATOM 0 H SER A 101 13.934 -45.051 11.033 1.00 22.41 H new ATOM 0 HA SER A 101 13.343 -47.002 8.886 1.00 1.12 H new ATOM 0 HB2 SER A 101 14.442 -48.644 10.201 1.00 13.55 H new ATOM 0 HB3 SER A 101 15.486 -47.239 10.296 1.00 13.55 H new ATOM 0 HG SER A 101 15.103 -48.192 12.377 1.00 43.01 H new ATOM 1538 N ALA A 102 11.717 -48.360 10.639 1.00 3.21 N ATOM 1539 CA ALA A 102 10.459 -48.791 11.235 1.00 30.11 C ATOM 1540 C ALA A 102 10.492 -48.646 12.753 1.00 61.23 C ATOM 1541 O ALA A 102 9.478 -48.338 13.378 1.00 3.15 O ATOM 1542 CB ALA A 102 10.157 -50.231 10.847 1.00 64.11 C ATOM 0 H ALA A 102 12.289 -49.118 10.266 1.00 3.21 H new ATOM 0 HA ALA A 102 9.666 -48.149 10.852 1.00 30.11 H new ATOM 0 HB1 ALA A 102 9.214 -50.540 11.299 1.00 64.11 H new ATOM 0 HB2 ALA A 102 10.081 -50.307 9.762 1.00 64.11 H new ATOM 0 HB3 ALA A 102 10.959 -50.879 11.201 1.00 64.11 H new ATOM 1548 N ALA A 103 11.664 -48.871 13.339 1.00 74.35 N ATOM 1549 CA ALA A 103 11.829 -48.764 14.783 1.00 75.32 C ATOM 1550 C ALA A 103 11.784 -47.308 15.234 1.00 35.42 C ATOM 1551 O ALA A 103 11.127 -46.975 16.220 1.00 74.32 O ATOM 1552 CB ALA A 103 13.136 -49.412 15.214 1.00 33.52 C ATOM 0 H ALA A 103 12.513 -49.128 12.835 1.00 74.35 H new ATOM 0 HA ALA A 103 11.001 -49.290 15.259 1.00 75.32 H new ATOM 0 HB1 ALA A 103 13.246 -49.325 16.295 1.00 33.52 H new ATOM 0 HB2 ALA A 103 13.130 -50.465 14.934 1.00 33.52 H new ATOM 0 HB3 ALA A 103 13.970 -48.911 14.723 1.00 33.52 H new ATOM 1558 N GLU A 104 12.487 -46.446 14.507 1.00 73.03 N ATOM 1559 CA GLU A 104 12.527 -45.026 14.835 1.00 41.23 C ATOM 1560 C GLU A 104 11.174 -44.369 14.577 1.00 31.23 C ATOM 1561 O GLU A 104 10.636 -43.671 15.438 1.00 72.31 O ATOM 1562 CB GLU A 104 13.612 -44.321 14.017 1.00 32.51 C ATOM 1563 CG GLU A 104 14.975 -44.319 14.688 1.00 30.33 C ATOM 1564 CD GLU A 104 16.048 -43.680 13.828 1.00 32.30 C ATOM 1565 OE1 GLU A 104 15.929 -43.746 12.586 1.00 13.55 O ATOM 1566 OE2 GLU A 104 17.006 -43.116 14.396 1.00 50.44 O ATOM 0 H GLU A 104 13.036 -46.706 13.688 1.00 73.03 H new ATOM 0 HA GLU A 104 12.761 -44.931 15.895 1.00 41.23 H new ATOM 0 HB2 GLU A 104 13.696 -44.807 13.045 1.00 32.51 H new ATOM 0 HB3 GLU A 104 13.305 -43.291 13.833 1.00 32.51 H new ATOM 0 HG2 GLU A 104 14.908 -43.785 15.636 1.00 30.33 H new ATOM 0 HG3 GLU A 104 15.263 -45.344 14.920 1.00 30.33 H new ATOM 1573 N LEU A 105 10.629 -44.597 13.387 1.00 24.12 N ATOM 1574 CA LEU A 105 9.339 -44.028 13.015 1.00 51.04 C ATOM 1575 C LEU A 105 8.278 -44.354 14.060 1.00 35.23 C ATOM 1576 O LEU A 105 7.370 -43.560 14.307 1.00 2.40 O ATOM 1577 CB LEU A 105 8.903 -44.555 11.647 1.00 74.54 C ATOM 1578 CG LEU A 105 7.606 -43.972 11.084 1.00 10.45 C ATOM 1579 CD1 LEU A 105 7.788 -42.502 10.740 1.00 50.43 C ATOM 1580 CD2 LEU A 105 7.154 -44.756 9.861 1.00 31.25 C ATOM 0 H LEU A 105 11.061 -45.172 12.663 1.00 24.12 H new ATOM 0 HA LEU A 105 9.449 -42.945 12.962 1.00 51.04 H new ATOM 0 HB2 LEU A 105 9.704 -44.362 10.934 1.00 74.54 H new ATOM 0 HB3 LEU A 105 8.791 -45.637 11.716 1.00 74.54 H new ATOM 0 HG LEU A 105 6.832 -44.053 11.848 1.00 10.45 H new ATOM 0 HD11 LEU A 105 6.855 -42.104 10.341 1.00 50.43 H new ATOM 0 HD12 LEU A 105 8.064 -41.950 11.638 1.00 50.43 H new ATOM 0 HD13 LEU A 105 8.576 -42.398 9.994 1.00 50.43 H new ATOM 0 HD21 LEU A 105 6.230 -44.326 9.475 1.00 31.25 H new ATOM 0 HD22 LEU A 105 7.926 -44.708 9.093 1.00 31.25 H new ATOM 0 HD23 LEU A 105 6.982 -45.796 10.138 1.00 31.25 H new ATOM 1592 N ARG A 106 8.399 -45.527 14.673 1.00 30.22 N ATOM 1593 CA ARG A 106 7.451 -45.958 15.693 1.00 34.02 C ATOM 1594 C ARG A 106 7.668 -45.193 16.996 1.00 61.24 C ATOM 1595 O ARG A 106 6.714 -44.861 17.699 1.00 12.34 O ATOM 1596 CB ARG A 106 7.586 -47.461 15.943 1.00 31.14 C ATOM 1597 CG ARG A 106 6.560 -48.011 16.921 1.00 53.33 C ATOM 1598 CD ARG A 106 6.973 -49.374 17.454 1.00 14.53 C ATOM 1599 NE ARG A 106 8.131 -49.287 18.340 1.00 52.34 N ATOM 1600 CZ ARG A 106 8.053 -48.939 19.619 1.00 2.03 C ATOM 1601 NH1 ARG A 106 6.878 -48.648 20.160 1.00 5.45 N ATOM 1602 NH2 ARG A 106 9.152 -48.883 20.361 1.00 43.24 N ATOM 0 H ARG A 106 9.145 -46.196 14.481 1.00 30.22 H new ATOM 0 HA ARG A 106 6.445 -45.746 15.331 1.00 34.02 H new ATOM 0 HB2 ARG A 106 7.490 -47.989 14.994 1.00 31.14 H new ATOM 0 HB3 ARG A 106 8.586 -47.669 16.324 1.00 31.14 H new ATOM 0 HG2 ARG A 106 6.439 -47.316 17.752 1.00 53.33 H new ATOM 0 HG3 ARG A 106 5.591 -48.090 16.427 1.00 53.33 H new ATOM 0 HD2 ARG A 106 6.137 -49.821 17.992 1.00 14.53 H new ATOM 0 HD3 ARG A 106 7.204 -50.035 16.619 1.00 14.53 H new ATOM 0 HE ARG A 106 9.050 -49.506 17.955 1.00 52.34 H new ATOM 0 HH11 ARG A 106 6.031 -48.691 19.593 1.00 5.45 H new ATOM 0 HH12 ARG A 106 6.821 -48.381 21.143 1.00 5.45 H new ATOM 0 HH21 ARG A 106 10.058 -49.107 19.949 1.00 43.24 H new ATOM 0 HH22 ARG A 106 9.091 -48.616 21.343 1.00 43.24 H new ATOM 1616 N HIS A 107 8.930 -44.918 17.310 1.00 12.44 N ATOM 1617 CA HIS A 107 9.273 -44.192 18.528 1.00 12.13 C ATOM 1618 C HIS A 107 8.520 -42.867 18.602 1.00 75.13 C ATOM 1619 O HIS A 107 8.085 -42.447 19.674 1.00 35.10 O ATOM 1620 CB HIS A 107 10.780 -43.939 18.589 1.00 35.24 C ATOM 1621 CG HIS A 107 11.233 -43.333 19.882 1.00 63.23 C ATOM 1622 ND1 HIS A 107 10.477 -43.364 21.034 1.00 32.21 N ATOM 1623 CD2 HIS A 107 12.375 -42.679 20.200 1.00 32.22 C ATOM 1624 CE1 HIS A 107 11.133 -42.754 22.005 1.00 15.01 C ATOM 1625 NE2 HIS A 107 12.288 -42.329 21.525 1.00 35.52 N ATOM 0 H HIS A 107 9.731 -45.186 16.739 1.00 12.44 H new ATOM 0 HA HIS A 107 8.980 -44.804 19.381 1.00 12.13 H new ATOM 0 HB2 HIS A 107 11.305 -44.882 18.435 1.00 35.24 H new ATOM 0 HB3 HIS A 107 11.063 -43.279 17.769 1.00 35.24 H new ATOM 0 HD2 HIS A 107 13.201 -42.471 19.535 1.00 32.22 H new ATOM 0 HE1 HIS A 107 10.784 -42.625 23.019 1.00 15.01 H new ATOM 0 HE2 HIS A 107 12.999 -41.823 22.053 1.00 35.52 H new ATOM 1633 N VAL A 108 8.370 -42.213 17.454 1.00 13.34 N ATOM 1634 CA VAL A 108 7.669 -40.936 17.388 1.00 11.25 C ATOM 1635 C VAL A 108 6.175 -41.116 17.630 1.00 15.15 C ATOM 1636 O VAL A 108 5.573 -40.395 18.426 1.00 50.44 O ATOM 1637 CB VAL A 108 7.878 -40.250 16.025 1.00 21.41 C ATOM 1638 CG1 VAL A 108 7.291 -38.847 16.037 1.00 25.11 C ATOM 1639 CG2 VAL A 108 9.356 -40.216 15.668 1.00 64.23 C ATOM 0 H VAL A 108 8.724 -42.546 16.558 1.00 13.34 H new ATOM 0 HA VAL A 108 8.088 -40.305 18.172 1.00 11.25 H new ATOM 0 HB VAL A 108 7.356 -40.829 15.263 1.00 21.41 H new ATOM 0 HG11 VAL A 108 7.448 -38.378 15.066 1.00 25.11 H new ATOM 0 HG12 VAL A 108 6.222 -38.901 16.245 1.00 25.11 H new ATOM 0 HG13 VAL A 108 7.781 -38.254 16.809 1.00 25.11 H new ATOM 0 HG21 VAL A 108 9.486 -39.728 14.702 1.00 64.23 H new ATOM 0 HG22 VAL A 108 9.902 -39.661 16.431 1.00 64.23 H new ATOM 0 HG23 VAL A 108 9.741 -41.234 15.615 1.00 64.23 H new ATOM 1649 N MET A 109 5.581 -42.084 16.939 1.00 3.34 N ATOM 1650 CA MET A 109 4.156 -42.360 17.081 1.00 63.02 C ATOM 1651 C MET A 109 3.814 -42.729 18.521 1.00 43.22 C ATOM 1652 O MET A 109 2.767 -42.342 19.040 1.00 11.32 O ATOM 1653 CB MET A 109 3.739 -43.491 16.139 1.00 35.23 C ATOM 1654 CG MET A 109 3.334 -43.011 14.755 1.00 73.51 C ATOM 1655 SD MET A 109 1.786 -42.086 14.765 1.00 21.44 S ATOM 1656 CE MET A 109 0.914 -42.870 13.411 1.00 30.14 C ATOM 0 H MET A 109 6.064 -42.690 16.276 1.00 3.34 H new ATOM 0 HA MET A 109 3.608 -41.456 16.817 1.00 63.02 H new ATOM 0 HB2 MET A 109 4.565 -44.196 16.043 1.00 35.23 H new ATOM 0 HB3 MET A 109 2.906 -44.035 16.584 1.00 35.23 H new ATOM 0 HG2 MET A 109 4.125 -42.382 14.347 1.00 73.51 H new ATOM 0 HG3 MET A 109 3.235 -43.870 14.091 1.00 73.51 H new ATOM 0 HE1 MET A 109 -0.157 -42.862 13.615 1.00 30.14 H new ATOM 0 HE2 MET A 109 1.112 -42.326 12.487 1.00 30.14 H new ATOM 0 HE3 MET A 109 1.256 -43.900 13.306 1.00 30.14 H new ATOM 1666 N THR A 110 4.704 -43.480 19.162 1.00 22.02 N ATOM 1667 CA THR A 110 4.496 -43.902 20.541 1.00 33.24 C ATOM 1668 C THR A 110 4.178 -42.712 21.439 1.00 53.33 C ATOM 1669 O THR A 110 3.286 -42.780 22.284 1.00 63.22 O ATOM 1670 CB THR A 110 5.731 -44.634 21.098 1.00 65.33 C ATOM 1671 OG1 THR A 110 6.206 -45.590 20.143 1.00 50.03 O ATOM 1672 CG2 THR A 110 5.401 -45.338 22.405 1.00 15.13 C ATOM 0 H THR A 110 5.576 -43.808 18.748 1.00 22.02 H new ATOM 0 HA THR A 110 3.648 -44.587 20.536 1.00 33.24 H new ATOM 0 HB THR A 110 6.508 -43.894 21.289 1.00 65.33 H new ATOM 0 HG1 THR A 110 6.695 -45.126 19.431 1.00 50.03 H new ATOM 0 HG21 THR A 110 6.289 -45.848 22.778 1.00 15.13 H new ATOM 0 HG22 THR A 110 5.068 -44.605 23.139 1.00 15.13 H new ATOM 0 HG23 THR A 110 4.609 -46.067 22.236 1.00 15.13 H new ATOM 1680 N ASN A 111 4.912 -41.621 21.249 1.00 43.52 N ATOM 1681 CA ASN A 111 4.708 -40.414 22.042 1.00 53.21 C ATOM 1682 C ASN A 111 3.366 -39.767 21.712 1.00 32.21 C ATOM 1683 O ASN A 111 2.757 -39.108 22.557 1.00 65.25 O ATOM 1684 CB ASN A 111 5.842 -39.417 21.794 1.00 54.04 C ATOM 1685 CG ASN A 111 5.487 -38.014 22.246 1.00 1.41 C ATOM 1686 OD1 ASN A 111 5.155 -37.790 23.410 1.00 33.22 O ATOM 1687 ND2 ASN A 111 5.556 -37.060 21.325 1.00 43.13 N ATOM 0 H ASN A 111 5.654 -41.548 20.553 1.00 43.52 H new ATOM 0 HA ASN A 111 4.706 -40.697 23.095 1.00 53.21 H new ATOM 0 HB2 ASN A 111 6.737 -39.750 22.320 1.00 54.04 H new ATOM 0 HB3 ASN A 111 6.084 -39.403 20.731 1.00 54.04 H new ATOM 0 HD21 ASN A 111 5.329 -36.096 21.571 1.00 43.13 H new ATOM 0 HD22 ASN A 111 5.836 -37.291 20.372 1.00 43.13 H new ATOM 1694 N LEU A 112 2.909 -39.960 20.480 1.00 63.33 N ATOM 1695 CA LEU A 112 1.639 -39.397 20.037 1.00 15.34 C ATOM 1696 C LEU A 112 0.466 -40.109 20.704 1.00 13.50 C ATOM 1697 O LEU A 112 -0.611 -39.536 20.865 1.00 51.33 O ATOM 1698 CB LEU A 112 1.514 -39.500 18.516 1.00 4.32 C ATOM 1699 CG LEU A 112 0.831 -38.324 17.817 1.00 3.54 C ATOM 1700 CD1 LEU A 112 1.081 -38.375 16.318 1.00 30.32 C ATOM 1701 CD2 LEU A 112 -0.662 -38.322 18.112 1.00 63.54 C ATOM 0 H LEU A 112 3.400 -40.503 19.769 1.00 63.33 H new ATOM 0 HA LEU A 112 1.616 -38.346 20.326 1.00 15.34 H new ATOM 0 HB2 LEU A 112 2.513 -39.615 18.096 1.00 4.32 H new ATOM 0 HB3 LEU A 112 0.961 -40.409 18.278 1.00 4.32 H new ATOM 0 HG LEU A 112 1.258 -37.399 18.204 1.00 3.54 H new ATOM 0 HD11 LEU A 112 0.587 -37.530 15.838 1.00 30.32 H new ATOM 0 HD12 LEU A 112 2.153 -38.326 16.126 1.00 30.32 H new ATOM 0 HD13 LEU A 112 0.682 -39.306 15.914 1.00 30.32 H new ATOM 0 HD21 LEU A 112 -1.132 -37.478 17.606 1.00 63.54 H new ATOM 0 HD22 LEU A 112 -1.105 -39.252 17.754 1.00 63.54 H new ATOM 0 HD23 LEU A 112 -0.820 -38.235 19.187 1.00 63.54 H new ATOM 1713 N GLY A 113 0.684 -41.361 21.092 1.00 34.44 N ATOM 1714 CA GLY A 113 -0.364 -42.130 21.739 1.00 24.23 C ATOM 1715 C GLY A 113 -1.060 -43.079 20.784 1.00 32.35 C ATOM 1716 O GLY A 113 -2.244 -43.373 20.946 1.00 52.24 O ATOM 0 H GLY A 113 1.567 -41.857 20.970 1.00 34.44 H new ATOM 0 HA2 GLY A 113 0.064 -42.699 22.564 1.00 24.23 H new ATOM 0 HA3 GLY A 113 -1.098 -41.448 22.169 1.00 24.23 H new ATOM 1720 N GLU A 114 -0.324 -43.559 19.787 1.00 51.43 N ATOM 1721 CA GLU A 114 -0.880 -44.478 18.801 1.00 15.10 C ATOM 1722 C GLU A 114 -0.193 -45.838 18.877 1.00 61.23 C ATOM 1723 O GLU A 114 0.993 -45.965 18.572 1.00 23.23 O ATOM 1724 CB GLU A 114 -0.736 -43.899 17.392 1.00 1.11 C ATOM 1725 CG GLU A 114 -1.714 -44.487 16.389 1.00 11.10 C ATOM 1726 CD GLU A 114 -3.160 -44.280 16.795 1.00 75.52 C ATOM 1727 OE1 GLU A 114 -3.678 -45.100 17.583 1.00 5.20 O ATOM 1728 OE2 GLU A 114 -3.775 -43.301 16.325 1.00 52.34 O ATOM 0 H GLU A 114 0.658 -43.327 19.641 1.00 51.43 H new ATOM 0 HA GLU A 114 -1.939 -44.612 19.024 1.00 15.10 H new ATOM 0 HB2 GLU A 114 -0.879 -42.819 17.436 1.00 1.11 H new ATOM 0 HB3 GLU A 114 0.281 -44.072 17.039 1.00 1.11 H new ATOM 0 HG2 GLU A 114 -1.546 -44.032 15.413 1.00 11.10 H new ATOM 0 HG3 GLU A 114 -1.520 -45.554 16.281 1.00 11.10 H new ATOM 1735 N LYS A 115 -0.946 -46.853 19.285 1.00 35.35 N ATOM 1736 CA LYS A 115 -0.412 -48.205 19.401 1.00 34.14 C ATOM 1737 C LYS A 115 0.003 -48.745 18.037 1.00 73.04 C ATOM 1738 O LYS A 115 -0.832 -48.924 17.148 1.00 3.42 O ATOM 1739 CB LYS A 115 -1.451 -49.133 20.035 1.00 73.55 C ATOM 1740 CG LYS A 115 -2.775 -49.163 19.290 1.00 64.25 C ATOM 1741 CD LYS A 115 -3.929 -49.504 20.217 1.00 51.11 C ATOM 1742 CE LYS A 115 -5.269 -49.373 19.510 1.00 54.22 C ATOM 1743 NZ LYS A 115 -5.373 -50.293 18.343 1.00 14.24 N ATOM 0 H LYS A 115 -1.929 -46.765 19.541 1.00 35.35 H new ATOM 0 HA LYS A 115 0.470 -48.167 20.040 1.00 34.14 H new ATOM 0 HB2 LYS A 115 -1.045 -50.144 20.078 1.00 73.55 H new ATOM 0 HB3 LYS A 115 -1.629 -48.817 21.063 1.00 73.55 H new ATOM 0 HG2 LYS A 115 -2.954 -48.193 18.826 1.00 64.25 H new ATOM 0 HG3 LYS A 115 -2.724 -49.897 18.486 1.00 64.25 H new ATOM 0 HD2 LYS A 115 -3.810 -50.522 20.588 1.00 51.11 H new ATOM 0 HD3 LYS A 115 -3.908 -48.844 21.084 1.00 51.11 H new ATOM 0 HE2 LYS A 115 -6.073 -49.587 20.214 1.00 54.22 H new ATOM 0 HE3 LYS A 115 -5.404 -48.345 19.175 1.00 54.22 H new ATOM 0 HZ1 LYS A 115 -6.340 -50.261 17.960 1.00 14.24 H new ATOM 0 HZ2 LYS A 115 -4.699 -49.998 17.607 1.00 14.24 H new ATOM 0 HZ3 LYS A 115 -5.153 -51.263 18.645 1.00 14.24 H new ATOM 1757 N LEU A 116 1.296 -49.005 17.877 1.00 54.45 N ATOM 1758 CA LEU A 116 1.821 -49.526 16.620 1.00 64.13 C ATOM 1759 C LEU A 116 2.976 -50.491 16.871 1.00 75.31 C ATOM 1760 O LEU A 116 3.882 -50.203 17.654 1.00 74.23 O ATOM 1761 CB LEU A 116 2.288 -48.378 15.723 1.00 11.45 C ATOM 1762 CG LEU A 116 1.297 -47.228 15.536 1.00 45.14 C ATOM 1763 CD1 LEU A 116 2.007 -45.994 15.001 1.00 4.34 C ATOM 1764 CD2 LEU A 116 0.170 -47.643 14.602 1.00 53.22 C ATOM 0 H LEU A 116 2.000 -48.864 18.602 1.00 54.45 H new ATOM 0 HA LEU A 116 1.020 -50.068 16.118 1.00 64.13 H new ATOM 0 HB2 LEU A 116 3.211 -47.972 16.137 1.00 11.45 H new ATOM 0 HB3 LEU A 116 2.531 -48.786 14.742 1.00 11.45 H new ATOM 0 HG LEU A 116 0.867 -46.983 16.507 1.00 45.14 H new ATOM 0 HD11 LEU A 116 1.286 -45.186 14.874 1.00 4.34 H new ATOM 0 HD12 LEU A 116 2.779 -45.684 15.705 1.00 4.34 H new ATOM 0 HD13 LEU A 116 2.465 -46.226 14.039 1.00 4.34 H new ATOM 0 HD21 LEU A 116 -0.526 -46.813 14.480 1.00 53.22 H new ATOM 0 HD22 LEU A 116 0.584 -47.915 13.631 1.00 53.22 H new ATOM 0 HD23 LEU A 116 -0.356 -48.499 15.025 1.00 53.22 H new ATOM 1776 N THR A 117 2.938 -51.638 16.200 1.00 72.40 N ATOM 1777 CA THR A 117 3.980 -52.646 16.349 1.00 4.32 C ATOM 1778 C THR A 117 4.868 -52.706 15.112 1.00 43.45 C ATOM 1779 O THR A 117 4.695 -51.927 14.174 1.00 64.14 O ATOM 1780 CB THR A 117 3.381 -54.041 16.605 1.00 72.31 C ATOM 1781 OG1 THR A 117 2.758 -54.533 15.413 1.00 54.30 O ATOM 1782 CG2 THR A 117 2.362 -53.994 17.733 1.00 12.04 C ATOM 0 H THR A 117 2.196 -51.892 15.548 1.00 72.40 H new ATOM 0 HA THR A 117 4.581 -52.354 17.210 1.00 4.32 H new ATOM 0 HB THR A 117 4.190 -54.711 16.895 1.00 72.31 H new ATOM 0 HG1 THR A 117 2.381 -55.421 15.584 1.00 54.30 H new ATOM 0 HG21 THR A 117 1.953 -54.991 17.895 1.00 12.04 H new ATOM 0 HG22 THR A 117 2.846 -53.647 18.646 1.00 12.04 H new ATOM 0 HG23 THR A 117 1.556 -53.310 17.467 1.00 12.04 H new ATOM 1790 N ASP A 118 5.818 -53.634 15.115 1.00 21.30 N ATOM 1791 CA ASP A 118 6.733 -53.797 13.991 1.00 75.03 C ATOM 1792 C ASP A 118 5.966 -54.097 12.706 1.00 23.11 C ATOM 1793 O ASP A 118 6.332 -53.625 11.630 1.00 31.22 O ATOM 1794 CB ASP A 118 7.732 -54.919 14.277 1.00 41.21 C ATOM 1795 CG ASP A 118 8.479 -54.711 15.580 1.00 54.52 C ATOM 1796 OD1 ASP A 118 7.847 -54.826 16.651 1.00 13.21 O ATOM 1797 OD2 ASP A 118 9.695 -54.433 15.528 1.00 31.24 O ATOM 0 H ASP A 118 5.975 -54.286 15.884 1.00 21.30 H new ATOM 0 HA ASP A 118 7.277 -52.862 13.859 1.00 75.03 H new ATOM 0 HB2 ASP A 118 7.204 -55.872 14.313 1.00 41.21 H new ATOM 0 HB3 ASP A 118 8.448 -54.982 13.457 1.00 41.21 H new ATOM 1802 N GLU A 119 4.903 -54.886 12.828 1.00 51.43 N ATOM 1803 CA GLU A 119 4.087 -55.250 11.675 1.00 0.43 C ATOM 1804 C GLU A 119 3.227 -54.072 11.224 1.00 63.53 C ATOM 1805 O GLU A 119 2.967 -53.902 10.033 1.00 30.32 O ATOM 1806 CB GLU A 119 3.196 -56.447 12.011 1.00 34.04 C ATOM 1807 CG GLU A 119 2.471 -57.024 10.807 1.00 43.34 C ATOM 1808 CD GLU A 119 1.751 -58.320 11.124 1.00 13.53 C ATOM 1809 OE1 GLU A 119 1.399 -58.530 12.304 1.00 45.01 O ATOM 1810 OE2 GLU A 119 1.538 -59.123 10.192 1.00 30.22 O ATOM 0 H GLU A 119 4.587 -55.285 13.712 1.00 51.43 H new ATOM 0 HA GLU A 119 4.756 -55.522 10.859 1.00 0.43 H new ATOM 0 HB2 GLU A 119 3.807 -57.227 12.465 1.00 34.04 H new ATOM 0 HB3 GLU A 119 2.461 -56.144 12.756 1.00 34.04 H new ATOM 0 HG2 GLU A 119 1.751 -56.294 10.437 1.00 43.34 H new ATOM 0 HG3 GLU A 119 3.188 -57.198 10.005 1.00 43.34 H new ATOM 1817 N GLU A 120 2.790 -53.264 12.184 1.00 73.00 N ATOM 1818 CA GLU A 120 1.958 -52.104 11.885 1.00 44.10 C ATOM 1819 C GLU A 120 2.787 -50.988 11.255 1.00 64.53 C ATOM 1820 O GLU A 120 2.321 -50.282 10.361 1.00 71.34 O ATOM 1821 CB GLU A 120 1.280 -51.593 13.158 1.00 60.22 C ATOM 1822 CG GLU A 120 0.084 -50.694 12.891 1.00 23.35 C ATOM 1823 CD GLU A 120 -0.988 -50.819 13.956 1.00 1.15 C ATOM 1824 OE1 GLU A 120 -0.708 -51.426 15.011 1.00 22.42 O ATOM 1825 OE2 GLU A 120 -2.106 -50.310 13.736 1.00 54.34 O ATOM 0 H GLU A 120 2.998 -53.391 13.175 1.00 73.00 H new ATOM 0 HA GLU A 120 1.193 -52.412 11.173 1.00 44.10 H new ATOM 0 HB2 GLU A 120 0.957 -52.446 13.755 1.00 60.22 H new ATOM 0 HB3 GLU A 120 2.010 -51.045 13.754 1.00 60.22 H new ATOM 0 HG2 GLU A 120 0.418 -49.658 12.837 1.00 23.35 H new ATOM 0 HG3 GLU A 120 -0.343 -50.943 11.920 1.00 23.35 H new ATOM 1832 N VAL A 121 4.020 -50.836 11.728 1.00 1.50 N ATOM 1833 CA VAL A 121 4.915 -49.807 11.212 1.00 62.04 C ATOM 1834 C VAL A 121 5.447 -50.183 9.833 1.00 54.31 C ATOM 1835 O VAL A 121 5.716 -49.315 9.002 1.00 1.45 O ATOM 1836 CB VAL A 121 6.105 -49.570 12.161 1.00 53.21 C ATOM 1837 CG1 VAL A 121 7.005 -48.467 11.625 1.00 74.04 C ATOM 1838 CG2 VAL A 121 5.610 -49.233 13.560 1.00 45.14 C ATOM 0 H VAL A 121 4.422 -51.412 12.468 1.00 1.50 H new ATOM 0 HA VAL A 121 4.332 -48.889 11.136 1.00 62.04 H new ATOM 0 HB VAL A 121 6.691 -50.487 12.218 1.00 53.21 H new ATOM 0 HG11 VAL A 121 7.840 -48.314 12.309 1.00 74.04 H new ATOM 0 HG12 VAL A 121 7.387 -48.753 10.645 1.00 74.04 H new ATOM 0 HG13 VAL A 121 6.434 -47.543 11.537 1.00 74.04 H new ATOM 0 HG21 VAL A 121 6.463 -49.069 14.218 1.00 45.14 H new ATOM 0 HG22 VAL A 121 5.001 -48.330 13.523 1.00 45.14 H new ATOM 0 HG23 VAL A 121 5.011 -50.059 13.943 1.00 45.14 H new ATOM 1848 N ASP A 122 5.594 -51.481 9.596 1.00 65.32 N ATOM 1849 CA ASP A 122 6.092 -51.973 8.316 1.00 23.24 C ATOM 1850 C ASP A 122 5.296 -51.379 7.159 1.00 71.22 C ATOM 1851 O ASP A 122 5.867 -50.937 6.163 1.00 63.02 O ATOM 1852 CB ASP A 122 6.021 -53.500 8.270 1.00 20.32 C ATOM 1853 CG ASP A 122 6.688 -54.074 7.036 1.00 44.13 C ATOM 1854 OD1 ASP A 122 7.805 -53.625 6.701 1.00 11.25 O ATOM 1855 OD2 ASP A 122 6.095 -54.973 6.404 1.00 15.42 O ATOM 0 H ASP A 122 5.376 -52.212 10.273 1.00 65.32 H new ATOM 0 HA ASP A 122 7.132 -51.662 8.215 1.00 23.24 H new ATOM 0 HB2 ASP A 122 6.497 -53.910 9.161 1.00 20.32 H new ATOM 0 HB3 ASP A 122 4.977 -53.813 8.294 1.00 20.32 H new ATOM 1860 N GLU A 123 3.974 -51.374 7.298 1.00 52.13 N ATOM 1861 CA GLU A 123 3.100 -50.836 6.262 1.00 14.11 C ATOM 1862 C GLU A 123 3.467 -49.391 5.937 1.00 51.13 C ATOM 1863 O GLU A 123 3.278 -48.930 4.811 1.00 5.04 O ATOM 1864 CB GLU A 123 1.637 -50.914 6.706 1.00 25.32 C ATOM 1865 CG GLU A 123 0.649 -50.528 5.618 1.00 24.04 C ATOM 1866 CD GLU A 123 0.707 -51.457 4.421 1.00 45.50 C ATOM 1867 OE1 GLU A 123 0.629 -52.687 4.619 1.00 11.21 O ATOM 1868 OE2 GLU A 123 0.831 -50.952 3.285 1.00 3.12 O ATOM 0 H GLU A 123 3.485 -51.736 8.117 1.00 52.13 H new ATOM 0 HA GLU A 123 3.232 -51.438 5.363 1.00 14.11 H new ATOM 0 HB2 GLU A 123 1.421 -51.929 7.038 1.00 25.32 H new ATOM 0 HB3 GLU A 123 1.492 -50.260 7.566 1.00 25.32 H new ATOM 0 HG2 GLU A 123 -0.360 -50.535 6.030 1.00 24.04 H new ATOM 0 HG3 GLU A 123 0.853 -49.508 5.292 1.00 24.04 H new ATOM 1875 N MET A 124 3.992 -48.682 6.931 1.00 53.22 N ATOM 1876 CA MET A 124 4.386 -47.289 6.751 1.00 70.45 C ATOM 1877 C MET A 124 5.685 -47.191 5.956 1.00 15.43 C ATOM 1878 O MET A 124 5.734 -46.547 4.908 1.00 40.50 O ATOM 1879 CB MET A 124 4.552 -46.604 8.108 1.00 35.13 C ATOM 1880 CG MET A 124 3.312 -46.683 8.984 1.00 34.01 C ATOM 1881 SD MET A 124 3.630 -46.179 10.686 1.00 51.23 S ATOM 1882 CE MET A 124 2.763 -44.612 10.742 1.00 24.23 C ATOM 0 H MET A 124 4.154 -49.049 7.869 1.00 53.22 H new ATOM 0 HA MET A 124 3.599 -46.784 6.192 1.00 70.45 H new ATOM 0 HB2 MET A 124 5.390 -47.060 8.636 1.00 35.13 H new ATOM 0 HB3 MET A 124 4.808 -45.557 7.948 1.00 35.13 H new ATOM 0 HG2 MET A 124 2.532 -46.049 8.561 1.00 34.01 H new ATOM 0 HG3 MET A 124 2.931 -47.704 8.977 1.00 34.01 H new ATOM 0 HE1 MET A 124 3.389 -43.867 11.233 1.00 24.23 H new ATOM 0 HE2 MET A 124 2.538 -44.284 9.727 1.00 24.23 H new ATOM 0 HE3 MET A 124 1.834 -44.730 11.300 1.00 24.23 H new ATOM 1892 N ILE A 125 6.733 -47.832 6.462 1.00 14.23 N ATOM 1893 CA ILE A 125 8.030 -47.816 5.799 1.00 63.12 C ATOM 1894 C ILE A 125 7.912 -48.271 4.348 1.00 33.43 C ATOM 1895 O ILE A 125 8.611 -47.767 3.470 1.00 50.14 O ATOM 1896 CB ILE A 125 9.046 -48.717 6.526 1.00 35.15 C ATOM 1897 CG1 ILE A 125 9.281 -48.210 7.951 1.00 71.41 C ATOM 1898 CG2 ILE A 125 10.355 -48.770 5.754 1.00 22.42 C ATOM 1899 CD1 ILE A 125 9.968 -46.864 8.007 1.00 11.14 C ATOM 0 H ILE A 125 6.709 -48.369 7.329 1.00 14.23 H new ATOM 0 HA ILE A 125 8.385 -46.786 5.827 1.00 63.12 H new ATOM 0 HB ILE A 125 8.640 -49.727 6.582 1.00 35.15 H new ATOM 0 HG12 ILE A 125 8.323 -48.142 8.466 1.00 71.41 H new ATOM 0 HG13 ILE A 125 9.883 -48.939 8.493 1.00 71.41 H new ATOM 0 HG21 ILE A 125 11.062 -49.411 6.281 1.00 22.42 H new ATOM 0 HG22 ILE A 125 10.174 -49.172 4.757 1.00 22.42 H new ATOM 0 HG23 ILE A 125 10.769 -47.765 5.670 1.00 22.42 H new ATOM 0 HD11 ILE A 125 10.102 -46.567 9.047 1.00 11.14 H new ATOM 0 HD12 ILE A 125 10.941 -46.932 7.521 1.00 11.14 H new ATOM 0 HD13 ILE A 125 9.357 -46.122 7.494 1.00 11.14 H new ATOM 1911 N ARG A 126 7.021 -49.227 4.105 1.00 53.23 N ATOM 1912 CA ARG A 126 6.810 -49.750 2.760 1.00 14.13 C ATOM 1913 C ARG A 126 6.283 -48.661 1.830 1.00 70.32 C ATOM 1914 O ARG A 126 6.567 -48.664 0.633 1.00 63.53 O ATOM 1915 CB ARG A 126 5.830 -50.924 2.795 1.00 34.10 C ATOM 1916 CG ARG A 126 5.827 -51.753 1.521 1.00 23.32 C ATOM 1917 CD ARG A 126 5.457 -53.202 1.800 1.00 54.41 C ATOM 1918 NE ARG A 126 4.016 -53.376 1.965 1.00 50.21 N ATOM 1919 CZ ARG A 126 3.152 -53.346 0.956 1.00 11.25 C ATOM 1920 NH1 ARG A 126 3.581 -53.150 -0.283 1.00 33.03 N ATOM 1921 NH2 ARG A 126 1.856 -53.513 1.187 1.00 53.43 N ATOM 0 H ARG A 126 6.434 -49.655 4.821 1.00 53.23 H new ATOM 0 HA ARG A 126 7.770 -50.098 2.377 1.00 14.13 H new ATOM 0 HB2 ARG A 126 6.079 -51.569 3.638 1.00 34.10 H new ATOM 0 HB3 ARG A 126 4.825 -50.542 2.972 1.00 34.10 H new ATOM 0 HG2 ARG A 126 5.120 -51.326 0.810 1.00 23.32 H new ATOM 0 HG3 ARG A 126 6.812 -51.711 1.056 1.00 23.32 H new ATOM 0 HD2 ARG A 126 5.807 -53.830 0.980 1.00 54.41 H new ATOM 0 HD3 ARG A 126 5.969 -53.540 2.701 1.00 54.41 H new ATOM 0 HE ARG A 126 3.653 -53.529 2.906 1.00 50.21 H new ATOM 0 HH11 ARG A 126 4.577 -53.022 -0.464 1.00 33.03 H new ATOM 0 HH12 ARG A 126 2.915 -53.127 -1.056 1.00 33.03 H new ATOM 0 HH21 ARG A 126 1.523 -53.664 2.139 1.00 53.43 H new ATOM 0 HH22 ARG A 126 1.193 -53.490 0.412 1.00 53.43 H new ATOM 1935 N GLU A 127 5.514 -47.732 2.390 1.00 70.55 N ATOM 1936 CA GLU A 127 4.947 -46.639 1.609 1.00 70.11 C ATOM 1937 C GLU A 127 6.013 -45.599 1.276 1.00 54.14 C ATOM 1938 O GLU A 127 6.193 -45.229 0.116 1.00 61.42 O ATOM 1939 CB GLU A 127 3.797 -45.980 2.373 1.00 32.21 C ATOM 1940 CG GLU A 127 2.867 -45.166 1.490 1.00 54.13 C ATOM 1941 CD GLU A 127 2.339 -45.959 0.310 1.00 21.42 C ATOM 1942 OE1 GLU A 127 2.055 -47.163 0.483 1.00 2.13 O ATOM 1943 OE2 GLU A 127 2.210 -45.376 -0.787 1.00 1.25 O ATOM 0 H GLU A 127 5.270 -47.715 3.380 1.00 70.55 H new ATOM 0 HA GLU A 127 4.564 -47.053 0.676 1.00 70.11 H new ATOM 0 HB2 GLU A 127 3.219 -46.753 2.880 1.00 32.21 H new ATOM 0 HB3 GLU A 127 4.210 -45.332 3.146 1.00 32.21 H new ATOM 0 HG2 GLU A 127 2.028 -44.807 2.086 1.00 54.13 H new ATOM 0 HG3 GLU A 127 3.397 -44.287 1.124 1.00 54.13 H new ATOM 1950 N ALA A 128 6.715 -45.130 2.302 1.00 61.31 N ATOM 1951 CA ALA A 128 7.763 -44.134 2.119 1.00 63.11 C ATOM 1952 C ALA A 128 8.917 -44.696 1.295 1.00 53.03 C ATOM 1953 O ALA A 128 9.545 -43.977 0.518 1.00 42.21 O ATOM 1954 CB ALA A 128 8.266 -43.643 3.468 1.00 22.23 C ATOM 0 H ALA A 128 6.577 -45.424 3.269 1.00 61.31 H new ATOM 0 HA ALA A 128 7.338 -43.292 1.573 1.00 63.11 H new ATOM 0 HB1 ALA A 128 9.048 -42.900 3.316 1.00 22.23 H new ATOM 0 HB2 ALA A 128 7.442 -43.194 4.022 1.00 22.23 H new ATOM 0 HB3 ALA A 128 8.669 -44.483 4.034 1.00 22.23 H new ATOM 1960 N ASP A 129 9.190 -45.984 1.470 1.00 61.13 N ATOM 1961 CA ASP A 129 10.268 -46.643 0.742 1.00 45.34 C ATOM 1962 C ASP A 129 9.936 -46.749 -0.743 1.00 53.04 C ATOM 1963 O ASP A 129 9.392 -47.757 -1.197 1.00 44.40 O ATOM 1964 CB ASP A 129 10.527 -48.035 1.320 1.00 42.21 C ATOM 1965 CG ASP A 129 11.792 -48.665 0.769 1.00 15.41 C ATOM 1966 OD1 ASP A 129 12.588 -47.941 0.135 1.00 54.14 O ATOM 1967 OD2 ASP A 129 11.985 -49.881 0.973 1.00 24.04 O ATOM 0 H ASP A 129 8.680 -46.593 2.110 1.00 61.13 H new ATOM 0 HA ASP A 129 11.169 -46.039 0.852 1.00 45.34 H new ATOM 0 HB2 ASP A 129 10.602 -47.966 2.405 1.00 42.21 H new ATOM 0 HB3 ASP A 129 9.677 -48.681 1.099 1.00 42.21 H new ATOM 1972 N ILE A 130 10.264 -45.703 -1.494 1.00 63.24 N ATOM 1973 CA ILE A 130 10.000 -45.680 -2.928 1.00 1.54 C ATOM 1974 C ILE A 130 11.056 -46.468 -3.694 1.00 61.44 C ATOM 1975 O ILE A 130 10.732 -47.270 -4.570 1.00 60.44 O ATOM 1976 CB ILE A 130 9.959 -44.238 -3.469 1.00 33.23 C ATOM 1977 CG1 ILE A 130 8.888 -43.426 -2.738 1.00 35.34 C ATOM 1978 CG2 ILE A 130 9.697 -44.242 -4.967 1.00 61.44 C ATOM 1979 CD1 ILE A 130 9.050 -41.931 -2.896 1.00 10.21 C ATOM 0 H ILE A 130 10.713 -44.861 -1.134 1.00 63.24 H new ATOM 0 HA ILE A 130 9.025 -46.144 -3.077 1.00 1.54 H new ATOM 0 HB ILE A 130 10.928 -43.771 -3.290 1.00 33.23 H new ATOM 0 HG12 ILE A 130 7.906 -43.718 -3.109 1.00 35.34 H new ATOM 0 HG13 ILE A 130 8.915 -43.676 -1.677 1.00 35.34 H new ATOM 0 HG21 ILE A 130 9.671 -43.216 -5.335 1.00 61.44 H new ATOM 0 HG22 ILE A 130 10.492 -44.789 -5.474 1.00 61.44 H new ATOM 0 HG23 ILE A 130 8.740 -44.724 -5.168 1.00 61.44 H new ATOM 0 HD11 ILE A 130 8.256 -41.419 -2.352 1.00 10.21 H new ATOM 0 HD12 ILE A 130 10.018 -41.626 -2.498 1.00 10.21 H new ATOM 0 HD13 ILE A 130 8.993 -41.668 -3.952 1.00 10.21 H new ATOM 1991 N ASP A 131 12.320 -46.236 -3.358 1.00 30.42 N ATOM 1992 CA ASP A 131 13.425 -46.927 -4.012 1.00 72.35 C ATOM 1993 C ASP A 131 13.494 -48.385 -3.567 1.00 44.23 C ATOM 1994 O ASP A 131 14.255 -49.178 -4.120 1.00 42.33 O ATOM 1995 CB ASP A 131 14.748 -46.224 -3.706 1.00 12.22 C ATOM 1996 CG ASP A 131 14.973 -46.038 -2.218 1.00 44.22 C ATOM 1997 OD1 ASP A 131 14.431 -46.841 -1.431 1.00 22.35 O ATOM 1998 OD2 ASP A 131 15.693 -45.089 -1.842 1.00 31.43 O ATOM 0 H ASP A 131 12.605 -45.574 -2.636 1.00 30.42 H new ATOM 0 HA ASP A 131 13.250 -46.902 -5.088 1.00 72.35 H new ATOM 0 HB2 ASP A 131 15.570 -46.804 -4.125 1.00 12.22 H new ATOM 0 HB3 ASP A 131 14.761 -45.251 -4.197 1.00 12.22 H new ATOM 2003 N GLY A 132 12.695 -48.730 -2.563 1.00 32.44 N ATOM 2004 CA GLY A 132 12.682 -50.092 -2.059 1.00 40.53 C ATOM 2005 C GLY A 132 14.018 -50.506 -1.475 1.00 32.11 C ATOM 2006 O GLY A 132 14.489 -51.618 -1.714 1.00 3.01 O ATOM 0 H GLY A 132 12.056 -48.092 -2.089 1.00 32.44 H new ATOM 0 HA2 GLY A 132 11.910 -50.186 -1.295 1.00 40.53 H new ATOM 0 HA3 GLY A 132 12.415 -50.773 -2.867 1.00 40.53 H new ATOM 2010 N ASP A 133 14.630 -49.610 -0.708 1.00 71.44 N ATOM 2011 CA ASP A 133 15.920 -49.889 -0.088 1.00 42.35 C ATOM 2012 C ASP A 133 15.737 -50.563 1.268 1.00 65.25 C ATOM 2013 O ASP A 133 16.676 -51.138 1.818 1.00 12.50 O ATOM 2014 CB ASP A 133 16.721 -48.596 0.075 1.00 50.21 C ATOM 2015 CG ASP A 133 16.084 -47.642 1.066 1.00 4.14 C ATOM 2016 OD1 ASP A 133 14.879 -47.800 1.352 1.00 32.13 O ATOM 2017 OD2 ASP A 133 16.792 -46.738 1.557 1.00 12.32 O ATOM 0 H ASP A 133 14.254 -48.685 -0.501 1.00 71.44 H new ATOM 0 HA ASP A 133 16.469 -50.568 -0.740 1.00 42.35 H new ATOM 0 HB2 ASP A 133 17.731 -48.837 0.405 1.00 50.21 H new ATOM 0 HB3 ASP A 133 16.811 -48.103 -0.893 1.00 50.21 H new ATOM 2022 N GLY A 134 14.522 -50.488 1.801 1.00 31.23 N ATOM 2023 CA GLY A 134 14.239 -51.094 3.089 1.00 35.50 C ATOM 2024 C GLY A 134 14.146 -50.071 4.204 1.00 71.53 C ATOM 2025 O GLY A 134 13.954 -50.427 5.366 1.00 74.30 O ATOM 0 H GLY A 134 13.729 -50.019 1.364 1.00 31.23 H new ATOM 0 HA2 GLY A 134 13.302 -51.647 3.029 1.00 35.50 H new ATOM 0 HA3 GLY A 134 15.020 -51.816 3.327 1.00 35.50 H new ATOM 2029 N GLN A 135 14.285 -48.798 3.849 1.00 32.12 N ATOM 2030 CA GLN A 135 14.218 -47.721 4.830 1.00 72.02 C ATOM 2031 C GLN A 135 13.656 -46.449 4.204 1.00 51.04 C ATOM 2032 O GLN A 135 13.459 -46.376 2.990 1.00 21.35 O ATOM 2033 CB GLN A 135 15.605 -47.447 5.413 1.00 41.21 C ATOM 2034 CG GLN A 135 15.573 -46.924 6.840 1.00 53.31 C ATOM 2035 CD GLN A 135 16.801 -47.320 7.635 1.00 43.13 C ATOM 2036 OE1 GLN A 135 16.742 -48.201 8.493 1.00 1.31 O ATOM 2037 NE2 GLN A 135 17.924 -46.670 7.352 1.00 3.15 N ATOM 0 H GLN A 135 14.445 -48.487 2.891 1.00 32.12 H new ATOM 0 HA GLN A 135 13.550 -48.035 5.632 1.00 72.02 H new ATOM 0 HB2 GLN A 135 16.190 -48.366 5.385 1.00 41.21 H new ATOM 0 HB3 GLN A 135 16.119 -46.723 4.781 1.00 41.21 H new ATOM 0 HG2 GLN A 135 15.491 -45.837 6.823 1.00 53.31 H new ATOM 0 HG3 GLN A 135 14.683 -47.303 7.342 1.00 53.31 H new ATOM 0 HE21 GLN A 135 17.927 -45.947 6.633 1.00 3.15 H new ATOM 0 HE22 GLN A 135 18.783 -46.894 7.854 1.00 3.15 H new ATOM 2046 N VAL A 136 13.399 -45.448 5.039 1.00 11.51 N ATOM 2047 CA VAL A 136 12.860 -44.177 4.567 1.00 21.54 C ATOM 2048 C VAL A 136 13.923 -43.085 4.598 1.00 55.41 C ATOM 2049 O VAL A 136 14.335 -42.635 5.666 1.00 32.43 O ATOM 2050 CB VAL A 136 11.654 -43.730 5.415 1.00 44.10 C ATOM 2051 CG1 VAL A 136 11.127 -42.389 4.927 1.00 1.04 C ATOM 2052 CG2 VAL A 136 10.560 -44.786 5.383 1.00 11.12 C ATOM 0 H VAL A 136 13.555 -45.492 6.046 1.00 11.51 H new ATOM 0 HA VAL A 136 12.533 -44.333 3.539 1.00 21.54 H new ATOM 0 HB VAL A 136 11.981 -43.611 6.448 1.00 44.10 H new ATOM 0 HG11 VAL A 136 10.275 -42.089 5.537 1.00 1.04 H new ATOM 0 HG12 VAL A 136 11.913 -41.638 5.007 1.00 1.04 H new ATOM 0 HG13 VAL A 136 10.814 -42.478 3.887 1.00 1.04 H new ATOM 0 HG21 VAL A 136 9.716 -44.454 5.987 1.00 11.12 H new ATOM 0 HG22 VAL A 136 10.232 -44.939 4.355 1.00 11.12 H new ATOM 0 HG23 VAL A 136 10.947 -45.723 5.784 1.00 11.12 H new ATOM 2062 N ASN A 137 14.362 -42.661 3.417 1.00 15.42 N ATOM 2063 CA ASN A 137 15.377 -41.619 3.308 1.00 31.42 C ATOM 2064 C ASN A 137 14.733 -40.239 3.220 1.00 3.03 C ATOM 2065 O ASN A 137 13.535 -40.116 2.967 1.00 35.44 O ATOM 2066 CB ASN A 137 16.257 -41.863 2.081 1.00 63.12 C ATOM 2067 CG ASN A 137 15.443 -42.095 0.822 1.00 5.33 C ATOM 2068 OD1 ASN A 137 14.324 -41.599 0.694 1.00 72.41 O ATOM 2069 ND2 ASN A 137 16.004 -42.851 -0.114 1.00 24.32 N ATOM 0 H ASN A 137 14.031 -43.023 2.523 1.00 15.42 H new ATOM 0 HA ASN A 137 15.996 -41.654 4.204 1.00 31.42 H new ATOM 0 HB2 ASN A 137 16.914 -41.006 1.933 1.00 63.12 H new ATOM 0 HB3 ASN A 137 16.896 -42.727 2.262 1.00 63.12 H new ATOM 0 HD21 ASN A 137 15.505 -43.041 -0.983 1.00 24.32 H new ATOM 0 HD22 ASN A 137 16.934 -43.241 0.036 1.00 24.32 H new ATOM 2076 N TYR A 138 15.538 -39.203 3.430 1.00 13.01 N ATOM 2077 CA TYR A 138 15.047 -37.831 3.376 1.00 31.15 C ATOM 2078 C TYR A 138 14.293 -37.573 2.075 1.00 1.45 C ATOM 2079 O TYR A 138 13.202 -37.004 2.081 1.00 72.22 O ATOM 2080 CB TYR A 138 16.209 -36.846 3.510 1.00 43.22 C ATOM 2081 CG TYR A 138 15.782 -35.396 3.466 1.00 42.02 C ATOM 2082 CD1 TYR A 138 15.017 -34.846 4.487 1.00 4.41 C ATOM 2083 CD2 TYR A 138 16.142 -34.577 2.403 1.00 4.10 C ATOM 2084 CE1 TYR A 138 14.624 -33.522 4.451 1.00 42.30 C ATOM 2085 CE2 TYR A 138 15.755 -33.252 2.359 1.00 1.33 C ATOM 2086 CZ TYR A 138 14.996 -32.729 3.385 1.00 11.24 C ATOM 2087 OH TYR A 138 14.607 -31.409 3.345 1.00 72.52 O ATOM 0 H TYR A 138 16.533 -39.287 3.639 1.00 13.01 H new ATOM 0 HA TYR A 138 14.358 -37.685 4.208 1.00 31.15 H new ATOM 0 HB2 TYR A 138 16.728 -37.035 4.450 1.00 43.22 H new ATOM 0 HB3 TYR A 138 16.924 -37.030 2.708 1.00 43.22 H new ATOM 0 HD1 TYR A 138 14.725 -35.464 5.323 1.00 4.41 H new ATOM 0 HD2 TYR A 138 16.735 -34.984 1.597 1.00 4.10 H new ATOM 0 HE1 TYR A 138 14.029 -33.110 5.253 1.00 42.30 H new ATOM 0 HE2 TYR A 138 16.045 -32.629 1.526 1.00 1.33 H new ATOM 0 HH TYR A 138 14.952 -30.991 2.529 1.00 72.52 H new ATOM 2097 N GLU A 139 14.884 -37.995 0.962 1.00 24.55 N ATOM 2098 CA GLU A 139 14.269 -37.810 -0.347 1.00 3.25 C ATOM 2099 C GLU A 139 12.837 -38.336 -0.354 1.00 70.21 C ATOM 2100 O GLU A 139 11.945 -37.727 -0.942 1.00 55.34 O ATOM 2101 CB GLU A 139 15.090 -38.519 -1.426 1.00 4.43 C ATOM 2102 CG GLU A 139 14.640 -38.199 -2.841 1.00 41.12 C ATOM 2103 CD GLU A 139 13.506 -39.091 -3.308 1.00 50.30 C ATOM 2104 OE1 GLU A 139 13.574 -40.314 -3.065 1.00 53.45 O ATOM 2105 OE2 GLU A 139 12.550 -38.565 -3.916 1.00 42.40 O ATOM 0 H GLU A 139 15.788 -38.467 0.940 1.00 24.55 H new ATOM 0 HA GLU A 139 14.246 -36.742 -0.562 1.00 3.25 H new ATOM 0 HB2 GLU A 139 16.138 -38.240 -1.315 1.00 4.43 H new ATOM 0 HB3 GLU A 139 15.028 -39.596 -1.269 1.00 4.43 H new ATOM 0 HG2 GLU A 139 14.322 -37.158 -2.890 1.00 41.12 H new ATOM 0 HG3 GLU A 139 15.486 -38.307 -3.520 1.00 41.12 H new ATOM 2112 N GLU A 140 12.627 -39.472 0.303 1.00 33.43 N ATOM 2113 CA GLU A 140 11.304 -40.081 0.371 1.00 75.41 C ATOM 2114 C GLU A 140 10.430 -39.372 1.401 1.00 12.51 C ATOM 2115 O GLU A 140 9.246 -39.130 1.166 1.00 14.24 O ATOM 2116 CB GLU A 140 11.419 -41.567 0.720 1.00 14.32 C ATOM 2117 CG GLU A 140 11.801 -42.442 -0.461 1.00 43.03 C ATOM 2118 CD GLU A 140 12.588 -43.670 -0.047 1.00 23.02 C ATOM 2119 OE1 GLU A 140 12.409 -44.129 1.101 1.00 71.54 O ATOM 2120 OE2 GLU A 140 13.383 -44.171 -0.869 1.00 23.31 O ATOM 0 H GLU A 140 13.355 -39.989 0.795 1.00 33.43 H new ATOM 0 HA GLU A 140 10.836 -39.980 -0.608 1.00 75.41 H new ATOM 0 HB2 GLU A 140 12.162 -41.690 1.508 1.00 14.32 H new ATOM 0 HB3 GLU A 140 10.467 -41.911 1.124 1.00 14.32 H new ATOM 0 HG2 GLU A 140 10.897 -42.754 -0.985 1.00 43.03 H new ATOM 0 HG3 GLU A 140 12.392 -41.857 -1.166 1.00 43.03 H new ATOM 2127 N PHE A 141 11.023 -39.041 2.543 1.00 13.45 N ATOM 2128 CA PHE A 141 10.299 -38.360 3.611 1.00 22.11 C ATOM 2129 C PHE A 141 9.740 -37.026 3.125 1.00 75.53 C ATOM 2130 O PHE A 141 8.651 -36.614 3.525 1.00 73.23 O ATOM 2131 CB PHE A 141 11.217 -38.132 4.814 1.00 64.52 C ATOM 2132 CG PHE A 141 10.504 -37.589 6.019 1.00 73.34 C ATOM 2133 CD1 PHE A 141 9.832 -38.438 6.884 1.00 63.24 C ATOM 2134 CD2 PHE A 141 10.504 -36.230 6.286 1.00 52.33 C ATOM 2135 CE1 PHE A 141 9.175 -37.942 7.993 1.00 12.35 C ATOM 2136 CE2 PHE A 141 9.848 -35.728 7.394 1.00 5.41 C ATOM 2137 CZ PHE A 141 9.182 -36.584 8.248 1.00 21.44 C ATOM 0 H PHE A 141 12.002 -39.233 2.753 1.00 13.45 H new ATOM 0 HA PHE A 141 9.466 -38.995 3.913 1.00 22.11 H new ATOM 0 HB2 PHE A 141 11.695 -39.075 5.079 1.00 64.52 H new ATOM 0 HB3 PHE A 141 12.010 -37.441 4.529 1.00 64.52 H new ATOM 0 HD1 PHE A 141 9.822 -39.500 6.689 1.00 63.24 H new ATOM 0 HD2 PHE A 141 11.022 -35.555 5.621 1.00 52.33 H new ATOM 0 HE1 PHE A 141 8.656 -38.615 8.660 1.00 12.35 H new ATOM 0 HE2 PHE A 141 9.856 -34.666 7.592 1.00 5.41 H new ATOM 0 HZ PHE A 141 8.668 -36.193 9.113 1.00 21.44 H new ATOM 2147 N VAL A 142 10.493 -36.356 2.259 1.00 40.21 N ATOM 2148 CA VAL A 142 10.073 -35.069 1.717 1.00 64.02 C ATOM 2149 C VAL A 142 8.917 -35.236 0.737 1.00 20.14 C ATOM 2150 O VAL A 142 8.003 -34.413 0.696 1.00 31.20 O ATOM 2151 CB VAL A 142 11.237 -34.354 1.004 1.00 74.34 C ATOM 2152 CG1 VAL A 142 10.772 -33.029 0.420 1.00 14.32 C ATOM 2153 CG2 VAL A 142 12.400 -34.146 1.961 1.00 64.03 C ATOM 0 H VAL A 142 11.397 -36.683 1.918 1.00 40.21 H new ATOM 0 HA VAL A 142 9.745 -34.462 2.561 1.00 64.02 H new ATOM 0 HB VAL A 142 11.580 -34.984 0.184 1.00 74.34 H new ATOM 0 HG11 VAL A 142 11.607 -32.538 -0.080 1.00 14.32 H new ATOM 0 HG12 VAL A 142 9.974 -33.209 -0.300 1.00 14.32 H new ATOM 0 HG13 VAL A 142 10.401 -32.389 1.220 1.00 14.32 H new ATOM 0 HG21 VAL A 142 13.213 -33.640 1.441 1.00 64.03 H new ATOM 0 HG22 VAL A 142 12.073 -33.537 2.804 1.00 64.03 H new ATOM 0 HG23 VAL A 142 12.748 -35.112 2.326 1.00 64.03 H new ATOM 2163 N GLN A 143 8.964 -36.307 -0.049 1.00 5.24 N ATOM 2164 CA GLN A 143 7.920 -36.581 -1.028 1.00 61.44 C ATOM 2165 C GLN A 143 6.649 -37.075 -0.345 1.00 61.13 C ATOM 2166 O GLN A 143 5.542 -36.833 -0.824 1.00 14.52 O ATOM 2167 CB GLN A 143 8.404 -37.619 -2.043 1.00 54.33 C ATOM 2168 CG GLN A 143 7.386 -37.928 -3.129 1.00 53.12 C ATOM 2169 CD GLN A 143 6.756 -36.678 -3.712 1.00 63.01 C ATOM 2170 OE1 GLN A 143 7.422 -35.656 -3.884 1.00 73.44 O ATOM 2171 NE2 GLN A 143 5.467 -36.753 -4.020 1.00 14.44 N ATOM 0 H GLN A 143 9.714 -36.998 -0.027 1.00 5.24 H new ATOM 0 HA GLN A 143 7.692 -35.651 -1.549 1.00 61.44 H new ATOM 0 HB2 GLN A 143 9.322 -37.260 -2.508 1.00 54.33 H new ATOM 0 HB3 GLN A 143 8.653 -38.541 -1.517 1.00 54.33 H new ATOM 0 HG2 GLN A 143 7.871 -38.491 -3.926 1.00 53.12 H new ATOM 0 HG3 GLN A 143 6.604 -38.566 -2.718 1.00 53.12 H new ATOM 0 HE21 GLN A 143 4.954 -37.620 -3.861 1.00 14.44 H new ATOM 0 HE22 GLN A 143 4.989 -35.943 -4.416 1.00 14.44 H new ATOM 2180 N MET A 144 6.817 -37.769 0.776 1.00 70.24 N ATOM 2181 CA MET A 144 5.682 -38.296 1.525 1.00 63.32 C ATOM 2182 C MET A 144 4.956 -37.180 2.268 1.00 55.21 C ATOM 2183 O MET A 144 3.755 -36.980 2.087 1.00 72.45 O ATOM 2184 CB MET A 144 6.150 -39.364 2.516 1.00 73.14 C ATOM 2185 CG MET A 144 5.012 -40.170 3.122 1.00 64.11 C ATOM 2186 SD MET A 144 4.310 -41.360 1.964 1.00 54.25 S ATOM 2187 CE MET A 144 2.582 -41.311 2.434 1.00 1.31 C ATOM 0 H MET A 144 7.727 -37.979 1.185 1.00 70.24 H new ATOM 0 HA MET A 144 4.988 -38.747 0.816 1.00 63.32 H new ATOM 0 HB2 MET A 144 6.836 -40.043 2.009 1.00 73.14 H new ATOM 0 HB3 MET A 144 6.711 -38.884 3.317 1.00 73.14 H new ATOM 0 HG2 MET A 144 5.375 -40.698 4.004 1.00 64.11 H new ATOM 0 HG3 MET A 144 4.229 -39.490 3.458 1.00 64.11 H new ATOM 0 HE1 MET A 144 2.301 -42.262 2.886 1.00 1.31 H new ATOM 0 HE2 MET A 144 2.423 -40.507 3.152 1.00 1.31 H new ATOM 0 HE3 MET A 144 1.969 -41.135 1.550 1.00 1.31 H new ATOM 2197 N MET A 145 5.691 -36.455 3.105 1.00 63.44 N ATOM 2198 CA MET A 145 5.116 -35.358 3.874 1.00 33.41 C ATOM 2199 C MET A 145 4.568 -34.275 2.950 1.00 33.25 C ATOM 2200 O MET A 145 3.657 -33.533 3.319 1.00 51.43 O ATOM 2201 CB MET A 145 6.165 -34.761 4.814 1.00 53.01 C ATOM 2202 CG MET A 145 5.578 -33.843 5.874 1.00 3.11 C ATOM 2203 SD MET A 145 6.526 -33.859 7.408 1.00 43.52 S ATOM 2204 CE MET A 145 6.120 -35.484 8.040 1.00 20.23 C ATOM 0 H MET A 145 6.686 -36.608 3.268 1.00 63.44 H new ATOM 0 HA MET A 145 4.292 -35.755 4.467 1.00 33.41 H new ATOM 0 HB2 MET A 145 6.704 -35.571 5.305 1.00 53.01 H new ATOM 0 HB3 MET A 145 6.894 -34.204 4.225 1.00 53.01 H new ATOM 0 HG2 MET A 145 5.539 -32.825 5.486 1.00 3.11 H new ATOM 0 HG3 MET A 145 4.552 -34.145 6.082 1.00 3.11 H new ATOM 0 HE1 MET A 145 6.545 -35.603 9.037 1.00 20.23 H new ATOM 0 HE2 MET A 145 5.037 -35.594 8.092 1.00 20.23 H new ATOM 0 HE3 MET A 145 6.531 -36.245 7.377 1.00 20.23 H new ATOM 2214 N THR A 146 5.128 -34.190 1.748 1.00 4.50 N ATOM 2215 CA THR A 146 4.697 -33.196 0.773 1.00 70.44 C ATOM 2216 C THR A 146 3.958 -33.851 -0.389 1.00 35.15 C ATOM 2217 O THR A 146 3.855 -33.279 -1.473 1.00 64.03 O ATOM 2218 CB THR A 146 5.891 -32.396 0.220 1.00 64.12 C ATOM 2219 OG1 THR A 146 6.832 -32.134 1.267 1.00 42.00 O ATOM 2220 CG2 THR A 146 5.427 -31.083 -0.392 1.00 15.04 C ATOM 0 H THR A 146 5.881 -34.798 1.426 1.00 4.50 H new ATOM 0 HA THR A 146 4.023 -32.515 1.293 1.00 70.44 H new ATOM 0 HB THR A 146 6.369 -32.991 -0.558 1.00 64.12 H new ATOM 0 HG1 THR A 146 7.327 -32.954 1.474 1.00 42.00 H new ATOM 0 HG21 THR A 146 6.288 -30.536 -0.776 1.00 15.04 H new ATOM 0 HG22 THR A 146 4.734 -31.287 -1.208 1.00 15.04 H new ATOM 0 HG23 THR A 146 4.926 -30.484 0.369 1.00 15.04 H new ATOM 2351 N LYS M 15 -2.030 -43.556 8.584 1.00 51.22 N ATOM 2352 CA LYS M 15 -1.158 -43.100 9.660 1.00 54.52 C ATOM 2353 C LYS M 15 -0.194 -42.028 9.161 1.00 13.45 C ATOM 2354 O LYS M 15 0.042 -41.028 9.840 1.00 20.44 O ATOM 2355 CB LYS M 15 -0.372 -44.277 10.241 1.00 14.12 C ATOM 2356 CG LYS M 15 -1.221 -45.512 10.489 1.00 14.33 C ATOM 2357 CD LYS M 15 -0.427 -46.604 11.186 1.00 11.32 C ATOM 2358 CE LYS M 15 -0.822 -47.985 10.687 1.00 31.10 C ATOM 2359 NZ LYS M 15 -0.552 -48.147 9.231 1.00 34.05 N ATOM 0 HA LYS M 15 -1.783 -42.667 10.442 1.00 54.52 H new ATOM 0 HB2 LYS M 15 0.438 -44.534 9.559 1.00 14.12 H new ATOM 0 HB3 LYS M 15 0.088 -43.968 11.180 1.00 14.12 H new ATOM 0 HG2 LYS M 15 -2.085 -45.244 11.097 1.00 14.33 H new ATOM 0 HG3 LYS M 15 -1.603 -45.888 9.540 1.00 14.33 H new ATOM 0 HD2 LYS M 15 0.638 -46.446 11.016 1.00 11.32 H new ATOM 0 HD3 LYS M 15 -0.591 -46.544 12.262 1.00 11.32 H new ATOM 0 HE2 LYS M 15 -0.273 -48.744 11.245 1.00 31.10 H new ATOM 0 HE3 LYS M 15 -1.882 -48.152 10.881 1.00 31.10 H new ATOM 0 HZ1 LYS M 15 -0.338 -49.144 9.026 1.00 34.05 H new ATOM 0 HZ2 LYS M 15 -1.389 -47.854 8.688 1.00 34.05 H new ATOM 0 HZ3 LYS M 15 0.260 -47.557 8.961 1.00 34.05 H new ATOM 2373 N TRP M 16 0.358 -42.242 7.973 1.00 55.43 N ATOM 2374 CA TRP M 16 1.295 -41.292 7.383 1.00 32.23 C ATOM 2375 C TRP M 16 0.712 -39.883 7.378 1.00 75.51 C ATOM 2376 O TRP M 16 1.381 -38.924 7.760 1.00 33.34 O ATOM 2377 CB TRP M 16 1.652 -41.715 5.957 1.00 21.15 C ATOM 2378 CG TRP M 16 2.798 -42.679 5.893 1.00 3.42 C ATOM 2379 CD1 TRP M 16 2.814 -43.893 5.269 1.00 41.05 C ATOM 2380 CD2 TRP M 16 4.094 -42.509 6.477 1.00 4.33 C ATOM 2381 NE1 TRP M 16 4.042 -44.488 5.429 1.00 21.21 N ATOM 2382 CE2 TRP M 16 4.846 -43.659 6.166 1.00 34.00 C ATOM 2383 CE3 TRP M 16 4.694 -41.496 7.231 1.00 62.32 C ATOM 2384 CZ2 TRP M 16 6.164 -43.823 6.584 1.00 14.40 C ATOM 2385 CZ3 TRP M 16 6.002 -41.660 7.645 1.00 23.22 C ATOM 2386 CH2 TRP M 16 6.726 -42.816 7.321 1.00 53.44 C ATOM 0 H TRP M 16 0.174 -43.065 7.399 1.00 55.43 H new ATOM 0 HA TRP M 16 2.200 -41.288 7.991 1.00 32.23 H new ATOM 0 HB2 TRP M 16 0.778 -42.169 5.491 1.00 21.15 H new ATOM 0 HB3 TRP M 16 1.900 -40.828 5.374 1.00 21.15 H new ATOM 0 HD1 TRP M 16 1.983 -44.323 4.729 1.00 41.05 H new ATOM 0 HE1 TRP M 16 4.311 -45.399 5.059 1.00 21.21 H new ATOM 0 HE3 TRP M 16 4.145 -40.601 7.485 1.00 62.32 H new ATOM 0 HZ2 TRP M 16 6.723 -44.713 6.335 1.00 14.40 H new ATOM 0 HZ3 TRP M 16 6.475 -40.884 8.228 1.00 23.22 H new ATOM 0 HH2 TRP M 16 7.747 -42.914 7.660 1.00 53.44 H new ATOM 2397 N GLU M 17 -0.539 -39.767 6.942 1.00 10.12 N ATOM 2398 CA GLU M 17 -1.211 -38.474 6.887 1.00 3.22 C ATOM 2399 C GLU M 17 -1.192 -37.792 8.253 1.00 62.54 C ATOM 2400 O GLU M 17 -1.235 -36.566 8.348 1.00 52.30 O ATOM 2401 CB GLU M 17 -2.654 -38.644 6.410 1.00 54.12 C ATOM 2402 CG GLU M 17 -3.473 -37.366 6.481 1.00 74.05 C ATOM 2403 CD GLU M 17 -4.179 -37.198 7.812 1.00 22.23 C ATOM 2404 OE1 GLU M 17 -5.060 -38.026 8.125 1.00 61.42 O ATOM 2405 OE2 GLU M 17 -3.850 -36.239 8.542 1.00 75.34 O ATOM 0 H GLU M 17 -1.107 -40.552 6.622 1.00 10.12 H new ATOM 0 HA GLU M 17 -0.674 -37.844 6.178 1.00 3.22 H new ATOM 0 HB2 GLU M 17 -2.648 -39.005 5.381 1.00 54.12 H new ATOM 0 HB3 GLU M 17 -3.139 -39.411 7.014 1.00 54.12 H new ATOM 0 HG2 GLU M 17 -2.820 -36.510 6.310 1.00 74.05 H new ATOM 0 HG3 GLU M 17 -4.212 -37.368 5.680 1.00 74.05 H new ATOM 2412 N LYS M 18 -1.127 -38.597 9.308 1.00 74.21 N ATOM 2413 CA LYS M 18 -1.102 -38.075 10.669 1.00 50.42 C ATOM 2414 C LYS M 18 0.269 -37.498 11.005 1.00 45.34 C ATOM 2415 O LYS M 18 0.385 -36.580 11.817 1.00 13.41 O ATOM 2416 CB LYS M 18 -1.462 -39.177 11.667 1.00 23.23 C ATOM 2417 CG LYS M 18 -1.859 -38.652 13.036 1.00 31.30 C ATOM 2418 CD LYS M 18 -1.497 -39.635 14.137 1.00 43.11 C ATOM 2419 CE LYS M 18 -2.366 -40.882 14.079 1.00 65.00 C ATOM 2420 NZ LYS M 18 -3.814 -40.555 14.196 1.00 24.12 N ATOM 0 H LYS M 18 -1.091 -39.614 9.246 1.00 74.21 H new ATOM 0 HA LYS M 18 -1.840 -37.276 10.738 1.00 50.42 H new ATOM 0 HB2 LYS M 18 -2.283 -39.768 11.262 1.00 23.23 H new ATOM 0 HB3 LYS M 18 -0.610 -39.848 11.777 1.00 23.23 H new ATOM 0 HG2 LYS M 18 -1.362 -37.700 13.220 1.00 31.30 H new ATOM 0 HG3 LYS M 18 -2.932 -38.461 13.056 1.00 31.30 H new ATOM 0 HD2 LYS M 18 -0.448 -39.917 14.044 1.00 43.11 H new ATOM 0 HD3 LYS M 18 -1.613 -39.154 15.108 1.00 43.11 H new ATOM 0 HE2 LYS M 18 -2.187 -41.406 13.140 1.00 65.00 H new ATOM 0 HE3 LYS M 18 -2.081 -41.561 14.883 1.00 65.00 H new ATOM 0 HZ1 LYS M 18 -4.341 -41.408 14.473 1.00 24.12 H new ATOM 0 HZ2 LYS M 18 -3.946 -39.817 14.916 1.00 24.12 H new ATOM 0 HZ3 LYS M 18 -4.168 -40.212 13.280 1.00 24.12 H new ATOM 2434 N ILE M 19 1.305 -38.041 10.374 1.00 42.52 N ATOM 2435 CA ILE M 19 2.668 -37.577 10.604 1.00 31.14 C ATOM 2436 C ILE M 19 2.948 -36.289 9.837 1.00 71.50 C ATOM 2437 O ILE M 19 3.816 -35.504 10.218 1.00 63.32 O ATOM 2438 CB ILE M 19 3.702 -38.642 10.193 1.00 52.11 C ATOM 2439 CG1 ILE M 19 3.389 -39.977 10.872 1.00 71.05 C ATOM 2440 CG2 ILE M 19 5.108 -38.179 10.545 1.00 34.03 C ATOM 2441 CD1 ILE M 19 4.290 -41.107 10.426 1.00 70.23 C ATOM 0 H ILE M 19 1.227 -38.802 9.700 1.00 42.52 H new ATOM 0 HA ILE M 19 2.760 -37.387 11.673 1.00 31.14 H new ATOM 0 HB ILE M 19 3.647 -38.783 9.114 1.00 52.11 H new ATOM 0 HG12 ILE M 19 3.478 -39.856 11.952 1.00 71.05 H new ATOM 0 HG13 ILE M 19 2.353 -40.246 10.666 1.00 71.05 H new ATOM 0 HG21 ILE M 19 5.827 -38.942 10.248 1.00 34.03 H new ATOM 0 HG22 ILE M 19 5.327 -37.250 10.019 1.00 34.03 H new ATOM 0 HG23 ILE M 19 5.178 -38.013 11.620 1.00 34.03 H new ATOM 0 HD11 ILE M 19 4.011 -42.022 10.948 1.00 70.23 H new ATOM 0 HD12 ILE M 19 4.183 -41.255 9.351 1.00 70.23 H new ATOM 0 HD13 ILE M 19 5.326 -40.859 10.657 1.00 70.23 H new ATOM 2453 N ARG M 20 2.205 -36.078 8.755 1.00 23.52 N ATOM 2454 CA ARG M 20 2.373 -34.885 7.934 1.00 30.33 C ATOM 2455 C ARG M 20 2.313 -33.624 8.790 1.00 11.43 C ATOM 2456 O ARG M 20 2.939 -32.613 8.470 1.00 43.42 O ATOM 2457 CB ARG M 20 1.295 -34.831 6.850 1.00 1.31 C ATOM 2458 CG ARG M 20 1.323 -33.553 6.028 1.00 53.14 C ATOM 2459 CD ARG M 20 0.443 -33.666 4.792 1.00 24.41 C ATOM 2460 NE ARG M 20 -0.923 -34.058 5.127 1.00 70.20 N ATOM 2461 CZ ARG M 20 -1.844 -34.362 4.219 1.00 21.00 C ATOM 2462 NH1 ARG M 20 -1.546 -34.320 2.928 1.00 42.32 N ATOM 2463 NH2 ARG M 20 -3.066 -34.709 4.602 1.00 22.52 N ATOM 0 H ARG M 20 1.481 -36.718 8.427 1.00 23.52 H new ATOM 0 HA ARG M 20 3.353 -34.935 7.460 1.00 30.33 H new ATOM 0 HB2 ARG M 20 1.418 -35.685 6.184 1.00 1.31 H new ATOM 0 HB3 ARG M 20 0.316 -34.931 7.318 1.00 1.31 H new ATOM 0 HG2 ARG M 20 0.986 -32.717 6.641 1.00 53.14 H new ATOM 0 HG3 ARG M 20 2.348 -33.335 5.728 1.00 53.14 H new ATOM 0 HD2 ARG M 20 0.428 -32.710 4.269 1.00 24.41 H new ATOM 0 HD3 ARG M 20 0.872 -34.397 4.107 1.00 24.41 H new ATOM 0 HE ARG M 20 -1.184 -34.101 6.112 1.00 70.20 H new ATOM 0 HH11 ARG M 20 -0.608 -34.054 2.630 1.00 42.32 H new ATOM 0 HH12 ARG M 20 -2.255 -34.554 2.233 1.00 42.32 H new ATOM 0 HH21 ARG M 20 -3.299 -34.743 5.594 1.00 22.52 H new ATOM 0 HH22 ARG M 20 -3.772 -34.942 3.904 1.00 22.52 H new ATOM 2630 N LYS M 30 17.276 -18.932 5.545 1.00 14.21 N ATOM 2631 CA LYS M 30 17.989 -18.908 6.817 1.00 54.42 C ATOM 2632 C LYS M 30 18.981 -17.750 6.862 1.00 22.31 C ATOM 2633 O LYS M 30 19.993 -17.814 7.562 1.00 52.31 O ATOM 2634 CB LYS M 30 18.723 -20.232 7.039 1.00 54.03 C ATOM 2635 CG LYS M 30 19.632 -20.624 5.887 1.00 3.51 C ATOM 2636 CD LYS M 30 20.560 -21.763 6.272 1.00 23.44 C ATOM 2637 CE LYS M 30 21.896 -21.246 6.783 1.00 24.00 C ATOM 2638 NZ LYS M 30 22.490 -22.155 7.803 1.00 40.25 N ATOM 0 HA LYS M 30 17.258 -18.768 7.613 1.00 54.42 H new ATOM 0 HB2 LYS M 30 19.316 -20.161 7.951 1.00 54.03 H new ATOM 0 HB3 LYS M 30 17.989 -21.022 7.197 1.00 54.03 H new ATOM 0 HG2 LYS M 30 19.027 -20.920 5.030 1.00 3.51 H new ATOM 0 HG3 LYS M 30 20.222 -19.761 5.578 1.00 3.51 H new ATOM 0 HD2 LYS M 30 20.087 -22.375 7.041 1.00 23.44 H new ATOM 0 HD3 LYS M 30 20.724 -22.407 5.408 1.00 23.44 H new ATOM 0 HE2 LYS M 30 22.587 -21.137 5.947 1.00 24.00 H new ATOM 0 HE3 LYS M 30 21.760 -20.255 7.215 1.00 24.00 H new ATOM 0 HZ1 LYS M 30 23.488 -21.905 7.952 1.00 40.25 H new ATOM 0 HZ2 LYS M 30 21.971 -22.057 8.699 1.00 40.25 H new ATOM 0 HZ3 LYS M 30 22.426 -23.139 7.471 1.00 40.25 H new ATOM 2652 N LEU M 31 18.685 -16.694 6.113 1.00 3.33 N ATOM 2653 CA LEU M 31 19.551 -15.521 6.069 1.00 4.52 C ATOM 2654 C LEU M 31 18.814 -14.280 6.564 1.00 31.42 C ATOM 2655 O LEU M 31 19.416 -13.376 7.144 1.00 62.34 O ATOM 2656 CB LEU M 31 20.060 -15.291 4.645 1.00 0.10 C ATOM 2657 CG LEU M 31 20.651 -13.910 4.358 1.00 63.31 C ATOM 2658 CD1 LEU M 31 21.715 -13.561 5.387 1.00 43.23 C ATOM 2659 CD2 LEU M 31 21.230 -13.860 2.951 1.00 11.13 C ATOM 0 H LEU M 31 17.852 -16.626 5.528 1.00 3.33 H new ATOM 0 HA LEU M 31 20.401 -15.703 6.727 1.00 4.52 H new ATOM 0 HB2 LEU M 31 20.820 -16.042 4.426 1.00 0.10 H new ATOM 0 HB3 LEU M 31 19.235 -15.462 3.954 1.00 0.10 H new ATOM 0 HG LEU M 31 19.852 -13.172 4.427 1.00 63.31 H new ATOM 0 HD11 LEU M 31 22.124 -12.575 5.167 1.00 43.23 H new ATOM 0 HD12 LEU M 31 21.271 -13.556 6.382 1.00 43.23 H new ATOM 0 HD13 LEU M 31 22.514 -14.302 5.350 1.00 43.23 H new ATOM 0 HD21 LEU M 31 21.646 -12.870 2.764 1.00 11.13 H new ATOM 0 HD22 LEU M 31 22.016 -14.609 2.854 1.00 11.13 H new ATOM 0 HD23 LEU M 31 20.442 -14.066 2.226 1.00 11.13 H new ATOM 2671 N LYS M 32 17.506 -14.245 6.334 1.00 72.11 N ATOM 2672 CA LYS M 32 16.684 -13.118 6.759 1.00 72.22 C ATOM 2673 C LYS M 32 16.939 -12.781 8.224 1.00 1.43 C ATOM 2674 O LYS M 32 17.083 -11.612 8.587 1.00 73.43 O ATOM 2675 CB LYS M 32 15.201 -13.434 6.548 1.00 43.31 C ATOM 2676 CG LYS M 32 14.827 -13.653 5.092 1.00 23.53 C ATOM 2677 CD LYS M 32 13.606 -14.548 4.959 1.00 2.12 C ATOM 2678 CE LYS M 32 12.386 -13.928 5.624 1.00 63.24 C ATOM 2679 NZ LYS M 32 12.276 -14.320 7.056 1.00 11.11 N ATOM 0 H LYS M 32 16.992 -14.985 5.855 1.00 72.11 H new ATOM 0 HA LYS M 32 16.955 -12.254 6.153 1.00 72.22 H new ATOM 0 HB2 LYS M 32 14.943 -14.326 7.119 1.00 43.31 H new ATOM 0 HB3 LYS M 32 14.603 -12.616 6.949 1.00 43.31 H new ATOM 0 HG2 LYS M 32 14.628 -12.692 4.618 1.00 23.53 H new ATOM 0 HG3 LYS M 32 15.668 -14.102 4.563 1.00 23.53 H new ATOM 0 HD2 LYS M 32 13.396 -14.725 3.904 1.00 2.12 H new ATOM 0 HD3 LYS M 32 13.814 -15.518 5.410 1.00 2.12 H new ATOM 0 HE2 LYS M 32 12.443 -12.842 5.548 1.00 63.24 H new ATOM 0 HE3 LYS M 32 11.486 -14.237 5.093 1.00 63.24 H new ATOM 0 HZ1 LYS M 32 11.273 -14.372 7.326 1.00 11.11 H new ATOM 0 HZ2 LYS M 32 12.721 -15.249 7.197 1.00 11.11 H new ATOM 0 HZ3 LYS M 32 12.757 -13.613 7.648 1.00 11.11 H new ATOM 2693 N HIS M 33 16.996 -13.810 9.063 1.00 71.30 N ATOM 2694 CA HIS M 33 17.236 -13.622 10.489 1.00 24.33 C ATOM 2695 C HIS M 33 18.459 -12.739 10.722 1.00 33.54 C ATOM 2696 O HIS M 33 18.481 -11.925 11.646 1.00 53.25 O ATOM 2697 CB HIS M 33 17.430 -14.974 11.178 1.00 51.41 C ATOM 2698 CG HIS M 33 17.807 -14.861 12.623 1.00 13.10 C ATOM 2699 ND1 HIS M 33 17.395 -13.821 13.429 1.00 12.13 N ATOM 2700 CD2 HIS M 33 18.561 -15.667 13.407 1.00 51.43 C ATOM 2701 CE1 HIS M 33 17.881 -13.991 14.646 1.00 53.20 C ATOM 2702 NE2 HIS M 33 18.592 -15.104 14.659 1.00 54.00 N ATOM 0 H HIS M 33 16.879 -14.783 8.780 1.00 71.30 H new ATOM 0 HA HIS M 33 16.365 -13.126 10.917 1.00 24.33 H new ATOM 0 HB2 HIS M 33 16.508 -15.550 11.095 1.00 51.41 H new ATOM 0 HB3 HIS M 33 18.204 -15.533 10.652 1.00 51.41 H new ATOM 0 HD2 HIS M 33 19.048 -16.582 13.104 1.00 51.43 H new ATOM 0 HE1 HIS M 33 17.724 -13.332 15.487 1.00 53.20 H new ATOM 0 HE2 HIS M 33 19.084 -15.484 15.468 1.00 54.00 H new ATOM 2710 N ILE M 34 19.473 -12.908 9.881 1.00 41.31 N ATOM 2711 CA ILE M 34 20.698 -12.126 9.996 1.00 50.13 C ATOM 2712 C ILE M 34 20.391 -10.635 10.096 1.00 65.52 C ATOM 2713 O ILE M 34 21.029 -9.909 10.858 1.00 24.22 O ATOM 2714 CB ILE M 34 21.634 -12.367 8.797 1.00 40.34 C ATOM 2715 CG1 ILE M 34 21.943 -13.859 8.654 1.00 13.52 C ATOM 2716 CG2 ILE M 34 22.918 -11.568 8.959 1.00 45.44 C ATOM 2717 CD1 ILE M 34 22.582 -14.464 9.885 1.00 53.55 C ATOM 0 H ILE M 34 19.471 -13.579 9.113 1.00 41.31 H new ATOM 0 HA ILE M 34 21.197 -12.454 10.908 1.00 50.13 H new ATOM 0 HB ILE M 34 21.132 -12.031 7.890 1.00 40.34 H new ATOM 0 HG12 ILE M 34 21.019 -14.394 8.434 1.00 13.52 H new ATOM 0 HG13 ILE M 34 22.606 -14.004 7.801 1.00 13.52 H new ATOM 0 HG21 ILE M 34 23.569 -11.749 8.104 1.00 45.44 H new ATOM 0 HG22 ILE M 34 22.681 -10.506 9.016 1.00 45.44 H new ATOM 0 HG23 ILE M 34 23.425 -11.876 9.873 1.00 45.44 H new ATOM 0 HD11 ILE M 34 22.773 -15.523 9.713 1.00 53.55 H new ATOM 0 HD12 ILE M 34 23.523 -13.955 10.094 1.00 53.55 H new ATOM 0 HD13 ILE M 34 21.911 -14.350 10.736 1.00 53.55 H new ATOM 2729 N VAL M 35 19.409 -10.186 9.322 1.00 40.44 N ATOM 2730 CA VAL M 35 19.015 -8.782 9.325 1.00 50.23 C ATOM 2731 C VAL M 35 18.806 -8.273 10.747 1.00 43.25 C ATOM 2732 O VAL M 35 19.182 -7.147 11.075 1.00 73.41 O ATOM 2733 CB VAL M 35 17.723 -8.560 8.517 1.00 54.12 C ATOM 2734 CG1 VAL M 35 17.395 -7.077 8.430 1.00 32.12 C ATOM 2735 CG2 VAL M 35 17.852 -9.168 7.128 1.00 13.33 C ATOM 0 H VAL M 35 18.871 -10.774 8.685 1.00 40.44 H new ATOM 0 HA VAL M 35 19.827 -8.224 8.858 1.00 50.23 H new ATOM 0 HB VAL M 35 16.903 -9.059 9.033 1.00 54.12 H new ATOM 0 HG11 VAL M 35 16.479 -6.940 7.855 1.00 32.12 H new ATOM 0 HG12 VAL M 35 17.257 -6.675 9.434 1.00 32.12 H new ATOM 0 HG13 VAL M 35 18.214 -6.552 7.938 1.00 32.12 H new ATOM 0 HG21 VAL M 35 16.930 -9.002 6.571 1.00 13.33 H new ATOM 0 HG22 VAL M 35 18.683 -8.699 6.602 1.00 13.33 H new ATOM 0 HG23 VAL M 35 18.035 -10.239 7.215 1.00 13.33 H new ATOM 2745 N TRP M 36 18.206 -9.109 11.586 1.00 51.32 N ATOM 2746 CA TRP M 36 17.948 -8.743 12.974 1.00 34.30 C ATOM 2747 C TRP M 36 19.245 -8.402 13.698 1.00 45.25 C ATOM 2748 O TRP M 36 19.294 -7.468 14.497 1.00 53.51 O ATOM 2749 CB TRP M 36 17.230 -9.884 13.698 1.00 5.11 C ATOM 2750 CG TRP M 36 15.799 -10.045 13.282 1.00 5.34 C ATOM 2751 CD1 TRP M 36 15.241 -9.652 12.100 1.00 74.33 C ATOM 2752 CD2 TRP M 36 14.746 -10.639 14.049 1.00 41.03 C ATOM 2753 NE1 TRP M 36 13.903 -9.967 12.085 1.00 41.14 N ATOM 2754 CE2 TRP M 36 13.575 -10.574 13.268 1.00 3.21 C ATOM 2755 CE3 TRP M 36 14.678 -11.222 15.317 1.00 43.31 C ATOM 2756 CZ2 TRP M 36 12.354 -11.068 13.717 1.00 75.23 C ATOM 2757 CZ3 TRP M 36 13.465 -11.712 15.761 1.00 51.32 C ATOM 2758 CH2 TRP M 36 12.316 -11.633 14.962 1.00 20.44 C ATOM 0 H TRP M 36 17.889 -10.044 11.330 1.00 51.32 H new ATOM 0 HA TRP M 36 17.309 -7.860 12.978 1.00 34.30 H new ATOM 0 HB2 TRP M 36 17.763 -10.816 13.510 1.00 5.11 H new ATOM 0 HB3 TRP M 36 17.271 -9.705 14.772 1.00 5.11 H new ATOM 0 HD1 TRP M 36 15.772 -9.165 11.295 1.00 74.33 H new ATOM 0 HE1 TRP M 36 13.259 -9.779 11.317 1.00 41.14 H new ATOM 0 HE3 TRP M 36 15.558 -11.288 15.939 1.00 43.31 H new ATOM 0 HZ2 TRP M 36 11.467 -11.007 13.104 1.00 75.23 H new ATOM 0 HZ3 TRP M 36 13.401 -12.163 16.740 1.00 51.32 H new ATOM 0 HH2 TRP M 36 11.382 -12.026 15.337 1.00 20.44 H new ATOM 2769 N ALA M 37 20.296 -9.164 13.412 1.00 73.53 N ATOM 2770 CA ALA M 37 21.595 -8.940 14.034 1.00 74.30 C ATOM 2771 C ALA M 37 22.166 -7.583 13.638 1.00 61.10 C ATOM 2772 O ALA M 37 23.063 -7.060 14.299 1.00 64.13 O ATOM 2773 CB ALA M 37 22.561 -10.053 13.655 1.00 54.13 C ATOM 0 H ALA M 37 20.273 -9.942 12.753 1.00 73.53 H new ATOM 0 HA ALA M 37 21.458 -8.946 15.115 1.00 74.30 H new ATOM 0 HB1 ALA M 37 23.527 -9.873 14.127 1.00 54.13 H new ATOM 0 HB2 ALA M 37 22.165 -11.010 13.994 1.00 54.13 H new ATOM 0 HB3 ALA M 37 22.684 -10.075 12.572 1.00 54.13 H new ATOM 2779 N SER M 38 21.641 -7.018 12.555 1.00 21.14 N ATOM 2780 CA SER M 38 22.103 -5.723 12.069 1.00 73.42 C ATOM 2781 C SER M 38 21.613 -4.597 12.973 1.00 15.23 C ATOM 2782 O SER M 38 22.143 -3.486 12.943 1.00 74.15 O ATOM 2783 CB SER M 38 21.617 -5.491 10.637 1.00 45.54 C ATOM 2784 OG SER M 38 21.480 -6.716 9.939 1.00 31.42 O ATOM 0 H SER M 38 20.896 -7.436 11.998 1.00 21.14 H new ATOM 0 HA SER M 38 23.193 -5.725 12.080 1.00 73.42 H new ATOM 0 HB2 SER M 38 20.660 -4.970 10.655 1.00 45.54 H new ATOM 0 HB3 SER M 38 22.321 -4.846 10.111 1.00 45.54 H new ATOM 0 HG SER M 38 21.681 -6.576 8.990 1.00 31.42 H new ATOM 2790 N ARG M 39 20.597 -4.892 13.778 1.00 71.10 N ATOM 2791 CA ARG M 39 20.033 -3.905 14.691 1.00 43.22 C ATOM 2792 C ARG M 39 21.071 -3.459 15.717 1.00 52.51 C ATOM 2793 O ARG M 39 20.986 -2.358 16.260 1.00 12.15 O ATOM 2794 CB ARG M 39 18.809 -4.480 15.405 1.00 54.41 C ATOM 2795 CG ARG M 39 17.644 -4.776 14.474 1.00 1.30 C ATOM 2796 CD ARG M 39 16.916 -3.503 14.071 1.00 34.20 C ATOM 2797 NE ARG M 39 16.440 -2.754 15.231 1.00 3.10 N ATOM 2798 CZ ARG M 39 15.770 -1.610 15.143 1.00 62.30 C ATOM 2799 NH1 ARG M 39 15.497 -1.088 13.955 1.00 5.44 N ATOM 2800 NH2 ARG M 39 15.371 -0.987 16.244 1.00 30.45 N ATOM 0 H ARG M 39 20.148 -5.807 13.816 1.00 71.10 H new ATOM 0 HA ARG M 39 19.729 -3.037 14.106 1.00 43.22 H new ATOM 0 HB2 ARG M 39 19.096 -5.398 15.918 1.00 54.41 H new ATOM 0 HB3 ARG M 39 18.482 -3.777 16.171 1.00 54.41 H new ATOM 0 HG2 ARG M 39 18.010 -5.285 13.582 1.00 1.30 H new ATOM 0 HG3 ARG M 39 16.947 -5.455 14.966 1.00 1.30 H new ATOM 0 HD2 ARG M 39 17.584 -2.874 13.483 1.00 34.20 H new ATOM 0 HD3 ARG M 39 16.071 -3.756 13.431 1.00 34.20 H new ATOM 0 HE ARG M 39 16.632 -3.130 16.160 1.00 3.10 H new ATOM 0 HH11 ARG M 39 15.801 -1.565 13.106 1.00 5.44 H new ATOM 0 HH12 ARG M 39 14.982 -0.210 13.890 1.00 5.44 H new ATOM 0 HH21 ARG M 39 15.578 -1.386 17.159 1.00 30.45 H new ATOM 0 HH22 ARG M 39 14.857 -0.109 16.175 1.00 30.45 H new ATOM 2814 N GLU M 40 22.048 -4.321 15.976 1.00 24.22 N ATOM 2815 CA GLU M 40 23.101 -4.016 16.938 1.00 11.51 C ATOM 2816 C GLU M 40 24.127 -3.059 16.337 1.00 73.35 C ATOM 2817 O GLU M 40 24.500 -2.061 16.955 1.00 73.40 O ATOM 2818 CB GLU M 40 23.793 -5.301 17.396 1.00 31.01 C ATOM 2819 CG GLU M 40 23.149 -5.937 18.617 1.00 45.11 C ATOM 2820 CD GLU M 40 21.976 -6.829 18.260 1.00 24.10 C ATOM 2821 OE1 GLU M 40 22.044 -7.506 17.213 1.00 61.51 O ATOM 2822 OE2 GLU M 40 20.991 -6.850 19.027 1.00 42.11 O ATOM 0 H GLU M 40 22.133 -5.236 15.534 1.00 24.22 H new ATOM 0 HA GLU M 40 22.641 -3.533 17.800 1.00 11.51 H new ATOM 0 HB2 GLU M 40 23.786 -6.019 16.576 1.00 31.01 H new ATOM 0 HB3 GLU M 40 24.837 -5.082 17.619 1.00 31.01 H new ATOM 0 HG2 GLU M 40 23.896 -6.522 19.153 1.00 45.11 H new ATOM 0 HG3 GLU M 40 22.811 -5.153 19.295 1.00 45.11 H new ATOM 2829 N LEU M 41 24.579 -3.371 15.127 1.00 24.23 N ATOM 2830 CA LEU M 41 25.563 -2.541 14.441 1.00 51.23 C ATOM 2831 C LEU M 41 25.084 -1.096 14.345 1.00 11.24 C ATOM 2832 O LEU M 41 23.935 -0.835 13.990 1.00 60.40 O ATOM 2833 CB LEU M 41 25.837 -3.093 13.041 1.00 41.43 C ATOM 2834 CG LEU M 41 26.854 -4.232 12.955 1.00 13.34 C ATOM 2835 CD1 LEU M 41 26.991 -4.719 11.521 1.00 14.32 C ATOM 2836 CD2 LEU M 41 28.203 -3.785 13.500 1.00 55.42 C ATOM 0 H LEU M 41 24.280 -4.192 14.601 1.00 24.23 H new ATOM 0 HA LEU M 41 26.486 -2.561 15.020 1.00 51.23 H new ATOM 0 HB2 LEU M 41 24.894 -3.442 12.619 1.00 41.43 H new ATOM 0 HB3 LEU M 41 26.185 -2.274 12.411 1.00 41.43 H new ATOM 0 HG LEU M 41 26.495 -5.061 13.565 1.00 13.34 H new ATOM 0 HD11 LEU M 41 27.719 -5.529 11.480 1.00 14.32 H new ATOM 0 HD12 LEU M 41 26.026 -5.080 11.165 1.00 14.32 H new ATOM 0 HD13 LEU M 41 27.327 -3.897 10.888 1.00 14.32 H new ATOM 0 HD21 LEU M 41 28.914 -4.608 13.431 1.00 55.42 H new ATOM 0 HD22 LEU M 41 28.569 -2.940 12.917 1.00 55.42 H new ATOM 0 HD23 LEU M 41 28.093 -3.487 14.543 1.00 55.42 H new