USER MOD reduce.3.24.130724 H: found=0, std=0, add=882, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 884 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 59 HIS : no HE2:sc= -4.79! C(o=-4.8!,f=-12!) USER MOD Set 1.2: A 118 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 53 THR OG1 : rot 128:sc= 0.961 USER MOD Set 2.2: A 86 TYR OH : rot 180:sc= 0 USER MOD Set 3.1: A 29 SER OG : rot 39:sc= -0.224 USER MOD Set 3.2: A 31 TYR OH : rot 180:sc= 0 USER MOD Set 4.1: A 15 LYS NZ :NH3+ 137:sc= -0.723 (180deg=0) USER MOD Set 4.2: A 18 MET CE :methyl 177:sc= -0.693 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 ASN : amide:sc= -3.13! C(o=-3.1!,f=-9.8!) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 LYS NZ :NH3+ -156:sc= 0.00272 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ -110:sc= 0.0847 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 MET CE :methyl 169:sc= -0.179 (180deg=-0.351) USER MOD Single : A 48 SER OG : rot 54:sc= 0.238 USER MOD Single : A 51 THR OG1 : rot 105:sc= -5.52! USER MOD Single : A 52 THR OG1 : rot -79:sc= -2! USER MOD Single : A 55 SER OG : rot 99:sc= 0.883 USER MOD Single : A 60 THR OG1 : rot 120:sc= -0.201 USER MOD Single : A 63 SER OG : rot 39:sc= 0.842 USER MOD Single : A 75 GLN : amide:sc= -0.691 X(o=-0.69,f=-0.47) USER MOD Single : A 77 LYS NZ :NH3+ -135:sc= -0.925 (180deg=-1.67) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 88 ASN : amide:sc= -0.305 K(o=-0.3,f=-3.5!) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot 180:sc= -0.535 USER MOD Single : A 91 TYR OH : rot -140:sc= -1.01 USER MOD Single : A 92 THR OG1 : rot -70:sc= -5.36! USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 96 GLN : amide:sc= -0.0276 X(o=-0.028,f=-0.029) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 THR OG1 : rot 169:sc= 0.667 USER MOD Single : A 102 HIS : no HD1:sc= -0.601 K(o=-0.6,f=-6!) USER MOD Single : A 107 THR OG1 : rot -170:sc= -0.877 USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 THR OG1 : rot -53:sc= 0.683 USER MOD Single : A 121 THR OG1 : rot 36:sc= -0.517! USER MOD Single : A 135 TYR OH : rot 30:sc= -3.74! USER MOD Single : A 140 LYS NZ :NH3+ -166:sc= 0.876 (180deg=0.56) USER MOD Single : A 142 THR OG1 : rot 180:sc= -0.113 USER MOD Single : A 144 SER OG : rot 180:sc= 0 USER MOD Single : A 145 TYR OH : rot 180:sc= 0 USER MOD Single : A 146 SER OG : rot 20:sc= 0.0548! USER MOD Single : A 147 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 140 N LYS A 11 28.094 -9.736 8.401 1.00 0.00 N ATOM 141 CA LYS A 11 28.714 -8.417 8.409 1.00 0.00 C ATOM 142 C LYS A 11 27.697 -7.348 8.800 1.00 0.00 C ATOM 143 O LYS A 11 26.592 -7.302 8.261 1.00 0.00 O ATOM 144 CB LYS A 11 29.284 -8.101 7.022 1.00 0.00 C ATOM 145 CG LYS A 11 30.378 -7.039 7.147 1.00 0.00 C ATOM 146 CD LYS A 11 31.698 -7.704 7.547 1.00 0.00 C ATOM 147 CE LYS A 11 32.668 -6.644 8.067 1.00 0.00 C ATOM 148 NZ LYS A 11 32.939 -6.889 9.512 1.00 0.00 N ATOM 0 HA LYS A 11 29.520 -8.419 9.142 1.00 0.00 H new ATOM 0 HB2 LYS A 11 29.691 -9.006 6.570 1.00 0.00 H new ATOM 0 HB3 LYS A 11 28.491 -7.745 6.364 1.00 0.00 H new ATOM 0 HG2 LYS A 11 30.497 -6.512 6.200 1.00 0.00 H new ATOM 0 HG3 LYS A 11 30.094 -6.296 7.892 1.00 0.00 H new ATOM 0 HD2 LYS A 11 31.520 -8.457 8.315 1.00 0.00 H new ATOM 0 HD3 LYS A 11 32.132 -8.219 6.690 1.00 0.00 H new ATOM 0 HE2 LYS A 11 33.598 -6.677 7.500 1.00 0.00 H new ATOM 0 HE3 LYS A 11 32.245 -5.649 7.928 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 33.599 -6.169 9.868 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 32.048 -6.837 10.046 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 33.359 -7.833 9.631 1.00 0.00 H new ATOM 162 N GLU A 12 28.082 -6.490 9.741 1.00 0.00 N ATOM 163 CA GLU A 12 27.198 -5.422 10.201 1.00 0.00 C ATOM 164 C GLU A 12 27.008 -4.384 9.098 1.00 0.00 C ATOM 165 O GLU A 12 27.883 -4.192 8.255 1.00 0.00 O ATOM 166 CB GLU A 12 27.800 -4.751 11.437 1.00 0.00 C ATOM 167 CG GLU A 12 27.877 -5.765 12.579 1.00 0.00 C ATOM 168 CD GLU A 12 28.577 -5.141 13.781 1.00 0.00 C ATOM 169 OE1 GLU A 12 28.795 -3.942 13.758 1.00 0.00 O ATOM 170 OE2 GLU A 12 28.876 -5.872 14.712 1.00 0.00 O ATOM 0 H GLU A 12 28.994 -6.512 10.198 1.00 0.00 H new ATOM 0 HA GLU A 12 26.229 -5.851 10.455 1.00 0.00 H new ATOM 0 HB2 GLU A 12 28.795 -4.368 11.208 1.00 0.00 H new ATOM 0 HB3 GLU A 12 27.190 -3.898 11.734 1.00 0.00 H new ATOM 0 HG2 GLU A 12 26.874 -6.088 12.858 1.00 0.00 H new ATOM 0 HG3 GLU A 12 28.418 -6.653 12.253 1.00 0.00 H new ATOM 177 N GLY A 13 25.858 -3.724 9.111 1.00 0.00 N ATOM 178 CA GLY A 13 25.556 -2.712 8.108 1.00 0.00 C ATOM 179 C GLY A 13 25.012 -3.348 6.837 1.00 0.00 C ATOM 180 O GLY A 13 24.893 -2.685 5.807 1.00 0.00 O ATOM 0 H GLY A 13 25.122 -3.870 9.802 1.00 0.00 H new ATOM 0 HA2 GLY A 13 24.827 -2.006 8.506 1.00 0.00 H new ATOM 0 HA3 GLY A 13 26.457 -2.143 7.877 1.00 0.00 H new ATOM 184 N GLU A 14 24.683 -4.636 6.913 1.00 0.00 N ATOM 185 CA GLU A 14 24.158 -5.338 5.762 1.00 0.00 C ATOM 186 C GLU A 14 22.745 -5.842 6.045 1.00 0.00 C ATOM 187 O GLU A 14 22.477 -6.401 7.109 1.00 0.00 O ATOM 188 CB GLU A 14 25.059 -6.523 5.427 1.00 0.00 C ATOM 189 CG GLU A 14 26.459 -6.018 5.075 1.00 0.00 C ATOM 190 CD GLU A 14 26.399 -5.125 3.839 1.00 0.00 C ATOM 191 OE1 GLU A 14 25.810 -5.543 2.857 1.00 0.00 O ATOM 192 OE2 GLU A 14 26.942 -4.034 3.895 1.00 0.00 O ATOM 0 H GLU A 14 24.773 -5.204 7.756 1.00 0.00 H new ATOM 0 HA GLU A 14 24.127 -4.649 4.918 1.00 0.00 H new ATOM 0 HB2 GLU A 14 25.110 -7.206 6.275 1.00 0.00 H new ATOM 0 HB3 GLU A 14 24.643 -7.085 4.591 1.00 0.00 H new ATOM 0 HG2 GLU A 14 26.875 -5.462 5.915 1.00 0.00 H new ATOM 0 HG3 GLU A 14 27.123 -6.863 4.891 1.00 0.00 H new ATOM 199 N LYS A 15 21.852 -5.646 5.086 1.00 0.00 N ATOM 200 CA LYS A 15 20.471 -6.088 5.242 1.00 0.00 C ATOM 201 C LYS A 15 20.423 -7.592 5.475 1.00 0.00 C ATOM 202 O LYS A 15 20.846 -8.378 4.629 1.00 0.00 O ATOM 203 CB LYS A 15 19.660 -5.728 3.995 1.00 0.00 C ATOM 204 CG LYS A 15 18.186 -6.066 4.228 1.00 0.00 C ATOM 205 CD LYS A 15 17.359 -5.550 3.054 1.00 0.00 C ATOM 206 CE LYS A 15 15.879 -5.860 3.294 1.00 0.00 C ATOM 207 NZ LYS A 15 15.064 -5.317 2.168 1.00 0.00 N ATOM 0 H LYS A 15 22.055 -5.188 4.198 1.00 0.00 H new ATOM 0 HA LYS A 15 20.038 -5.583 6.106 1.00 0.00 H new ATOM 0 HB2 LYS A 15 19.770 -4.667 3.771 1.00 0.00 H new ATOM 0 HB3 LYS A 15 20.038 -6.276 3.132 1.00 0.00 H new ATOM 0 HG2 LYS A 15 18.060 -7.144 4.331 1.00 0.00 H new ATOM 0 HG3 LYS A 15 17.840 -5.615 5.158 1.00 0.00 H new ATOM 0 HD2 LYS A 15 17.502 -4.476 2.939 1.00 0.00 H new ATOM 0 HD3 LYS A 15 17.693 -6.017 2.127 1.00 0.00 H new ATOM 0 HE2 LYS A 15 15.731 -6.937 3.377 1.00 0.00 H new ATOM 0 HE3 LYS A 15 15.553 -5.420 4.237 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 14.346 -6.016 1.890 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 14.594 -4.440 2.471 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 15.683 -5.116 1.357 1.00 0.00 H new ATOM 221 N VAL A 16 19.908 -7.983 6.635 1.00 0.00 N ATOM 222 CA VAL A 16 19.816 -9.396 6.977 1.00 0.00 C ATOM 223 C VAL A 16 18.362 -9.825 7.156 1.00 0.00 C ATOM 224 O VAL A 16 17.991 -10.952 6.827 1.00 0.00 O ATOM 225 CB VAL A 16 20.585 -9.664 8.270 1.00 0.00 C ATOM 226 CG1 VAL A 16 22.080 -9.494 8.017 1.00 0.00 C ATOM 227 CG2 VAL A 16 20.127 -8.679 9.349 1.00 0.00 C ATOM 0 H VAL A 16 19.551 -7.347 7.348 1.00 0.00 H new ATOM 0 HA VAL A 16 20.249 -9.972 6.159 1.00 0.00 H new ATOM 0 HB VAL A 16 20.391 -10.682 8.606 1.00 0.00 H new ATOM 0 HG11 VAL A 16 22.629 -9.685 8.939 1.00 0.00 H new ATOM 0 HG12 VAL A 16 22.402 -10.199 7.250 1.00 0.00 H new ATOM 0 HG13 VAL A 16 22.279 -8.476 7.681 1.00 0.00 H new ATOM 0 HG21 VAL A 16 20.675 -8.869 10.272 1.00 0.00 H new ATOM 0 HG22 VAL A 16 20.320 -7.659 9.016 1.00 0.00 H new ATOM 0 HG23 VAL A 16 19.059 -8.806 9.528 1.00 0.00 H new ATOM 237 N ALA A 17 17.544 -8.923 7.687 1.00 0.00 N ATOM 238 CA ALA A 17 16.136 -9.221 7.914 1.00 0.00 C ATOM 239 C ALA A 17 15.265 -8.025 7.549 1.00 0.00 C ATOM 240 O ALA A 17 15.753 -6.903 7.421 1.00 0.00 O ATOM 241 CB ALA A 17 15.911 -9.586 9.382 1.00 0.00 C ATOM 0 H ALA A 17 17.830 -7.985 7.967 1.00 0.00 H new ATOM 0 HA ALA A 17 15.858 -10.063 7.281 1.00 0.00 H new ATOM 0 HB1 ALA A 17 14.856 -9.808 9.544 1.00 0.00 H new ATOM 0 HB2 ALA A 17 16.509 -10.462 9.635 1.00 0.00 H new ATOM 0 HB3 ALA A 17 16.208 -8.749 10.015 1.00 0.00 H new ATOM 247 N MET A 18 13.971 -8.273 7.381 1.00 0.00 N ATOM 248 CA MET A 18 13.043 -7.203 7.032 1.00 0.00 C ATOM 249 C MET A 18 11.939 -7.091 8.077 1.00 0.00 C ATOM 250 O MET A 18 11.467 -8.097 8.604 1.00 0.00 O ATOM 251 CB MET A 18 12.420 -7.474 5.660 1.00 0.00 C ATOM 252 CG MET A 18 11.533 -6.296 5.252 1.00 0.00 C ATOM 253 SD MET A 18 12.562 -4.969 4.581 1.00 0.00 S ATOM 254 CE MET A 18 12.082 -5.165 2.847 1.00 0.00 C ATOM 0 H MET A 18 13.544 -9.194 7.479 1.00 0.00 H new ATOM 0 HA MET A 18 13.598 -6.265 7.000 1.00 0.00 H new ATOM 0 HB2 MET A 18 13.204 -7.625 4.918 1.00 0.00 H new ATOM 0 HB3 MET A 18 11.831 -8.391 5.692 1.00 0.00 H new ATOM 0 HG2 MET A 18 10.804 -6.617 4.508 1.00 0.00 H new ATOM 0 HG3 MET A 18 10.971 -5.935 6.113 1.00 0.00 H new ATOM 0 HE1 MET A 18 12.568 -4.397 2.246 1.00 0.00 H new ATOM 0 HE2 MET A 18 12.388 -6.150 2.494 1.00 0.00 H new ATOM 0 HE3 MET A 18 11.000 -5.067 2.756 1.00 0.00 H new ATOM 264 N LEU A 19 11.530 -5.862 8.370 1.00 0.00 N ATOM 265 CA LEU A 19 10.479 -5.636 9.351 1.00 0.00 C ATOM 266 C LEU A 19 9.182 -5.239 8.653 1.00 0.00 C ATOM 267 O LEU A 19 9.144 -4.263 7.906 1.00 0.00 O ATOM 268 CB LEU A 19 10.902 -4.525 10.318 1.00 0.00 C ATOM 269 CG LEU A 19 9.689 -4.054 11.130 1.00 0.00 C ATOM 270 CD1 LEU A 19 9.165 -5.208 11.981 1.00 0.00 C ATOM 271 CD2 LEU A 19 10.098 -2.894 12.043 1.00 0.00 C ATOM 0 H LEU A 19 11.907 -5.014 7.946 1.00 0.00 H new ATOM 0 HA LEU A 19 10.315 -6.559 9.908 1.00 0.00 H new ATOM 0 HB2 LEU A 19 11.680 -4.890 10.988 1.00 0.00 H new ATOM 0 HB3 LEU A 19 11.326 -3.689 9.762 1.00 0.00 H new ATOM 0 HG LEU A 19 8.908 -3.720 10.448 1.00 0.00 H new ATOM 0 HD11 LEU A 19 8.303 -4.873 12.558 1.00 0.00 H new ATOM 0 HD12 LEU A 19 8.869 -6.033 11.333 1.00 0.00 H new ATOM 0 HD13 LEU A 19 9.948 -5.544 12.661 1.00 0.00 H new ATOM 0 HD21 LEU A 19 9.234 -2.562 12.618 1.00 0.00 H new ATOM 0 HD22 LEU A 19 10.882 -3.226 12.724 1.00 0.00 H new ATOM 0 HD23 LEU A 19 10.470 -2.068 11.437 1.00 0.00 H new ATOM 283 N ASN A 20 8.125 -6.000 8.906 1.00 0.00 N ATOM 284 CA ASN A 20 6.824 -5.719 8.300 1.00 0.00 C ATOM 285 C ASN A 20 5.769 -5.463 9.367 1.00 0.00 C ATOM 286 O ASN A 20 5.594 -6.256 10.294 1.00 0.00 O ATOM 287 CB ASN A 20 6.395 -6.894 7.426 1.00 0.00 C ATOM 288 CG ASN A 20 5.231 -6.486 6.531 1.00 0.00 C ATOM 289 OD1 ASN A 20 4.442 -5.615 6.895 1.00 0.00 O ATOM 290 ND2 ASN A 20 5.077 -7.064 5.370 1.00 0.00 N ATOM 0 H ASN A 20 8.139 -6.813 9.522 1.00 0.00 H new ATOM 0 HA ASN A 20 6.920 -4.823 7.687 1.00 0.00 H new ATOM 0 HB2 ASN A 20 7.234 -7.228 6.815 1.00 0.00 H new ATOM 0 HB3 ASN A 20 6.103 -7.736 8.054 1.00 0.00 H new ATOM 0 HD21 ASN A 20 4.302 -6.793 4.764 1.00 0.00 H new ATOM 0 HD22 ASN A 20 5.732 -7.786 5.069 1.00 0.00 H new ATOM 297 N ILE A 21 5.064 -4.345 9.230 1.00 0.00 N ATOM 298 CA ILE A 21 4.023 -3.994 10.190 1.00 0.00 C ATOM 299 C ILE A 21 2.641 -4.218 9.576 1.00 0.00 C ATOM 300 O ILE A 21 2.288 -3.578 8.588 1.00 0.00 O ATOM 301 CB ILE A 21 4.167 -2.531 10.621 1.00 0.00 C ATOM 302 CG1 ILE A 21 5.625 -2.252 10.983 1.00 0.00 C ATOM 303 CG2 ILE A 21 3.284 -2.282 11.842 1.00 0.00 C ATOM 304 CD1 ILE A 21 6.056 -0.923 10.369 1.00 0.00 C ATOM 0 H ILE A 21 5.192 -3.673 8.473 1.00 0.00 H new ATOM 0 HA ILE A 21 4.132 -4.633 11.066 1.00 0.00 H new ATOM 0 HB ILE A 21 3.863 -1.874 9.806 1.00 0.00 H new ATOM 0 HG12 ILE A 21 5.742 -2.219 12.066 1.00 0.00 H new ATOM 0 HG13 ILE A 21 6.262 -3.057 10.618 1.00 0.00 H new ATOM 0 HG21 ILE A 21 3.381 -1.242 12.155 1.00 0.00 H new ATOM 0 HG22 ILE A 21 2.245 -2.489 11.588 1.00 0.00 H new ATOM 0 HG23 ILE A 21 3.596 -2.937 12.656 1.00 0.00 H new ATOM 0 HD11 ILE A 21 7.096 -0.723 10.627 1.00 0.00 H new ATOM 0 HD12 ILE A 21 5.954 -0.973 9.285 1.00 0.00 H new ATOM 0 HD13 ILE A 21 5.426 -0.122 10.756 1.00 0.00 H new ATOM 316 N PRO A 22 1.868 -5.119 10.132 1.00 0.00 N ATOM 317 CA PRO A 22 0.507 -5.444 9.617 1.00 0.00 C ATOM 318 C PRO A 22 -0.536 -4.396 9.993 1.00 0.00 C ATOM 319 O PRO A 22 -1.281 -3.915 9.143 1.00 0.00 O ATOM 320 CB PRO A 22 0.189 -6.786 10.282 1.00 0.00 C ATOM 321 CG PRO A 22 0.983 -6.803 11.550 1.00 0.00 C ATOM 322 CD PRO A 22 2.204 -5.917 11.318 1.00 0.00 C ATOM 0 HA PRO A 22 0.484 -5.474 8.528 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -0.878 -6.880 10.486 1.00 0.00 H new ATOM 0 HB3 PRO A 22 0.464 -7.619 9.635 1.00 0.00 H new ATOM 0 HG2 PRO A 22 0.388 -6.430 12.384 1.00 0.00 H new ATOM 0 HG3 PRO A 22 1.285 -7.819 11.803 1.00 0.00 H new ATOM 0 HD2 PRO A 22 2.400 -5.280 12.181 1.00 0.00 H new ATOM 0 HD3 PRO A 22 3.101 -6.514 11.152 1.00 0.00 H new ATOM 330 N LYS A 23 -0.581 -4.049 11.274 1.00 0.00 N ATOM 331 CA LYS A 23 -1.542 -3.063 11.754 1.00 0.00 C ATOM 332 C LYS A 23 -1.331 -1.719 11.063 1.00 0.00 C ATOM 333 O LYS A 23 -2.292 -1.026 10.729 1.00 0.00 O ATOM 334 CB LYS A 23 -1.401 -2.897 13.269 1.00 0.00 C ATOM 335 CG LYS A 23 -2.532 -2.006 13.787 1.00 0.00 C ATOM 336 CD LYS A 23 -3.761 -2.871 14.079 1.00 0.00 C ATOM 337 CE LYS A 23 -5.024 -2.013 13.997 1.00 0.00 C ATOM 338 NZ LYS A 23 -5.530 -2.015 12.595 1.00 0.00 N ATOM 0 H LYS A 23 0.031 -4.432 11.994 1.00 0.00 H new ATOM 0 HA LYS A 23 -2.546 -3.416 11.519 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -1.436 -3.871 13.758 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -0.434 -2.454 13.510 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -2.216 -1.485 14.691 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -2.777 -1.243 13.049 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -3.819 -3.691 13.363 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -3.677 -3.318 15.070 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -5.787 -2.402 14.672 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -4.807 -0.994 14.316 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -6.389 -1.432 12.535 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -4.802 -1.625 11.963 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -5.752 -2.989 12.307 1.00 0.00 H new ATOM 352 N LEU A 24 -0.073 -1.359 10.849 1.00 0.00 N ATOM 353 CA LEU A 24 0.251 -0.096 10.194 1.00 0.00 C ATOM 354 C LEU A 24 0.594 -0.318 8.726 1.00 0.00 C ATOM 355 O LEU A 24 0.961 0.619 8.017 1.00 0.00 O ATOM 356 CB LEU A 24 1.428 0.569 10.904 1.00 0.00 C ATOM 357 CG LEU A 24 1.002 1.026 12.300 1.00 0.00 C ATOM 358 CD1 LEU A 24 -0.162 2.008 12.175 1.00 0.00 C ATOM 359 CD2 LEU A 24 0.551 -0.178 13.127 1.00 0.00 C ATOM 0 H LEU A 24 0.737 -1.919 11.117 1.00 0.00 H new ATOM 0 HA LEU A 24 -0.622 0.554 10.250 1.00 0.00 H new ATOM 0 HB2 LEU A 24 2.261 -0.130 10.979 1.00 0.00 H new ATOM 0 HB3 LEU A 24 1.779 1.422 10.324 1.00 0.00 H new ATOM 0 HG LEU A 24 1.847 1.508 12.792 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -0.469 2.337 13.168 1.00 0.00 H new ATOM 0 HD12 LEU A 24 0.152 2.871 11.588 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -1.000 1.518 11.680 1.00 0.00 H new ATOM 0 HD21 LEU A 24 0.249 0.155 14.120 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -0.292 -0.662 12.635 1.00 0.00 H new ATOM 0 HD23 LEU A 24 1.374 -0.887 13.217 1.00 0.00 H new ATOM 371 N LYS A 25 0.466 -1.558 8.276 1.00 0.00 N ATOM 372 CA LYS A 25 0.758 -1.886 6.887 1.00 0.00 C ATOM 373 C LYS A 25 2.040 -1.194 6.429 1.00 0.00 C ATOM 374 O LYS A 25 2.129 -0.717 5.298 1.00 0.00 O ATOM 375 CB LYS A 25 -0.409 -1.446 6.002 1.00 0.00 C ATOM 376 CG LYS A 25 -1.569 -2.437 6.142 1.00 0.00 C ATOM 377 CD LYS A 25 -2.517 -1.953 7.239 1.00 0.00 C ATOM 378 CE LYS A 25 -3.606 -3.002 7.469 1.00 0.00 C ATOM 379 NZ LYS A 25 -4.460 -2.586 8.617 1.00 0.00 N ATOM 0 H LYS A 25 0.165 -2.348 8.846 1.00 0.00 H new ATOM 0 HA LYS A 25 0.896 -2.964 6.803 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -0.736 -0.446 6.287 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -0.088 -1.392 4.962 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -2.104 -2.525 5.196 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -1.188 -3.429 6.386 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -1.964 -1.779 8.162 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -2.967 -1.002 6.953 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -4.214 -3.114 6.571 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -3.154 -3.973 7.671 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -4.913 -3.424 9.034 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -3.872 -2.117 9.335 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -5.192 -1.927 8.284 1.00 0.00 H new ATOM 393 N LYS A 26 3.029 -1.146 7.313 1.00 0.00 N ATOM 394 CA LYS A 26 4.303 -0.510 6.992 1.00 0.00 C ATOM 395 C LYS A 26 5.427 -1.539 6.995 1.00 0.00 C ATOM 396 O LYS A 26 5.366 -2.533 7.711 1.00 0.00 O ATOM 397 CB LYS A 26 4.604 0.593 8.005 1.00 0.00 C ATOM 398 CG LYS A 26 3.913 1.884 7.565 1.00 0.00 C ATOM 399 CD LYS A 26 4.841 2.652 6.626 1.00 0.00 C ATOM 400 CE LYS A 26 5.599 3.712 7.420 1.00 0.00 C ATOM 401 NZ LYS A 26 6.639 4.341 6.554 1.00 0.00 N ATOM 0 H LYS A 26 2.975 -1.537 8.253 1.00 0.00 H new ATOM 0 HA LYS A 26 4.233 -0.072 5.996 1.00 0.00 H new ATOM 0 HB2 LYS A 26 4.255 0.299 8.995 1.00 0.00 H new ATOM 0 HB3 LYS A 26 5.680 0.750 8.080 1.00 0.00 H new ATOM 0 HG2 LYS A 26 2.974 1.655 7.061 1.00 0.00 H new ATOM 0 HG3 LYS A 26 3.668 2.495 8.434 1.00 0.00 H new ATOM 0 HD2 LYS A 26 5.543 1.967 6.150 1.00 0.00 H new ATOM 0 HD3 LYS A 26 4.264 3.122 5.830 1.00 0.00 H new ATOM 0 HE2 LYS A 26 4.907 4.472 7.784 1.00 0.00 H new ATOM 0 HE3 LYS A 26 6.066 3.260 8.295 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 7.583 4.047 6.876 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 6.500 4.038 5.569 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 6.560 5.376 6.613 1.00 0.00 H new ATOM 415 N LYS A 27 6.450 -1.299 6.187 1.00 0.00 N ATOM 416 CA LYS A 27 7.573 -2.221 6.112 1.00 0.00 C ATOM 417 C LYS A 27 8.900 -1.471 6.214 1.00 0.00 C ATOM 418 O LYS A 27 9.012 -0.327 5.772 1.00 0.00 O ATOM 419 CB LYS A 27 7.525 -2.993 4.798 1.00 0.00 C ATOM 420 CG LYS A 27 6.250 -3.833 4.742 1.00 0.00 C ATOM 421 CD LYS A 27 6.277 -4.722 3.496 1.00 0.00 C ATOM 422 CE LYS A 27 6.269 -3.845 2.246 1.00 0.00 C ATOM 423 NZ LYS A 27 5.887 -4.668 1.062 1.00 0.00 N ATOM 0 H LYS A 27 6.525 -0.483 5.580 1.00 0.00 H new ATOM 0 HA LYS A 27 7.500 -2.916 6.948 1.00 0.00 H new ATOM 0 HB2 LYS A 27 7.553 -2.301 3.957 1.00 0.00 H new ATOM 0 HB3 LYS A 27 8.400 -3.637 4.711 1.00 0.00 H new ATOM 0 HG2 LYS A 27 6.167 -4.448 5.638 1.00 0.00 H new ATOM 0 HG3 LYS A 27 5.375 -3.184 4.719 1.00 0.00 H new ATOM 0 HD2 LYS A 27 7.166 -5.353 3.505 1.00 0.00 H new ATOM 0 HD3 LYS A 27 5.414 -5.388 3.492 1.00 0.00 H new ATOM 0 HE2 LYS A 27 5.566 -3.021 2.371 1.00 0.00 H new ATOM 0 HE3 LYS A 27 7.254 -3.403 2.093 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 5.882 -4.070 0.211 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 6.574 -5.439 0.939 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 4.939 -5.069 1.209 1.00 0.00 H new ATOM 437 N PHE A 28 9.900 -2.120 6.802 1.00 0.00 N ATOM 438 CA PHE A 28 11.215 -1.507 6.960 1.00 0.00 C ATOM 439 C PHE A 28 12.318 -2.536 6.745 1.00 0.00 C ATOM 440 O PHE A 28 12.075 -3.742 6.794 1.00 0.00 O ATOM 441 CB PHE A 28 11.351 -0.890 8.353 1.00 0.00 C ATOM 442 CG PHE A 28 10.467 0.329 8.450 1.00 0.00 C ATOM 443 CD1 PHE A 28 10.936 1.569 7.999 1.00 0.00 C ATOM 444 CD2 PHE A 28 9.182 0.221 8.992 1.00 0.00 C ATOM 445 CE1 PHE A 28 10.118 2.702 8.092 1.00 0.00 C ATOM 446 CE2 PHE A 28 8.364 1.353 9.084 1.00 0.00 C ATOM 447 CZ PHE A 28 8.833 2.594 8.634 1.00 0.00 C ATOM 0 H PHE A 28 9.826 -3.066 7.176 1.00 0.00 H new ATOM 0 HA PHE A 28 11.315 -0.722 6.210 1.00 0.00 H new ATOM 0 HB2 PHE A 28 11.070 -1.618 9.114 1.00 0.00 H new ATOM 0 HB3 PHE A 28 12.389 -0.616 8.542 1.00 0.00 H new ATOM 0 HD1 PHE A 28 11.928 1.652 7.580 1.00 0.00 H new ATOM 0 HD2 PHE A 28 8.821 -0.736 9.339 1.00 0.00 H new ATOM 0 HE1 PHE A 28 10.479 3.659 7.745 1.00 0.00 H new ATOM 0 HE2 PHE A 28 7.372 1.270 9.502 1.00 0.00 H new ATOM 0 HZ PHE A 28 8.202 3.468 8.706 1.00 0.00 H new ATOM 457 N SER A 29 13.533 -2.054 6.504 1.00 0.00 N ATOM 458 CA SER A 29 14.666 -2.945 6.280 1.00 0.00 C ATOM 459 C SER A 29 15.558 -3.013 7.515 1.00 0.00 C ATOM 460 O SER A 29 16.066 -1.993 7.982 1.00 0.00 O ATOM 461 CB SER A 29 15.482 -2.451 5.085 1.00 0.00 C ATOM 462 OG SER A 29 15.672 -1.047 5.198 1.00 0.00 O ATOM 0 H SER A 29 13.758 -1.060 6.459 1.00 0.00 H new ATOM 0 HA SER A 29 14.282 -3.944 6.076 1.00 0.00 H new ATOM 0 HB2 SER A 29 16.446 -2.959 5.052 1.00 0.00 H new ATOM 0 HB3 SER A 29 14.966 -2.687 4.154 1.00 0.00 H new ATOM 0 HG SER A 29 15.837 -0.814 6.135 1.00 0.00 H new ATOM 468 N ILE A 30 15.747 -4.221 8.037 1.00 0.00 N ATOM 469 CA ILE A 30 16.583 -4.409 9.217 1.00 0.00 C ATOM 470 C ILE A 30 18.001 -4.792 8.805 1.00 0.00 C ATOM 471 O ILE A 30 18.209 -5.768 8.082 1.00 0.00 O ATOM 472 CB ILE A 30 15.997 -5.508 10.102 1.00 0.00 C ATOM 473 CG1 ILE A 30 14.516 -5.216 10.356 1.00 0.00 C ATOM 474 CG2 ILE A 30 16.745 -5.541 11.436 1.00 0.00 C ATOM 475 CD1 ILE A 30 14.370 -3.839 11.003 1.00 0.00 C ATOM 0 H ILE A 30 15.336 -5.077 7.665 1.00 0.00 H new ATOM 0 HA ILE A 30 16.613 -3.472 9.774 1.00 0.00 H new ATOM 0 HB ILE A 30 16.100 -6.472 9.604 1.00 0.00 H new ATOM 0 HG12 ILE A 30 13.962 -5.249 9.418 1.00 0.00 H new ATOM 0 HG13 ILE A 30 14.090 -5.981 11.005 1.00 0.00 H new ATOM 0 HG21 ILE A 30 16.327 -6.325 12.068 1.00 0.00 H new ATOM 0 HG22 ILE A 30 17.801 -5.744 11.256 1.00 0.00 H new ATOM 0 HG23 ILE A 30 16.640 -4.578 11.936 1.00 0.00 H new ATOM 0 HD11 ILE A 30 13.315 -3.632 11.184 1.00 0.00 H new ATOM 0 HD12 ILE A 30 14.910 -3.823 11.950 1.00 0.00 H new ATOM 0 HD13 ILE A 30 14.780 -3.079 10.338 1.00 0.00 H new ATOM 487 N TYR A 31 18.975 -4.019 9.272 1.00 0.00 N ATOM 488 CA TYR A 31 20.373 -4.284 8.944 1.00 0.00 C ATOM 489 C TYR A 31 21.122 -4.826 10.156 1.00 0.00 C ATOM 490 O TYR A 31 20.879 -4.398 11.285 1.00 0.00 O ATOM 491 CB TYR A 31 21.050 -2.996 8.473 1.00 0.00 C ATOM 492 CG TYR A 31 20.470 -2.579 7.146 1.00 0.00 C ATOM 493 CD1 TYR A 31 19.250 -1.897 7.099 1.00 0.00 C ATOM 494 CD2 TYR A 31 21.152 -2.875 5.961 1.00 0.00 C ATOM 495 CE1 TYR A 31 18.711 -1.511 5.868 1.00 0.00 C ATOM 496 CE2 TYR A 31 20.614 -2.489 4.728 1.00 0.00 C ATOM 497 CZ TYR A 31 19.393 -1.808 4.682 1.00 0.00 C ATOM 498 OH TYR A 31 18.860 -1.427 3.466 1.00 0.00 O ATOM 0 H TYR A 31 18.826 -3.210 9.874 1.00 0.00 H new ATOM 0 HA TYR A 31 20.399 -5.030 8.149 1.00 0.00 H new ATOM 0 HB2 TYR A 31 20.905 -2.206 9.210 1.00 0.00 H new ATOM 0 HB3 TYR A 31 22.125 -3.151 8.379 1.00 0.00 H new ATOM 0 HD1 TYR A 31 18.724 -1.668 8.014 1.00 0.00 H new ATOM 0 HD2 TYR A 31 22.094 -3.402 5.998 1.00 0.00 H new ATOM 0 HE1 TYR A 31 17.769 -0.984 5.832 1.00 0.00 H new ATOM 0 HE2 TYR A 31 21.141 -2.717 3.813 1.00 0.00 H new ATOM 0 HH TYR A 31 19.459 -1.709 2.744 1.00 0.00 H new ATOM 508 N TRP A 32 22.031 -5.769 9.918 1.00 0.00 N ATOM 509 CA TRP A 32 22.806 -6.355 11.004 1.00 0.00 C ATOM 510 C TRP A 32 23.716 -5.313 11.645 1.00 0.00 C ATOM 511 O TRP A 32 24.412 -4.573 10.952 1.00 0.00 O ATOM 512 CB TRP A 32 23.652 -7.517 10.474 1.00 0.00 C ATOM 513 CG TRP A 32 24.443 -8.119 11.591 1.00 0.00 C ATOM 514 CD1 TRP A 32 25.788 -8.243 11.612 1.00 0.00 C ATOM 515 CD2 TRP A 32 23.962 -8.682 12.846 1.00 0.00 C ATOM 516 NE1 TRP A 32 26.164 -8.841 12.800 1.00 0.00 N ATOM 517 CE2 TRP A 32 25.074 -9.132 13.594 1.00 0.00 C ATOM 518 CE3 TRP A 32 22.682 -8.845 13.401 1.00 0.00 C ATOM 519 CZ2 TRP A 32 24.920 -9.718 14.850 1.00 0.00 C ATOM 520 CZ3 TRP A 32 22.523 -9.435 14.666 1.00 0.00 C ATOM 521 CH2 TRP A 32 23.642 -9.871 15.389 1.00 0.00 C ATOM 0 H TRP A 32 22.246 -6.139 8.992 1.00 0.00 H new ATOM 0 HA TRP A 32 22.111 -6.723 11.759 1.00 0.00 H new ATOM 0 HB2 TRP A 32 23.008 -8.272 10.024 1.00 0.00 H new ATOM 0 HB3 TRP A 32 24.323 -7.163 9.691 1.00 0.00 H new ATOM 0 HD1 TRP A 32 26.460 -7.926 10.828 1.00 0.00 H new ATOM 0 HE1 TRP A 32 27.130 -9.043 13.058 1.00 0.00 H new ATOM 0 HE3 TRP A 32 21.813 -8.514 12.851 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 25.786 -10.052 15.403 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 21.534 -9.553 15.083 1.00 0.00 H new ATOM 0 HH2 TRP A 32 23.515 -10.324 16.361 1.00 0.00 H new ATOM 532 N GLY A 33 23.709 -5.264 12.974 1.00 0.00 N ATOM 533 CA GLY A 33 24.543 -4.310 13.700 1.00 0.00 C ATOM 534 C GLY A 33 23.956 -2.913 13.645 1.00 0.00 C ATOM 535 O GLY A 33 23.158 -2.596 12.761 1.00 0.00 O ATOM 0 H GLY A 33 23.140 -5.868 13.567 1.00 0.00 H new ATOM 0 HA2 GLY A 33 24.640 -4.625 14.739 1.00 0.00 H new ATOM 0 HA3 GLY A 33 25.546 -4.302 13.274 1.00 0.00 H new ATOM 539 N ALA A 34 24.362 -2.075 14.593 1.00 0.00 N ATOM 540 CA ALA A 34 23.872 -0.710 14.633 1.00 0.00 C ATOM 541 C ALA A 34 25.036 0.276 14.564 1.00 0.00 C ATOM 542 O ALA A 34 25.440 0.844 15.579 1.00 0.00 O ATOM 543 CB ALA A 34 23.072 -0.471 15.919 1.00 0.00 C ATOM 0 H ALA A 34 25.021 -2.316 15.333 1.00 0.00 H new ATOM 0 HA ALA A 34 23.222 -0.553 13.772 1.00 0.00 H new ATOM 0 HB1 ALA A 34 22.710 0.557 15.937 1.00 0.00 H new ATOM 0 HB2 ALA A 34 22.224 -1.155 15.952 1.00 0.00 H new ATOM 0 HB3 ALA A 34 23.713 -0.645 16.784 1.00 0.00 H new ATOM 683 N GLY A 44 18.528 -0.529 12.755 1.00 0.00 N ATOM 684 CA GLY A 44 19.747 -1.323 12.862 1.00 0.00 C ATOM 685 C GLY A 44 19.608 -2.388 13.942 1.00 0.00 C ATOM 686 O GLY A 44 19.025 -2.141 14.999 1.00 0.00 O ATOM 0 HA2 GLY A 44 19.963 -1.796 11.904 1.00 0.00 H new ATOM 0 HA3 GLY A 44 20.591 -0.673 13.093 1.00 0.00 H new ATOM 690 N MET A 45 20.145 -3.574 13.671 1.00 0.00 N ATOM 691 CA MET A 45 20.069 -4.668 14.629 1.00 0.00 C ATOM 692 C MET A 45 21.292 -4.665 15.542 1.00 0.00 C ATOM 693 O MET A 45 22.418 -4.456 15.089 1.00 0.00 O ATOM 694 CB MET A 45 19.996 -6.003 13.894 1.00 0.00 C ATOM 695 CG MET A 45 19.476 -7.091 14.837 1.00 0.00 C ATOM 696 SD MET A 45 18.064 -7.925 14.072 1.00 0.00 S ATOM 697 CE MET A 45 18.965 -8.681 12.697 1.00 0.00 C ATOM 0 H MET A 45 20.633 -3.799 12.804 1.00 0.00 H new ATOM 0 HA MET A 45 19.171 -4.532 15.232 1.00 0.00 H new ATOM 0 HB2 MET A 45 19.339 -5.916 13.029 1.00 0.00 H new ATOM 0 HB3 MET A 45 20.983 -6.276 13.519 1.00 0.00 H new ATOM 0 HG2 MET A 45 20.266 -7.811 15.050 1.00 0.00 H new ATOM 0 HG3 MET A 45 19.180 -6.651 15.790 1.00 0.00 H new ATOM 0 HE1 MET A 45 18.324 -9.407 12.197 1.00 0.00 H new ATOM 0 HE2 MET A 45 19.260 -7.908 11.987 1.00 0.00 H new ATOM 0 HE3 MET A 45 19.854 -9.183 13.077 1.00 0.00 H new ATOM 707 N PHE A 46 21.065 -4.900 16.828 1.00 0.00 N ATOM 708 CA PHE A 46 22.158 -4.921 17.794 1.00 0.00 C ATOM 709 C PHE A 46 22.954 -6.218 17.689 1.00 0.00 C ATOM 710 O PHE A 46 22.392 -7.287 17.458 1.00 0.00 O ATOM 711 CB PHE A 46 21.605 -4.790 19.211 1.00 0.00 C ATOM 712 CG PHE A 46 22.629 -4.125 20.099 1.00 0.00 C ATOM 713 CD1 PHE A 46 23.740 -4.850 20.545 1.00 0.00 C ATOM 714 CD2 PHE A 46 22.468 -2.787 20.479 1.00 0.00 C ATOM 715 CE1 PHE A 46 24.690 -4.238 21.370 1.00 0.00 C ATOM 716 CE2 PHE A 46 23.418 -2.174 21.304 1.00 0.00 C ATOM 717 CZ PHE A 46 24.530 -2.900 21.749 1.00 0.00 C ATOM 0 H PHE A 46 20.142 -5.077 17.225 1.00 0.00 H new ATOM 0 HA PHE A 46 22.818 -4.082 17.573 1.00 0.00 H new ATOM 0 HB2 PHE A 46 20.685 -4.205 19.200 1.00 0.00 H new ATOM 0 HB3 PHE A 46 21.352 -5.774 19.605 1.00 0.00 H new ATOM 0 HD1 PHE A 46 23.864 -5.882 20.252 1.00 0.00 H new ATOM 0 HD2 PHE A 46 21.610 -2.228 20.135 1.00 0.00 H new ATOM 0 HE1 PHE A 46 25.547 -4.798 21.714 1.00 0.00 H new ATOM 0 HE2 PHE A 46 23.294 -1.142 21.597 1.00 0.00 H new ATOM 0 HZ PHE A 46 25.264 -2.427 22.385 1.00 0.00 H new ATOM 727 N VAL A 47 24.267 -6.115 17.868 1.00 0.00 N ATOM 728 CA VAL A 47 25.134 -7.285 17.798 1.00 0.00 C ATOM 729 C VAL A 47 26.062 -7.335 19.008 1.00 0.00 C ATOM 730 O VAL A 47 26.849 -6.416 19.236 1.00 0.00 O ATOM 731 CB VAL A 47 25.962 -7.243 16.515 1.00 0.00 C ATOM 732 CG1 VAL A 47 26.539 -5.846 16.322 1.00 0.00 C ATOM 733 CG2 VAL A 47 27.105 -8.256 16.612 1.00 0.00 C ATOM 0 H VAL A 47 24.752 -5.239 18.062 1.00 0.00 H new ATOM 0 HA VAL A 47 24.511 -8.179 17.797 1.00 0.00 H new ATOM 0 HB VAL A 47 25.324 -7.491 15.667 1.00 0.00 H new ATOM 0 HG11 VAL A 47 27.129 -5.819 15.406 1.00 0.00 H new ATOM 0 HG12 VAL A 47 25.726 -5.123 16.251 1.00 0.00 H new ATOM 0 HG13 VAL A 47 27.175 -5.595 17.171 1.00 0.00 H new ATOM 0 HG21 VAL A 47 27.696 -8.226 15.697 1.00 0.00 H new ATOM 0 HG22 VAL A 47 27.740 -8.008 17.462 1.00 0.00 H new ATOM 0 HG23 VAL A 47 26.694 -9.257 16.746 1.00 0.00 H new ATOM 743 N SER A 48 25.964 -8.411 19.778 1.00 0.00 N ATOM 744 CA SER A 48 26.799 -8.570 20.964 1.00 0.00 C ATOM 745 C SER A 48 26.653 -9.976 21.538 1.00 0.00 C ATOM 746 O SER A 48 25.839 -10.769 21.064 1.00 0.00 O ATOM 747 CB SER A 48 26.401 -7.540 22.022 1.00 0.00 C ATOM 748 OG SER A 48 27.416 -6.547 22.114 1.00 0.00 O ATOM 0 H SER A 48 25.320 -9.183 19.605 1.00 0.00 H new ATOM 0 HA SER A 48 27.839 -8.414 20.678 1.00 0.00 H new ATOM 0 HB2 SER A 48 25.449 -7.080 21.759 1.00 0.00 H new ATOM 0 HB3 SER A 48 26.264 -8.027 22.987 1.00 0.00 H new ATOM 0 HG SER A 48 27.583 -6.167 21.226 1.00 0.00 H new ATOM 754 N ASP A 49 27.445 -10.275 22.562 1.00 0.00 N ATOM 755 CA ASP A 49 27.393 -11.587 23.196 1.00 0.00 C ATOM 756 C ASP A 49 26.023 -11.824 23.822 1.00 0.00 C ATOM 757 O ASP A 49 25.490 -12.933 23.769 1.00 0.00 O ATOM 758 CB ASP A 49 28.472 -11.687 24.276 1.00 0.00 C ATOM 759 CG ASP A 49 28.377 -13.035 24.984 1.00 0.00 C ATOM 760 OD1 ASP A 49 27.648 -13.886 24.502 1.00 0.00 O ATOM 761 OD2 ASP A 49 29.033 -13.194 26.001 1.00 0.00 O ATOM 0 H ASP A 49 28.125 -9.633 22.968 1.00 0.00 H new ATOM 0 HA ASP A 49 27.569 -12.346 22.434 1.00 0.00 H new ATOM 0 HB2 ASP A 49 29.459 -11.571 23.828 1.00 0.00 H new ATOM 0 HB3 ASP A 49 28.352 -10.879 24.997 1.00 0.00 H new ATOM 766 N VAL A 50 25.458 -10.778 24.417 1.00 0.00 N ATOM 767 CA VAL A 50 24.150 -10.888 25.051 1.00 0.00 C ATOM 768 C VAL A 50 23.034 -10.686 24.029 1.00 0.00 C ATOM 769 O VAL A 50 21.907 -11.140 24.228 1.00 0.00 O ATOM 770 CB VAL A 50 24.021 -9.852 26.163 1.00 0.00 C ATOM 771 CG1 VAL A 50 25.340 -9.755 26.929 1.00 0.00 C ATOM 772 CG2 VAL A 50 23.689 -8.491 25.556 1.00 0.00 C ATOM 0 H VAL A 50 25.882 -9.852 24.473 1.00 0.00 H new ATOM 0 HA VAL A 50 24.058 -11.888 25.474 1.00 0.00 H new ATOM 0 HB VAL A 50 23.225 -10.152 26.845 1.00 0.00 H new ATOM 0 HG11 VAL A 50 25.246 -9.014 27.723 1.00 0.00 H new ATOM 0 HG12 VAL A 50 25.580 -10.725 27.364 1.00 0.00 H new ATOM 0 HG13 VAL A 50 26.136 -9.456 26.247 1.00 0.00 H new ATOM 0 HG21 VAL A 50 23.597 -7.751 26.351 1.00 0.00 H new ATOM 0 HG22 VAL A 50 24.485 -8.193 24.873 1.00 0.00 H new ATOM 0 HG23 VAL A 50 22.748 -8.556 25.010 1.00 0.00 H new ATOM 782 N THR A 51 23.355 -9.999 22.938 1.00 0.00 N ATOM 783 CA THR A 51 22.374 -9.738 21.892 1.00 0.00 C ATOM 784 C THR A 51 22.452 -10.809 20.808 1.00 0.00 C ATOM 785 O THR A 51 23.530 -11.305 20.486 1.00 0.00 O ATOM 786 CB THR A 51 22.621 -8.364 21.269 1.00 0.00 C ATOM 787 OG1 THR A 51 23.892 -8.356 20.639 1.00 0.00 O ATOM 788 CG2 THR A 51 22.585 -7.294 22.359 1.00 0.00 C ATOM 0 H THR A 51 24.282 -9.615 22.756 1.00 0.00 H new ATOM 0 HA THR A 51 21.381 -9.758 22.341 1.00 0.00 H new ATOM 0 HB THR A 51 21.846 -8.154 20.531 1.00 0.00 H new ATOM 0 HG1 THR A 51 23.776 -8.406 19.667 1.00 0.00 H new ATOM 0 HG21 THR A 51 22.761 -6.315 21.914 1.00 0.00 H new ATOM 0 HG22 THR A 51 21.609 -7.302 22.844 1.00 0.00 H new ATOM 0 HG23 THR A 51 23.359 -7.501 23.098 1.00 0.00 H new ATOM 796 N THR A 52 21.298 -11.159 20.254 1.00 0.00 N ATOM 797 CA THR A 52 21.238 -12.172 19.208 1.00 0.00 C ATOM 798 C THR A 52 20.270 -11.758 18.103 1.00 0.00 C ATOM 799 O THR A 52 19.558 -10.763 18.231 1.00 0.00 O ATOM 800 CB THR A 52 20.788 -13.507 19.794 1.00 0.00 C ATOM 801 OG1 THR A 52 19.804 -13.281 20.795 1.00 0.00 O ATOM 802 CG2 THR A 52 21.983 -14.233 20.402 1.00 0.00 C ATOM 0 H THR A 52 20.395 -10.759 20.510 1.00 0.00 H new ATOM 0 HA THR A 52 22.237 -12.275 18.783 1.00 0.00 H new ATOM 0 HB THR A 52 20.362 -14.122 19.001 1.00 0.00 H new ATOM 0 HG1 THR A 52 20.241 -13.001 21.626 1.00 0.00 H new ATOM 0 HG21 THR A 52 21.656 -15.186 20.819 1.00 0.00 H new ATOM 0 HG22 THR A 52 22.731 -14.412 19.630 1.00 0.00 H new ATOM 0 HG23 THR A 52 22.417 -13.621 21.192 1.00 0.00 H new ATOM 810 N THR A 53 20.250 -12.530 17.020 1.00 0.00 N ATOM 811 CA THR A 53 19.361 -12.235 15.901 1.00 0.00 C ATOM 812 C THR A 53 18.151 -13.162 15.922 1.00 0.00 C ATOM 813 O THR A 53 18.239 -14.301 16.379 1.00 0.00 O ATOM 814 CB THR A 53 20.111 -12.398 14.581 1.00 0.00 C ATOM 815 OG1 THR A 53 19.517 -13.444 13.823 1.00 0.00 O ATOM 816 CG2 THR A 53 21.577 -12.734 14.865 1.00 0.00 C ATOM 0 H THR A 53 20.833 -13.357 16.894 1.00 0.00 H new ATOM 0 HA THR A 53 19.017 -11.205 15.995 1.00 0.00 H new ATOM 0 HB THR A 53 20.057 -11.468 14.015 1.00 0.00 H new ATOM 0 HG1 THR A 53 19.319 -13.121 12.919 1.00 0.00 H new ATOM 0 HG21 THR A 53 22.113 -12.850 13.923 1.00 0.00 H new ATOM 0 HG22 THR A 53 22.030 -11.928 15.443 1.00 0.00 H new ATOM 0 HG23 THR A 53 21.634 -13.663 15.432 1.00 0.00 H new ATOM 824 N PRO A 54 17.030 -12.693 15.447 1.00 0.00 N ATOM 825 CA PRO A 54 15.772 -13.489 15.417 1.00 0.00 C ATOM 826 C PRO A 54 15.794 -14.582 14.354 1.00 0.00 C ATOM 827 O PRO A 54 15.273 -14.402 13.252 1.00 0.00 O ATOM 828 CB PRO A 54 14.698 -12.445 15.113 1.00 0.00 C ATOM 829 CG PRO A 54 15.402 -11.358 14.372 1.00 0.00 C ATOM 830 CD PRO A 54 16.840 -11.345 14.884 1.00 0.00 C ATOM 0 HA PRO A 54 15.605 -14.024 16.352 1.00 0.00 H new ATOM 0 HB2 PRO A 54 13.893 -12.872 14.514 1.00 0.00 H new ATOM 0 HB3 PRO A 54 14.247 -12.067 16.030 1.00 0.00 H new ATOM 0 HG2 PRO A 54 15.374 -11.540 13.298 1.00 0.00 H new ATOM 0 HG3 PRO A 54 14.920 -10.396 14.545 1.00 0.00 H new ATOM 0 HD2 PRO A 54 17.548 -11.145 14.080 1.00 0.00 H new ATOM 0 HD3 PRO A 54 16.988 -10.573 15.639 1.00 0.00 H new ATOM 838 N SER A 55 16.396 -15.716 14.696 1.00 0.00 N ATOM 839 CA SER A 55 16.478 -16.836 13.769 1.00 0.00 C ATOM 840 C SER A 55 15.957 -18.110 14.421 1.00 0.00 C ATOM 841 O SER A 55 15.911 -19.167 13.791 1.00 0.00 O ATOM 842 CB SER A 55 17.926 -17.043 13.320 1.00 0.00 C ATOM 843 OG SER A 55 17.938 -17.734 12.079 1.00 0.00 O ATOM 0 H SER A 55 16.832 -15.882 15.603 1.00 0.00 H new ATOM 0 HA SER A 55 15.861 -16.608 12.900 1.00 0.00 H new ATOM 0 HB2 SER A 55 18.429 -16.081 13.219 1.00 0.00 H new ATOM 0 HB3 SER A 55 18.474 -17.611 14.071 1.00 0.00 H new ATOM 0 HG SER A 55 18.052 -17.091 11.348 1.00 0.00 H new ATOM 849 N GLY A 56 15.566 -18.002 15.685 1.00 0.00 N ATOM 850 CA GLY A 56 15.049 -19.155 16.412 1.00 0.00 C ATOM 851 C GLY A 56 15.317 -19.020 17.908 1.00 0.00 C ATOM 852 O GLY A 56 16.044 -19.822 18.493 1.00 0.00 O ATOM 0 H GLY A 56 15.596 -17.136 16.224 1.00 0.00 H new ATOM 0 HA2 GLY A 56 13.977 -19.249 16.238 1.00 0.00 H new ATOM 0 HA3 GLY A 56 15.515 -20.066 16.036 1.00 0.00 H new ATOM 856 N GLY A 57 14.725 -18.000 18.521 1.00 0.00 N ATOM 857 CA GLY A 57 14.906 -17.770 19.951 1.00 0.00 C ATOM 858 C GLY A 57 16.206 -17.011 20.219 1.00 0.00 C ATOM 859 O GLY A 57 17.295 -17.584 20.146 1.00 0.00 O ATOM 0 H GLY A 57 14.120 -17.324 18.055 1.00 0.00 H new ATOM 0 HA2 GLY A 57 14.061 -17.203 20.342 1.00 0.00 H new ATOM 0 HA3 GLY A 57 14.921 -18.724 20.478 1.00 0.00 H new ATOM 863 N GLY A 58 16.090 -15.720 20.523 1.00 0.00 N ATOM 864 CA GLY A 58 17.258 -14.895 20.791 1.00 0.00 C ATOM 865 C GLY A 58 16.840 -13.469 21.138 1.00 0.00 C ATOM 866 O GLY A 58 15.767 -13.005 20.742 1.00 0.00 O ATOM 0 H GLY A 58 15.200 -15.227 20.589 1.00 0.00 H new ATOM 0 HA2 GLY A 58 17.831 -15.322 21.614 1.00 0.00 H new ATOM 0 HA3 GLY A 58 17.912 -14.886 19.919 1.00 0.00 H new ATOM 870 N HIS A 59 17.698 -12.777 21.876 1.00 0.00 N ATOM 871 CA HIS A 59 17.419 -11.397 22.262 1.00 0.00 C ATOM 872 C HIS A 59 17.712 -10.467 21.092 1.00 0.00 C ATOM 873 O HIS A 59 18.871 -10.172 20.800 1.00 0.00 O ATOM 874 CB HIS A 59 18.294 -10.993 23.449 1.00 0.00 C ATOM 875 CG HIS A 59 17.865 -9.644 23.958 1.00 0.00 C ATOM 876 ND1 HIS A 59 18.692 -8.848 24.738 1.00 0.00 N ATOM 877 CD2 HIS A 59 16.699 -8.937 23.806 1.00 0.00 C ATOM 878 CE1 HIS A 59 18.018 -7.718 25.024 1.00 0.00 C ATOM 879 NE2 HIS A 59 16.796 -7.721 24.479 1.00 0.00 N ATOM 0 H HIS A 59 18.586 -13.143 22.218 1.00 0.00 H new ATOM 0 HA HIS A 59 16.369 -11.320 22.544 1.00 0.00 H new ATOM 0 HB2 HIS A 59 18.212 -11.735 24.243 1.00 0.00 H new ATOM 0 HB3 HIS A 59 19.341 -10.963 23.148 1.00 0.00 H new ATOM 0 HD1 HIS A 59 19.639 -9.077 25.040 1.00 0.00 H new ATOM 0 HD2 HIS A 59 15.837 -9.272 23.249 1.00 0.00 H new ATOM 0 HE1 HIS A 59 18.415 -6.909 25.620 1.00 0.00 H new ATOM 887 N THR A 60 16.661 -10.013 20.426 1.00 0.00 N ATOM 888 CA THR A 60 16.825 -9.121 19.282 1.00 0.00 C ATOM 889 C THR A 60 16.597 -7.674 19.699 1.00 0.00 C ATOM 890 O THR A 60 15.491 -7.295 20.079 1.00 0.00 O ATOM 891 CB THR A 60 15.823 -9.493 18.185 1.00 0.00 C ATOM 892 OG1 THR A 60 15.999 -10.857 17.827 1.00 0.00 O ATOM 893 CG2 THR A 60 16.051 -8.613 16.957 1.00 0.00 C ATOM 0 H THR A 60 15.693 -10.243 20.653 1.00 0.00 H new ATOM 0 HA THR A 60 17.842 -9.228 18.903 1.00 0.00 H new ATOM 0 HB THR A 60 14.810 -9.339 18.556 1.00 0.00 H new ATOM 0 HG1 THR A 60 15.168 -11.349 17.995 1.00 0.00 H new ATOM 0 HG21 THR A 60 15.336 -8.881 16.179 1.00 0.00 H new ATOM 0 HG22 THR A 60 15.915 -7.566 17.229 1.00 0.00 H new ATOM 0 HG23 THR A 60 17.065 -8.763 16.585 1.00 0.00 H new ATOM 901 N VAL A 61 17.649 -6.867 19.616 1.00 0.00 N ATOM 902 CA VAL A 61 17.546 -5.460 19.985 1.00 0.00 C ATOM 903 C VAL A 61 17.678 -4.589 18.743 1.00 0.00 C ATOM 904 O VAL A 61 18.622 -4.735 17.966 1.00 0.00 O ATOM 905 CB VAL A 61 18.642 -5.097 20.986 1.00 0.00 C ATOM 906 CG1 VAL A 61 18.712 -3.576 21.144 1.00 0.00 C ATOM 907 CG2 VAL A 61 18.333 -5.740 22.340 1.00 0.00 C ATOM 0 H VAL A 61 18.574 -7.159 19.300 1.00 0.00 H new ATOM 0 HA VAL A 61 16.573 -5.287 20.445 1.00 0.00 H new ATOM 0 HB VAL A 61 19.601 -5.466 20.621 1.00 0.00 H new ATOM 0 HG11 VAL A 61 19.494 -3.320 21.858 1.00 0.00 H new ATOM 0 HG12 VAL A 61 18.938 -3.120 20.180 1.00 0.00 H new ATOM 0 HG13 VAL A 61 17.754 -3.203 21.506 1.00 0.00 H new ATOM 0 HG21 VAL A 61 19.115 -5.480 23.053 1.00 0.00 H new ATOM 0 HG22 VAL A 61 17.373 -5.375 22.706 1.00 0.00 H new ATOM 0 HG23 VAL A 61 18.290 -6.823 22.227 1.00 0.00 H new ATOM 917 N LEU A 62 16.721 -3.688 18.568 1.00 0.00 N ATOM 918 CA LEU A 62 16.716 -2.796 17.415 1.00 0.00 C ATOM 919 C LEU A 62 16.820 -1.346 17.849 1.00 0.00 C ATOM 920 O LEU A 62 16.449 -0.986 18.967 1.00 0.00 O ATOM 921 CB LEU A 62 15.446 -3.000 16.585 1.00 0.00 C ATOM 922 CG LEU A 62 15.396 -4.437 16.069 1.00 0.00 C ATOM 923 CD1 LEU A 62 14.308 -4.553 15.020 1.00 0.00 C ATOM 924 CD2 LEU A 62 16.725 -4.819 15.433 1.00 0.00 C ATOM 0 H LEU A 62 15.939 -3.555 19.209 1.00 0.00 H new ATOM 0 HA LEU A 62 17.584 -3.037 16.802 1.00 0.00 H new ATOM 0 HB2 LEU A 62 14.565 -2.790 17.192 1.00 0.00 H new ATOM 0 HB3 LEU A 62 15.430 -2.302 15.748 1.00 0.00 H new ATOM 0 HG LEU A 62 15.192 -5.103 16.907 1.00 0.00 H new ATOM 0 HD11 LEU A 62 14.268 -5.577 14.649 1.00 0.00 H new ATOM 0 HD12 LEU A 62 13.347 -4.290 15.462 1.00 0.00 H new ATOM 0 HD13 LEU A 62 14.525 -3.876 14.194 1.00 0.00 H new ATOM 0 HD21 LEU A 62 16.673 -5.846 15.070 1.00 0.00 H new ATOM 0 HD22 LEU A 62 16.935 -4.150 14.599 1.00 0.00 H new ATOM 0 HD23 LEU A 62 17.520 -4.736 16.174 1.00 0.00 H new ATOM 936 N SER A 63 17.340 -0.517 16.955 1.00 0.00 N ATOM 937 CA SER A 63 17.504 0.900 17.259 1.00 0.00 C ATOM 938 C SER A 63 17.098 1.772 16.077 1.00 0.00 C ATOM 939 O SER A 63 17.241 1.374 14.920 1.00 0.00 O ATOM 940 CB SER A 63 18.961 1.195 17.633 1.00 0.00 C ATOM 941 OG SER A 63 19.056 2.516 18.157 1.00 0.00 O ATOM 0 H SER A 63 17.652 -0.795 16.025 1.00 0.00 H new ATOM 0 HA SER A 63 16.853 1.135 18.101 1.00 0.00 H new ATOM 0 HB2 SER A 63 19.312 0.473 18.370 1.00 0.00 H new ATOM 0 HB3 SER A 63 19.601 1.092 16.757 1.00 0.00 H new ATOM 0 HG SER A 63 18.278 2.700 18.724 1.00 0.00 H new ATOM 947 N GLY A 64 16.591 2.968 16.377 1.00 0.00 N ATOM 948 CA GLY A 64 16.167 3.888 15.324 1.00 0.00 C ATOM 949 C GLY A 64 15.998 5.310 15.859 1.00 0.00 C ATOM 950 O GLY A 64 16.005 5.544 17.068 1.00 0.00 O ATOM 0 H GLY A 64 16.465 3.318 17.327 1.00 0.00 H new ATOM 0 HA2 GLY A 64 16.902 3.886 14.519 1.00 0.00 H new ATOM 0 HA3 GLY A 64 15.225 3.544 14.896 1.00 0.00 H new ATOM 1102 N GLY A 74 -0.752 3.485 16.274 1.00 0.00 N ATOM 1103 CA GLY A 74 -0.768 2.063 15.944 1.00 0.00 C ATOM 1104 C GLY A 74 0.449 1.350 16.528 1.00 0.00 C ATOM 1105 O GLY A 74 0.424 0.143 16.767 1.00 0.00 O ATOM 0 HA2 GLY A 74 -1.680 1.607 16.329 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -0.782 1.938 14.861 1.00 0.00 H new ATOM 1109 N GLN A 75 1.516 2.102 16.755 1.00 0.00 N ATOM 1110 CA GLN A 75 2.732 1.527 17.317 1.00 0.00 C ATOM 1111 C GLN A 75 2.537 1.181 18.790 1.00 0.00 C ATOM 1112 O GLN A 75 2.997 0.140 19.259 1.00 0.00 O ATOM 1113 CB GLN A 75 3.892 2.511 17.173 1.00 0.00 C ATOM 1114 CG GLN A 75 4.300 2.607 15.702 1.00 0.00 C ATOM 1115 CD GLN A 75 4.817 1.255 15.218 1.00 0.00 C ATOM 1116 OE1 GLN A 75 5.692 0.663 15.849 1.00 0.00 O ATOM 1117 NE2 GLN A 75 4.326 0.731 14.129 1.00 0.00 N ATOM 0 H GLN A 75 1.566 3.102 16.561 1.00 0.00 H new ATOM 0 HA GLN A 75 2.960 0.612 16.770 1.00 0.00 H new ATOM 0 HB2 GLN A 75 3.598 3.493 17.545 1.00 0.00 H new ATOM 0 HB3 GLN A 75 4.739 2.182 17.776 1.00 0.00 H new ATOM 0 HG2 GLN A 75 3.447 2.917 15.098 1.00 0.00 H new ATOM 0 HG3 GLN A 75 5.072 3.367 15.578 1.00 0.00 H new ATOM 0 HE21 GLN A 75 3.601 1.224 13.608 1.00 0.00 H new ATOM 0 HE22 GLN A 75 4.667 -0.172 13.799 1.00 0.00 H new ATOM 1126 N LEU A 76 1.856 2.063 19.515 1.00 0.00 N ATOM 1127 CA LEU A 76 1.615 1.843 20.935 1.00 0.00 C ATOM 1128 C LEU A 76 0.313 1.076 21.153 1.00 0.00 C ATOM 1129 O LEU A 76 -0.758 1.673 21.268 1.00 0.00 O ATOM 1130 CB LEU A 76 1.529 3.186 21.655 1.00 0.00 C ATOM 1131 CG LEU A 76 2.644 4.107 21.156 1.00 0.00 C ATOM 1132 CD1 LEU A 76 2.474 5.500 21.767 1.00 0.00 C ATOM 1133 CD2 LEU A 76 4.001 3.537 21.564 1.00 0.00 C ATOM 0 H LEU A 76 1.465 2.929 19.146 1.00 0.00 H new ATOM 0 HA LEU A 76 2.441 1.256 21.335 1.00 0.00 H new ATOM 0 HB2 LEU A 76 0.557 3.645 21.476 1.00 0.00 H new ATOM 0 HB3 LEU A 76 1.619 3.040 22.731 1.00 0.00 H new ATOM 0 HG LEU A 76 2.591 4.178 20.070 1.00 0.00 H new ATOM 0 HD11 LEU A 76 3.270 6.154 21.410 1.00 0.00 H new ATOM 0 HD12 LEU A 76 1.508 5.911 21.474 1.00 0.00 H new ATOM 0 HD13 LEU A 76 2.523 5.429 22.854 1.00 0.00 H new ATOM 0 HD21 LEU A 76 4.794 4.195 21.208 1.00 0.00 H new ATOM 0 HD22 LEU A 76 4.053 3.462 22.650 1.00 0.00 H new ATOM 0 HD23 LEU A 76 4.126 2.547 21.126 1.00 0.00 H new ATOM 1145 N LYS A 77 0.415 -0.248 21.209 1.00 0.00 N ATOM 1146 CA LYS A 77 -0.757 -1.091 21.415 1.00 0.00 C ATOM 1147 C LYS A 77 -0.353 -2.562 21.457 1.00 0.00 C ATOM 1148 O LYS A 77 0.435 -3.027 20.630 1.00 0.00 O ATOM 1149 CB LYS A 77 -1.767 -0.864 20.292 1.00 0.00 C ATOM 1150 CG LYS A 77 -1.381 -1.708 19.079 1.00 0.00 C ATOM 1151 CD LYS A 77 -1.986 -1.087 17.820 1.00 0.00 C ATOM 1152 CE LYS A 77 -3.485 -0.874 18.018 1.00 0.00 C ATOM 1153 NZ LYS A 77 -4.131 -0.640 16.696 1.00 0.00 N ATOM 0 H LYS A 77 1.293 -0.758 21.115 1.00 0.00 H new ATOM 0 HA LYS A 77 -1.214 -0.825 22.368 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -2.768 -1.131 20.630 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -1.793 0.191 20.020 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -0.296 -1.760 18.988 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -1.740 -2.730 19.203 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -1.500 -0.136 17.603 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -1.812 -1.737 16.963 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -3.926 -1.745 18.502 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -3.659 -0.022 18.676 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -4.791 0.160 16.769 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -3.402 -0.424 15.987 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -4.652 -1.493 16.408 1.00 0.00 H new ATOM 1167 N GLU A 78 -0.897 -3.289 22.424 1.00 0.00 N ATOM 1168 CA GLU A 78 -0.591 -4.707 22.577 1.00 0.00 C ATOM 1169 C GLU A 78 -1.237 -5.516 21.467 1.00 0.00 C ATOM 1170 O GLU A 78 -0.923 -6.691 21.277 1.00 0.00 O ATOM 1171 CB GLU A 78 -1.071 -5.216 23.941 1.00 0.00 C ATOM 1172 CG GLU A 78 -0.212 -4.606 25.052 1.00 0.00 C ATOM 1173 CD GLU A 78 -0.615 -5.191 26.402 1.00 0.00 C ATOM 1174 OE1 GLU A 78 -1.462 -6.070 26.415 1.00 0.00 O ATOM 1175 OE2 GLU A 78 -0.067 -4.757 27.403 1.00 0.00 O ATOM 0 H GLU A 78 -1.552 -2.921 23.114 1.00 0.00 H new ATOM 0 HA GLU A 78 0.490 -4.829 22.516 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -2.118 -4.951 24.091 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -1.009 -6.304 23.976 1.00 0.00 H new ATOM 0 HG2 GLU A 78 0.842 -4.806 24.860 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -0.334 -3.523 25.064 1.00 0.00 H new ATOM 1182 N LYS A 79 -2.137 -4.879 20.733 1.00 0.00 N ATOM 1183 CA LYS A 79 -2.822 -5.546 19.638 1.00 0.00 C ATOM 1184 C LYS A 79 -1.940 -5.554 18.396 1.00 0.00 C ATOM 1185 O LYS A 79 -2.188 -6.306 17.454 1.00 0.00 O ATOM 1186 CB LYS A 79 -4.141 -4.841 19.332 1.00 0.00 C ATOM 1187 CG LYS A 79 -4.980 -4.763 20.607 1.00 0.00 C ATOM 1188 CD LYS A 79 -6.448 -5.042 20.266 1.00 0.00 C ATOM 1189 CE LYS A 79 -6.666 -6.551 20.140 1.00 0.00 C ATOM 1190 NZ LYS A 79 -8.063 -6.820 19.700 1.00 0.00 N ATOM 0 H LYS A 79 -2.408 -3.906 20.875 1.00 0.00 H new ATOM 0 HA LYS A 79 -3.031 -6.574 19.933 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -3.950 -3.839 18.947 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -4.685 -5.382 18.558 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -4.620 -5.488 21.337 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -4.881 -3.777 21.061 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -7.096 -4.634 21.042 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -6.716 -4.546 19.333 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -5.961 -6.972 19.423 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -6.476 -7.037 21.097 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -8.209 -7.846 19.615 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -8.728 -6.433 20.400 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -8.229 -6.369 18.778 1.00 0.00 H new ATOM 1204 N ASP A 80 -0.909 -4.713 18.401 1.00 0.00 N ATOM 1205 CA ASP A 80 0.006 -4.639 17.261 1.00 0.00 C ATOM 1206 C ASP A 80 0.811 -5.933 17.136 1.00 0.00 C ATOM 1207 O ASP A 80 1.026 -6.633 18.127 1.00 0.00 O ATOM 1208 CB ASP A 80 0.953 -3.457 17.427 1.00 0.00 C ATOM 1209 CG ASP A 80 2.227 -3.688 16.624 1.00 0.00 C ATOM 1210 OD1 ASP A 80 2.898 -4.673 16.885 1.00 0.00 O ATOM 1211 OD2 ASP A 80 2.514 -2.877 15.759 1.00 0.00 O ATOM 0 H ASP A 80 -0.686 -4.080 19.170 1.00 0.00 H new ATOM 0 HA ASP A 80 -0.583 -4.503 16.354 1.00 0.00 H new ATOM 0 HB2 ASP A 80 0.465 -2.541 17.094 1.00 0.00 H new ATOM 0 HB3 ASP A 80 1.198 -3.323 18.481 1.00 0.00 H new ATOM 1216 N THR A 81 1.248 -6.249 15.919 1.00 0.00 N ATOM 1217 CA THR A 81 2.017 -7.458 15.680 1.00 0.00 C ATOM 1218 C THR A 81 3.116 -7.191 14.667 1.00 0.00 C ATOM 1219 O THR A 81 2.849 -6.868 13.513 1.00 0.00 O ATOM 1220 CB THR A 81 1.103 -8.561 15.157 1.00 0.00 C ATOM 1221 OG1 THR A 81 -0.087 -7.990 14.627 1.00 0.00 O ATOM 1222 CG2 THR A 81 0.746 -9.508 16.293 1.00 0.00 C ATOM 0 H THR A 81 1.081 -5.683 15.087 1.00 0.00 H new ATOM 0 HA THR A 81 2.467 -7.775 16.621 1.00 0.00 H new ATOM 0 HB THR A 81 1.620 -9.112 14.371 1.00 0.00 H new ATOM 0 HG1 THR A 81 -0.670 -8.702 14.291 1.00 0.00 H new ATOM 0 HG21 THR A 81 0.093 -10.296 15.918 1.00 0.00 H new ATOM 0 HG22 THR A 81 1.656 -9.952 16.696 1.00 0.00 H new ATOM 0 HG23 THR A 81 0.233 -8.955 17.080 1.00 0.00 H new ATOM 1230 N LEU A 82 4.353 -7.329 15.108 1.00 0.00 N ATOM 1231 CA LEU A 82 5.489 -7.089 14.228 1.00 0.00 C ATOM 1232 C LEU A 82 5.949 -8.388 13.571 1.00 0.00 C ATOM 1233 O LEU A 82 6.163 -9.396 14.244 1.00 0.00 O ATOM 1234 CB LEU A 82 6.642 -6.492 15.030 1.00 0.00 C ATOM 1235 CG LEU A 82 6.160 -5.267 15.808 1.00 0.00 C ATOM 1236 CD1 LEU A 82 7.354 -4.560 16.458 1.00 0.00 C ATOM 1237 CD2 LEU A 82 5.453 -4.306 14.855 1.00 0.00 C ATOM 0 H LEU A 82 4.599 -7.603 16.059 1.00 0.00 H new ATOM 0 HA LEU A 82 5.180 -6.393 13.448 1.00 0.00 H new ATOM 0 HB2 LEU A 82 7.040 -7.237 15.719 1.00 0.00 H new ATOM 0 HB3 LEU A 82 7.454 -6.211 14.360 1.00 0.00 H new ATOM 0 HG LEU A 82 5.466 -5.585 16.586 1.00 0.00 H new ATOM 0 HD11 LEU A 82 7.004 -3.688 17.011 1.00 0.00 H new ATOM 0 HD12 LEU A 82 7.855 -5.246 17.141 1.00 0.00 H new ATOM 0 HD13 LEU A 82 8.054 -4.242 15.685 1.00 0.00 H new ATOM 0 HD21 LEU A 82 5.109 -3.432 15.408 1.00 0.00 H new ATOM 0 HD22 LEU A 82 6.146 -3.992 14.075 1.00 0.00 H new ATOM 0 HD23 LEU A 82 4.598 -4.807 14.400 1.00 0.00 H new ATOM 1249 N VAL A 83 6.097 -8.363 12.250 1.00 0.00 N ATOM 1250 CA VAL A 83 6.528 -9.549 11.528 1.00 0.00 C ATOM 1251 C VAL A 83 7.929 -9.349 10.970 1.00 0.00 C ATOM 1252 O VAL A 83 8.184 -8.408 10.219 1.00 0.00 O ATOM 1253 CB VAL A 83 5.550 -9.838 10.389 1.00 0.00 C ATOM 1254 CG1 VAL A 83 5.672 -11.301 9.955 1.00 0.00 C ATOM 1255 CG2 VAL A 83 4.114 -9.562 10.859 1.00 0.00 C ATOM 0 H VAL A 83 5.927 -7.544 11.666 1.00 0.00 H new ATOM 0 HA VAL A 83 6.545 -10.395 12.215 1.00 0.00 H new ATOM 0 HB VAL A 83 5.787 -9.192 9.544 1.00 0.00 H new ATOM 0 HG11 VAL A 83 4.972 -11.499 9.143 1.00 0.00 H new ATOM 0 HG12 VAL A 83 6.689 -11.496 9.613 1.00 0.00 H new ATOM 0 HG13 VAL A 83 5.442 -11.951 10.799 1.00 0.00 H new ATOM 0 HG21 VAL A 83 3.419 -9.769 10.045 1.00 0.00 H new ATOM 0 HG22 VAL A 83 3.880 -10.204 11.708 1.00 0.00 H new ATOM 0 HG23 VAL A 83 4.023 -8.518 11.157 1.00 0.00 H new ATOM 1265 N LEU A 84 8.835 -10.238 11.350 1.00 0.00 N ATOM 1266 CA LEU A 84 10.213 -10.147 10.895 1.00 0.00 C ATOM 1267 C LEU A 84 10.550 -11.263 9.912 1.00 0.00 C ATOM 1268 O LEU A 84 10.187 -12.420 10.122 1.00 0.00 O ATOM 1269 CB LEU A 84 11.152 -10.242 12.090 1.00 0.00 C ATOM 1270 CG LEU A 84 11.268 -8.877 12.765 1.00 0.00 C ATOM 1271 CD1 LEU A 84 12.142 -7.951 11.916 1.00 0.00 C ATOM 1272 CD2 LEU A 84 9.875 -8.273 12.921 1.00 0.00 C ATOM 0 H LEU A 84 8.642 -11.026 11.968 1.00 0.00 H new ATOM 0 HA LEU A 84 10.336 -9.190 10.389 1.00 0.00 H new ATOM 0 HB2 LEU A 84 10.778 -10.979 12.801 1.00 0.00 H new ATOM 0 HB3 LEU A 84 12.135 -10.583 11.766 1.00 0.00 H new ATOM 0 HG LEU A 84 11.726 -8.994 13.747 1.00 0.00 H new ATOM 0 HD11 LEU A 84 12.221 -6.979 12.402 1.00 0.00 H new ATOM 0 HD12 LEU A 84 13.136 -8.386 11.809 1.00 0.00 H new ATOM 0 HD13 LEU A 84 11.692 -7.828 10.931 1.00 0.00 H new ATOM 0 HD21 LEU A 84 9.953 -7.298 13.403 1.00 0.00 H new ATOM 0 HD22 LEU A 84 9.417 -8.157 11.939 1.00 0.00 H new ATOM 0 HD23 LEU A 84 9.259 -8.932 13.533 1.00 0.00 H new ATOM 1284 N GLU A 85 11.249 -10.908 8.843 1.00 0.00 N ATOM 1285 CA GLU A 85 11.637 -11.894 7.836 1.00 0.00 C ATOM 1286 C GLU A 85 13.101 -12.273 8.009 1.00 0.00 C ATOM 1287 O GLU A 85 13.978 -11.408 7.995 1.00 0.00 O ATOM 1288 CB GLU A 85 11.425 -11.323 6.434 1.00 0.00 C ATOM 1289 CG GLU A 85 9.938 -11.029 6.218 1.00 0.00 C ATOM 1290 CD GLU A 85 9.722 -10.386 4.854 1.00 0.00 C ATOM 1291 OE1 GLU A 85 10.675 -10.312 4.096 1.00 0.00 O ATOM 1292 OE2 GLU A 85 8.602 -9.981 4.583 1.00 0.00 O ATOM 0 H GLU A 85 11.558 -9.956 8.649 1.00 0.00 H new ATOM 0 HA GLU A 85 11.017 -12.782 7.963 1.00 0.00 H new ATOM 0 HB2 GLU A 85 12.008 -10.410 6.310 1.00 0.00 H new ATOM 0 HB3 GLU A 85 11.779 -12.031 5.685 1.00 0.00 H new ATOM 0 HG2 GLU A 85 9.363 -11.953 6.288 1.00 0.00 H new ATOM 0 HG3 GLU A 85 9.573 -10.366 7.003 1.00 0.00 H new ATOM 1299 N TYR A 86 13.352 -13.570 8.174 1.00 0.00 N ATOM 1300 CA TYR A 86 14.716 -14.057 8.355 1.00 0.00 C ATOM 1301 C TYR A 86 14.892 -15.421 7.693 1.00 0.00 C ATOM 1302 O TYR A 86 13.988 -16.248 7.712 1.00 0.00 O ATOM 1303 CB TYR A 86 15.019 -14.176 9.850 1.00 0.00 C ATOM 1304 CG TYR A 86 16.511 -14.248 10.061 1.00 0.00 C ATOM 1305 CD1 TYR A 86 17.211 -15.392 9.676 1.00 0.00 C ATOM 1306 CD2 TYR A 86 17.192 -13.166 10.629 1.00 0.00 C ATOM 1307 CE1 TYR A 86 18.599 -15.461 9.858 1.00 0.00 C ATOM 1308 CE2 TYR A 86 18.580 -13.230 10.809 1.00 0.00 C ATOM 1309 CZ TYR A 86 19.284 -14.379 10.424 1.00 0.00 C ATOM 1310 OH TYR A 86 20.653 -14.443 10.601 1.00 0.00 O ATOM 0 H TYR A 86 12.636 -14.296 8.186 1.00 0.00 H new ATOM 0 HA TYR A 86 15.404 -13.351 7.890 1.00 0.00 H new ATOM 0 HB2 TYR A 86 14.607 -13.320 10.384 1.00 0.00 H new ATOM 0 HB3 TYR A 86 14.541 -15.066 10.258 1.00 0.00 H new ATOM 0 HD1 TYR A 86 16.683 -16.225 9.237 1.00 0.00 H new ATOM 0 HD2 TYR A 86 16.648 -12.282 10.928 1.00 0.00 H new ATOM 0 HE1 TYR A 86 19.140 -16.348 9.562 1.00 0.00 H new ATOM 0 HE2 TYR A 86 19.107 -12.394 11.244 1.00 0.00 H new ATOM 0 HH TYR A 86 20.970 -13.608 11.005 1.00 0.00 H new ATOM 1320 N ASP A 87 16.061 -15.649 7.112 1.00 0.00 N ATOM 1321 CA ASP A 87 16.341 -16.921 6.453 1.00 0.00 C ATOM 1322 C ASP A 87 15.104 -17.464 5.741 1.00 0.00 C ATOM 1323 O ASP A 87 14.704 -18.609 5.954 1.00 0.00 O ATOM 1324 CB ASP A 87 16.834 -17.946 7.476 1.00 0.00 C ATOM 1325 CG ASP A 87 17.148 -19.266 6.784 1.00 0.00 C ATOM 1326 OD1 ASP A 87 16.849 -19.383 5.607 1.00 0.00 O ATOM 1327 OD2 ASP A 87 17.684 -20.143 7.441 1.00 0.00 O ATOM 0 H ASP A 87 16.827 -14.977 7.082 1.00 0.00 H new ATOM 0 HA ASP A 87 17.116 -16.745 5.707 1.00 0.00 H new ATOM 0 HB2 ASP A 87 17.724 -17.570 7.980 1.00 0.00 H new ATOM 0 HB3 ASP A 87 16.075 -18.100 8.243 1.00 0.00 H new ATOM 1332 N ASN A 88 14.507 -16.635 4.893 1.00 0.00 N ATOM 1333 CA ASN A 88 13.325 -17.033 4.144 1.00 0.00 C ATOM 1334 C ASN A 88 12.226 -17.488 5.093 1.00 0.00 C ATOM 1335 O ASN A 88 11.354 -18.275 4.720 1.00 0.00 O ATOM 1336 CB ASN A 88 13.682 -18.171 3.190 1.00 0.00 C ATOM 1337 CG ASN A 88 14.625 -17.666 2.101 1.00 0.00 C ATOM 1338 OD1 ASN A 88 15.445 -16.782 2.350 1.00 0.00 O ATOM 1339 ND2 ASN A 88 14.559 -18.179 0.903 1.00 0.00 N ATOM 0 H ASN A 88 14.823 -15.683 4.708 1.00 0.00 H new ATOM 0 HA ASN A 88 12.965 -16.177 3.573 1.00 0.00 H new ATOM 0 HB2 ASN A 88 14.153 -18.984 3.742 1.00 0.00 H new ATOM 0 HB3 ASN A 88 12.776 -18.575 2.739 1.00 0.00 H new ATOM 0 HD21 ASN A 88 15.187 -17.848 0.171 1.00 0.00 H new ATOM 0 HD22 ASN A 88 13.879 -18.911 0.699 1.00 0.00 H new ATOM 1346 N LYS A 89 12.269 -16.982 6.319 1.00 0.00 N ATOM 1347 CA LYS A 89 11.264 -17.342 7.313 1.00 0.00 C ATOM 1348 C LYS A 89 10.602 -16.092 7.879 1.00 0.00 C ATOM 1349 O LYS A 89 11.245 -15.053 8.029 1.00 0.00 O ATOM 1350 CB LYS A 89 11.900 -18.149 8.452 1.00 0.00 C ATOM 1351 CG LYS A 89 12.040 -19.610 8.033 1.00 0.00 C ATOM 1352 CD LYS A 89 13.337 -20.179 8.600 1.00 0.00 C ATOM 1353 CE LYS A 89 13.229 -20.288 10.123 1.00 0.00 C ATOM 1354 NZ LYS A 89 14.532 -20.745 10.682 1.00 0.00 N ATOM 0 H LYS A 89 12.980 -16.328 6.647 1.00 0.00 H new ATOM 0 HA LYS A 89 10.507 -17.954 6.823 1.00 0.00 H new ATOM 0 HB2 LYS A 89 12.878 -17.737 8.700 1.00 0.00 H new ATOM 0 HB3 LYS A 89 11.286 -18.075 9.349 1.00 0.00 H new ATOM 0 HG2 LYS A 89 11.189 -20.186 8.395 1.00 0.00 H new ATOM 0 HG3 LYS A 89 12.040 -19.689 6.946 1.00 0.00 H new ATOM 0 HD2 LYS A 89 13.534 -21.160 8.168 1.00 0.00 H new ATOM 0 HD3 LYS A 89 14.176 -19.537 8.330 1.00 0.00 H new ATOM 0 HE2 LYS A 89 12.957 -19.322 10.549 1.00 0.00 H new ATOM 0 HE3 LYS A 89 12.439 -20.989 10.393 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 14.459 -20.819 11.717 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 14.773 -21.675 10.284 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 15.275 -20.060 10.436 1.00 0.00 H new ATOM 1368 N THR A 90 9.315 -16.195 8.190 1.00 0.00 N ATOM 1369 CA THR A 90 8.583 -15.057 8.735 1.00 0.00 C ATOM 1370 C THR A 90 8.280 -15.276 10.213 1.00 0.00 C ATOM 1371 O THR A 90 7.673 -16.276 10.588 1.00 0.00 O ATOM 1372 CB THR A 90 7.266 -14.869 7.970 1.00 0.00 C ATOM 1373 OG1 THR A 90 7.227 -15.763 6.866 1.00 0.00 O ATOM 1374 CG2 THR A 90 7.167 -13.435 7.458 1.00 0.00 C ATOM 0 H THR A 90 8.762 -17.044 8.076 1.00 0.00 H new ATOM 0 HA THR A 90 9.201 -14.165 8.627 1.00 0.00 H new ATOM 0 HB THR A 90 6.431 -15.074 8.640 1.00 0.00 H new ATOM 0 HG1 THR A 90 6.385 -15.644 6.378 1.00 0.00 H new ATOM 0 HG21 THR A 90 6.230 -13.306 6.916 1.00 0.00 H new ATOM 0 HG22 THR A 90 7.196 -12.745 8.301 1.00 0.00 H new ATOM 0 HG23 THR A 90 8.004 -13.228 6.791 1.00 0.00 H new ATOM 1382 N TYR A 91 8.706 -14.335 11.045 1.00 0.00 N ATOM 1383 CA TYR A 91 8.473 -14.436 12.482 1.00 0.00 C ATOM 1384 C TYR A 91 7.368 -13.478 12.901 1.00 0.00 C ATOM 1385 O TYR A 91 7.386 -12.310 12.531 1.00 0.00 O ATOM 1386 CB TYR A 91 9.758 -14.096 13.233 1.00 0.00 C ATOM 1387 CG TYR A 91 10.762 -15.199 13.016 1.00 0.00 C ATOM 1388 CD1 TYR A 91 11.261 -15.438 11.732 1.00 0.00 C ATOM 1389 CD2 TYR A 91 11.197 -15.977 14.094 1.00 0.00 C ATOM 1390 CE1 TYR A 91 12.199 -16.458 11.525 1.00 0.00 C ATOM 1391 CE2 TYR A 91 12.133 -16.997 13.889 1.00 0.00 C ATOM 1392 CZ TYR A 91 12.635 -17.238 12.604 1.00 0.00 C ATOM 1393 OH TYR A 91 13.561 -18.241 12.403 1.00 0.00 O ATOM 0 H TYR A 91 9.211 -13.498 10.754 1.00 0.00 H new ATOM 0 HA TYR A 91 8.169 -15.455 12.722 1.00 0.00 H new ATOM 0 HB2 TYR A 91 10.160 -13.147 12.880 1.00 0.00 H new ATOM 0 HB3 TYR A 91 9.552 -13.979 14.297 1.00 0.00 H new ATOM 0 HD1 TYR A 91 10.924 -14.837 10.901 1.00 0.00 H new ATOM 0 HD2 TYR A 91 10.810 -15.790 15.085 1.00 0.00 H new ATOM 0 HE1 TYR A 91 12.586 -16.643 10.534 1.00 0.00 H new ATOM 0 HE2 TYR A 91 12.468 -17.598 14.721 1.00 0.00 H new ATOM 0 HH TYR A 91 13.321 -19.022 12.945 1.00 0.00 H new ATOM 1403 N THR A 92 6.410 -13.980 13.674 1.00 0.00 N ATOM 1404 CA THR A 92 5.300 -13.151 14.127 1.00 0.00 C ATOM 1405 C THR A 92 5.503 -12.710 15.573 1.00 0.00 C ATOM 1406 O THR A 92 5.485 -13.529 16.492 1.00 0.00 O ATOM 1407 CB THR A 92 3.992 -13.946 14.023 1.00 0.00 C ATOM 1408 OG1 THR A 92 4.243 -15.195 13.396 1.00 0.00 O ATOM 1409 CG2 THR A 92 2.979 -13.167 13.189 1.00 0.00 C ATOM 0 H THR A 92 6.380 -14.947 13.997 1.00 0.00 H new ATOM 0 HA THR A 92 5.253 -12.265 13.494 1.00 0.00 H new ATOM 0 HB THR A 92 3.594 -14.108 15.025 1.00 0.00 H new ATOM 0 HG1 THR A 92 4.449 -15.050 12.449 1.00 0.00 H new ATOM 0 HG21 THR A 92 2.052 -13.736 13.118 1.00 0.00 H new ATOM 0 HG22 THR A 92 2.780 -12.206 13.663 1.00 0.00 H new ATOM 0 HG23 THR A 92 3.381 -13.002 12.189 1.00 0.00 H new ATOM 1417 N TYR A 93 5.689 -11.409 15.767 1.00 0.00 N ATOM 1418 CA TYR A 93 5.885 -10.860 17.100 1.00 0.00 C ATOM 1419 C TYR A 93 4.673 -10.038 17.526 1.00 0.00 C ATOM 1420 O TYR A 93 3.963 -9.482 16.689 1.00 0.00 O ATOM 1421 CB TYR A 93 7.129 -9.973 17.124 1.00 0.00 C ATOM 1422 CG TYR A 93 8.364 -10.825 17.015 1.00 0.00 C ATOM 1423 CD1 TYR A 93 8.943 -11.358 18.169 1.00 0.00 C ATOM 1424 CD2 TYR A 93 8.929 -11.082 15.764 1.00 0.00 C ATOM 1425 CE1 TYR A 93 10.090 -12.149 18.073 1.00 0.00 C ATOM 1426 CE2 TYR A 93 10.075 -11.873 15.666 1.00 0.00 C ATOM 1427 CZ TYR A 93 10.658 -12.410 16.820 1.00 0.00 C ATOM 1428 OH TYR A 93 11.791 -13.192 16.723 1.00 0.00 O ATOM 0 H TYR A 93 5.708 -10.717 15.018 1.00 0.00 H new ATOM 0 HA TYR A 93 6.014 -11.690 17.795 1.00 0.00 H new ATOM 0 HB2 TYR A 93 7.094 -9.260 16.301 1.00 0.00 H new ATOM 0 HB3 TYR A 93 7.156 -9.394 18.047 1.00 0.00 H new ATOM 0 HD1 TYR A 93 8.504 -11.158 19.135 1.00 0.00 H new ATOM 0 HD2 TYR A 93 8.480 -10.669 14.873 1.00 0.00 H new ATOM 0 HE1 TYR A 93 10.539 -12.559 18.965 1.00 0.00 H new ATOM 0 HE2 TYR A 93 10.512 -12.071 14.699 1.00 0.00 H new ATOM 0 HH TYR A 93 12.052 -13.274 15.782 1.00 0.00 H new ATOM 1438 N GLU A 94 4.446 -9.965 18.830 1.00 0.00 N ATOM 1439 CA GLU A 94 3.316 -9.206 19.362 1.00 0.00 C ATOM 1440 C GLU A 94 3.790 -8.205 20.401 1.00 0.00 C ATOM 1441 O GLU A 94 4.637 -8.525 21.233 1.00 0.00 O ATOM 1442 CB GLU A 94 2.286 -10.156 19.984 1.00 0.00 C ATOM 1443 CG GLU A 94 1.375 -9.380 20.937 1.00 0.00 C ATOM 1444 CD GLU A 94 0.286 -10.298 21.479 1.00 0.00 C ATOM 1445 OE1 GLU A 94 0.591 -11.097 22.347 1.00 0.00 O ATOM 1446 OE2 GLU A 94 -0.838 -10.186 21.019 1.00 0.00 O ATOM 0 H GLU A 94 5.024 -10.418 19.538 1.00 0.00 H new ATOM 0 HA GLU A 94 2.848 -8.663 18.541 1.00 0.00 H new ATOM 0 HB2 GLU A 94 1.692 -10.626 19.201 1.00 0.00 H new ATOM 0 HB3 GLU A 94 2.794 -10.956 20.523 1.00 0.00 H new ATOM 0 HG2 GLU A 94 1.960 -8.971 21.760 1.00 0.00 H new ATOM 0 HG3 GLU A 94 0.924 -8.536 20.416 1.00 0.00 H new ATOM 1453 N ILE A 95 3.245 -6.990 20.354 1.00 0.00 N ATOM 1454 CA ILE A 95 3.644 -5.969 21.305 1.00 0.00 C ATOM 1455 C ILE A 95 3.190 -6.340 22.711 1.00 0.00 C ATOM 1456 O ILE A 95 1.995 -6.477 22.979 1.00 0.00 O ATOM 1457 CB ILE A 95 3.022 -4.635 20.908 1.00 0.00 C ATOM 1458 CG1 ILE A 95 3.787 -4.053 19.725 1.00 0.00 C ATOM 1459 CG2 ILE A 95 3.082 -3.660 22.084 1.00 0.00 C ATOM 1460 CD1 ILE A 95 5.060 -3.364 20.210 1.00 0.00 C ATOM 0 H ILE A 95 2.539 -6.698 19.678 1.00 0.00 H new ATOM 0 HA ILE A 95 4.731 -5.889 21.297 1.00 0.00 H new ATOM 0 HB ILE A 95 1.980 -4.794 20.630 1.00 0.00 H new ATOM 0 HG12 ILE A 95 4.039 -4.845 19.020 1.00 0.00 H new ATOM 0 HG13 ILE A 95 3.159 -3.340 19.191 1.00 0.00 H new ATOM 0 HG21 ILE A 95 2.636 -2.710 21.792 1.00 0.00 H new ATOM 0 HG22 ILE A 95 2.532 -4.075 22.929 1.00 0.00 H new ATOM 0 HG23 ILE A 95 4.121 -3.500 22.371 1.00 0.00 H new ATOM 0 HD11 ILE A 95 5.598 -2.952 19.357 1.00 0.00 H new ATOM 0 HD12 ILE A 95 4.799 -2.559 20.897 1.00 0.00 H new ATOM 0 HD13 ILE A 95 5.693 -4.088 20.723 1.00 0.00 H new ATOM 1472 N GLN A 96 4.155 -6.493 23.606 1.00 0.00 N ATOM 1473 CA GLN A 96 3.854 -6.842 24.993 1.00 0.00 C ATOM 1474 C GLN A 96 3.614 -5.588 25.828 1.00 0.00 C ATOM 1475 O GLN A 96 2.509 -5.365 26.325 1.00 0.00 O ATOM 1476 CB GLN A 96 5.003 -7.646 25.605 1.00 0.00 C ATOM 1477 CG GLN A 96 5.203 -8.933 24.809 1.00 0.00 C ATOM 1478 CD GLN A 96 5.795 -10.018 25.705 1.00 0.00 C ATOM 1479 OE1 GLN A 96 5.206 -11.089 25.858 1.00 0.00 O ATOM 1480 NE2 GLN A 96 6.926 -9.801 26.319 1.00 0.00 N ATOM 0 H GLN A 96 5.148 -6.383 23.402 1.00 0.00 H new ATOM 0 HA GLN A 96 2.948 -7.448 24.995 1.00 0.00 H new ATOM 0 HB2 GLN A 96 5.919 -7.055 25.598 1.00 0.00 H new ATOM 0 HB3 GLN A 96 4.783 -7.880 26.647 1.00 0.00 H new ATOM 0 HG2 GLN A 96 4.250 -9.268 24.400 1.00 0.00 H new ATOM 0 HG3 GLN A 96 5.865 -8.747 23.963 1.00 0.00 H new ATOM 0 HE21 GLN A 96 7.413 -8.914 26.192 1.00 0.00 H new ATOM 0 HE22 GLN A 96 7.323 -10.518 26.926 1.00 0.00 H new ATOM 1489 N LYS A 97 4.655 -4.773 25.981 1.00 0.00 N ATOM 1490 CA LYS A 97 4.546 -3.549 26.759 1.00 0.00 C ATOM 1491 C LYS A 97 5.452 -2.469 26.178 1.00 0.00 C ATOM 1492 O LYS A 97 6.559 -2.752 25.703 1.00 0.00 O ATOM 1493 CB LYS A 97 4.935 -3.816 28.216 1.00 0.00 C ATOM 1494 CG LYS A 97 4.240 -2.802 29.127 1.00 0.00 C ATOM 1495 CD LYS A 97 4.503 -3.166 30.590 1.00 0.00 C ATOM 1496 CE LYS A 97 5.989 -2.979 30.902 1.00 0.00 C ATOM 1497 NZ LYS A 97 6.189 -2.951 32.379 1.00 0.00 N ATOM 0 H LYS A 97 5.577 -4.939 25.578 1.00 0.00 H new ATOM 0 HA LYS A 97 3.513 -3.205 26.719 1.00 0.00 H new ATOM 0 HB2 LYS A 97 4.650 -4.829 28.499 1.00 0.00 H new ATOM 0 HB3 LYS A 97 6.016 -3.744 28.333 1.00 0.00 H new ATOM 0 HG2 LYS A 97 4.609 -1.798 28.919 1.00 0.00 H new ATOM 0 HG3 LYS A 97 3.168 -2.795 28.930 1.00 0.00 H new ATOM 0 HD2 LYS A 97 3.901 -2.538 31.246 1.00 0.00 H new ATOM 0 HD3 LYS A 97 4.208 -4.198 30.778 1.00 0.00 H new ATOM 0 HE2 LYS A 97 6.569 -3.790 30.462 1.00 0.00 H new ATOM 0 HE3 LYS A 97 6.350 -2.051 30.458 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 7.199 -2.824 32.590 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 5.648 -2.162 32.788 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 5.859 -3.847 32.791 1.00 0.00 H new ATOM 1511 N ILE A 98 4.975 -1.231 26.217 1.00 0.00 N ATOM 1512 CA ILE A 98 5.745 -0.112 25.694 1.00 0.00 C ATOM 1513 C ILE A 98 6.052 0.894 26.798 1.00 0.00 C ATOM 1514 O ILE A 98 5.162 1.298 27.549 1.00 0.00 O ATOM 1515 CB ILE A 98 4.971 0.584 24.576 1.00 0.00 C ATOM 1516 CG1 ILE A 98 4.361 -0.471 23.650 1.00 0.00 C ATOM 1517 CG2 ILE A 98 5.928 1.475 23.779 1.00 0.00 C ATOM 1518 CD1 ILE A 98 2.848 -0.526 23.869 1.00 0.00 C ATOM 0 H ILE A 98 4.065 -0.979 26.603 1.00 0.00 H new ATOM 0 HA ILE A 98 6.683 -0.502 25.299 1.00 0.00 H new ATOM 0 HB ILE A 98 4.176 1.195 25.003 1.00 0.00 H new ATOM 0 HG12 ILE A 98 4.580 -0.229 22.610 1.00 0.00 H new ATOM 0 HG13 ILE A 98 4.804 -1.446 23.850 1.00 0.00 H new ATOM 0 HG21 ILE A 98 5.380 1.974 22.980 1.00 0.00 H new ATOM 0 HG22 ILE A 98 6.365 2.223 24.441 1.00 0.00 H new ATOM 0 HG23 ILE A 98 6.721 0.863 23.348 1.00 0.00 H new ATOM 0 HD11 ILE A 98 2.412 -1.277 23.210 1.00 0.00 H new ATOM 0 HD12 ILE A 98 2.640 -0.788 24.906 1.00 0.00 H new ATOM 0 HD13 ILE A 98 2.413 0.448 23.647 1.00 0.00 H new ATOM 1530 N TRP A 99 7.316 1.300 26.889 1.00 0.00 N ATOM 1531 CA TRP A 99 7.724 2.261 27.903 1.00 0.00 C ATOM 1532 C TRP A 99 8.963 3.034 27.453 1.00 0.00 C ATOM 1533 O TRP A 99 9.425 2.885 26.322 1.00 0.00 O ATOM 1534 CB TRP A 99 8.018 1.544 29.216 1.00 0.00 C ATOM 1535 CG TRP A 99 9.258 0.724 29.062 1.00 0.00 C ATOM 1536 CD1 TRP A 99 10.520 1.182 29.233 1.00 0.00 C ATOM 1537 CD2 TRP A 99 9.378 -0.681 28.704 1.00 0.00 C ATOM 1538 NE1 TRP A 99 11.404 0.144 29.014 1.00 0.00 N ATOM 1539 CE2 TRP A 99 10.749 -1.026 28.683 1.00 0.00 C ATOM 1540 CE3 TRP A 99 8.438 -1.681 28.402 1.00 0.00 C ATOM 1541 CZ2 TRP A 99 11.175 -2.318 28.374 1.00 0.00 C ATOM 1542 CZ3 TRP A 99 8.862 -2.982 28.088 1.00 0.00 C ATOM 1543 CH2 TRP A 99 10.228 -3.300 28.075 1.00 0.00 C ATOM 0 H TRP A 99 8.067 0.980 26.278 1.00 0.00 H new ATOM 0 HA TRP A 99 6.907 2.967 28.050 1.00 0.00 H new ATOM 0 HB2 TRP A 99 8.145 2.269 30.020 1.00 0.00 H new ATOM 0 HB3 TRP A 99 7.178 0.906 29.492 1.00 0.00 H new ATOM 0 HD1 TRP A 99 10.791 2.193 29.497 1.00 0.00 H new ATOM 0 HE1 TRP A 99 12.418 0.231 29.088 1.00 0.00 H new ATOM 0 HE3 TRP A 99 7.384 -1.447 28.412 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 12.228 -2.557 28.366 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 8.132 -3.743 27.855 1.00 0.00 H new ATOM 0 HH2 TRP A 99 10.547 -4.303 27.834 1.00 0.00 H new ATOM 1554 N ILE A 100 9.496 3.863 28.345 1.00 0.00 N ATOM 1555 CA ILE A 100 10.682 4.649 28.025 1.00 0.00 C ATOM 1556 C ILE A 100 11.709 4.534 29.148 1.00 0.00 C ATOM 1557 O ILE A 100 11.374 4.683 30.323 1.00 0.00 O ATOM 1558 CB ILE A 100 10.306 6.113 27.817 1.00 0.00 C ATOM 1559 CG1 ILE A 100 8.951 6.188 27.114 1.00 0.00 C ATOM 1560 CG2 ILE A 100 11.366 6.787 26.941 1.00 0.00 C ATOM 1561 CD1 ILE A 100 8.603 7.650 26.842 1.00 0.00 C ATOM 0 H ILE A 100 9.130 4.007 29.286 1.00 0.00 H new ATOM 0 HA ILE A 100 11.117 4.261 27.104 1.00 0.00 H new ATOM 0 HB ILE A 100 10.250 6.619 28.781 1.00 0.00 H new ATOM 0 HG12 ILE A 100 8.983 5.630 26.178 1.00 0.00 H new ATOM 0 HG13 ILE A 100 8.181 5.728 27.734 1.00 0.00 H new ATOM 0 HG21 ILE A 100 11.101 7.833 26.790 1.00 0.00 H new ATOM 0 HG22 ILE A 100 12.337 6.726 27.433 1.00 0.00 H new ATOM 0 HG23 ILE A 100 11.415 6.282 25.976 1.00 0.00 H new ATOM 0 HD11 ILE A 100 7.637 7.707 26.341 1.00 0.00 H new ATOM 0 HD12 ILE A 100 8.555 8.194 27.785 1.00 0.00 H new ATOM 0 HD13 ILE A 100 9.369 8.094 26.206 1.00 0.00 H new ATOM 1573 N THR A 101 12.955 4.271 28.777 1.00 0.00 N ATOM 1574 CA THR A 101 14.024 4.135 29.763 1.00 0.00 C ATOM 1575 C THR A 101 15.243 4.957 29.358 1.00 0.00 C ATOM 1576 O THR A 101 15.281 5.542 28.276 1.00 0.00 O ATOM 1577 CB THR A 101 14.423 2.666 29.914 1.00 0.00 C ATOM 1578 OG1 THR A 101 15.140 2.491 31.129 1.00 0.00 O ATOM 1579 CG2 THR A 101 15.299 2.256 28.734 1.00 0.00 C ATOM 0 H THR A 101 13.251 4.148 27.809 1.00 0.00 H new ATOM 0 HA THR A 101 13.652 4.507 30.718 1.00 0.00 H new ATOM 0 HB THR A 101 13.528 2.044 29.933 1.00 0.00 H new ATOM 0 HG1 THR A 101 15.238 1.534 31.316 1.00 0.00 H new ATOM 0 HG21 THR A 101 15.585 1.209 28.839 1.00 0.00 H new ATOM 0 HG22 THR A 101 14.744 2.389 27.805 1.00 0.00 H new ATOM 0 HG23 THR A 101 16.195 2.876 28.713 1.00 0.00 H new ATOM 1587 N HIS A 102 16.238 5.001 30.237 1.00 0.00 N ATOM 1588 CA HIS A 102 17.454 5.758 29.964 1.00 0.00 C ATOM 1589 C HIS A 102 18.335 5.012 28.967 1.00 0.00 C ATOM 1590 O HIS A 102 18.285 3.786 28.877 1.00 0.00 O ATOM 1591 CB HIS A 102 18.233 5.991 31.260 1.00 0.00 C ATOM 1592 CG HIS A 102 19.023 7.267 31.149 1.00 0.00 C ATOM 1593 ND1 HIS A 102 20.073 7.412 30.257 1.00 0.00 N ATOM 1594 CD2 HIS A 102 18.926 8.465 31.813 1.00 0.00 C ATOM 1595 CE1 HIS A 102 20.563 8.656 30.406 1.00 0.00 C ATOM 1596 NE2 HIS A 102 19.900 9.340 31.341 1.00 0.00 N ATOM 0 H HIS A 102 16.227 4.525 31.139 1.00 0.00 H new ATOM 0 HA HIS A 102 17.170 6.720 29.536 1.00 0.00 H new ATOM 0 HB2 HIS A 102 17.546 6.049 32.104 1.00 0.00 H new ATOM 0 HB3 HIS A 102 18.902 5.152 31.450 1.00 0.00 H new ATOM 0 HD2 HIS A 102 18.204 8.693 32.583 1.00 0.00 H new ATOM 0 HE1 HIS A 102 21.392 9.053 29.838 1.00 0.00 H new ATOM 0 HE2 HIS A 102 20.071 10.299 31.645 1.00 0.00 H new ATOM 1604 N ALA A 103 19.141 5.761 28.224 1.00 0.00 N ATOM 1605 CA ALA A 103 20.031 5.160 27.236 1.00 0.00 C ATOM 1606 C ALA A 103 21.044 4.245 27.913 1.00 0.00 C ATOM 1607 O ALA A 103 21.562 3.312 27.300 1.00 0.00 O ATOM 1608 CB ALA A 103 20.765 6.255 26.463 1.00 0.00 C ATOM 0 H ALA A 103 19.197 6.778 28.285 1.00 0.00 H new ATOM 0 HA ALA A 103 19.431 4.568 26.545 1.00 0.00 H new ATOM 0 HB1 ALA A 103 21.428 5.799 25.727 1.00 0.00 H new ATOM 0 HB2 ALA A 103 20.040 6.890 25.954 1.00 0.00 H new ATOM 0 HB3 ALA A 103 21.352 6.858 27.156 1.00 0.00 H new ATOM 1614 N ASP A 104 21.325 4.520 29.182 1.00 0.00 N ATOM 1615 CA ASP A 104 22.282 3.717 29.934 1.00 0.00 C ATOM 1616 C ASP A 104 21.595 2.500 30.548 1.00 0.00 C ATOM 1617 O ASP A 104 22.178 1.799 31.373 1.00 0.00 O ATOM 1618 CB ASP A 104 22.917 4.561 31.041 1.00 0.00 C ATOM 1619 CG ASP A 104 23.687 5.727 30.431 1.00 0.00 C ATOM 1620 OD1 ASP A 104 23.948 5.680 29.240 1.00 0.00 O ATOM 1621 OD2 ASP A 104 24.000 6.652 31.161 1.00 0.00 O ATOM 0 H ASP A 104 20.907 5.287 29.708 1.00 0.00 H new ATOM 0 HA ASP A 104 23.058 3.375 29.249 1.00 0.00 H new ATOM 0 HB2 ASP A 104 22.144 4.936 31.712 1.00 0.00 H new ATOM 0 HB3 ASP A 104 23.588 3.945 31.640 1.00 0.00 H new ATOM 1626 N ASP A 105 20.351 2.258 30.141 1.00 0.00 N ATOM 1627 CA ASP A 105 19.594 1.123 30.662 1.00 0.00 C ATOM 1628 C ASP A 105 19.972 -0.154 29.919 1.00 0.00 C ATOM 1629 O ASP A 105 19.371 -0.494 28.901 1.00 0.00 O ATOM 1630 CB ASP A 105 18.096 1.382 30.497 1.00 0.00 C ATOM 1631 CG ASP A 105 17.304 0.423 31.377 1.00 0.00 C ATOM 1632 OD1 ASP A 105 17.834 0.011 32.395 1.00 0.00 O ATOM 1633 OD2 ASP A 105 16.180 0.112 31.018 1.00 0.00 O ATOM 0 H ASP A 105 19.850 2.827 29.459 1.00 0.00 H new ATOM 0 HA ASP A 105 19.831 1.002 31.719 1.00 0.00 H new ATOM 0 HB2 ASP A 105 17.864 2.412 30.767 1.00 0.00 H new ATOM 0 HB3 ASP A 105 17.809 1.253 29.453 1.00 0.00 H new ATOM 1638 N ARG A 106 20.972 -0.858 30.441 1.00 0.00 N ATOM 1639 CA ARG A 106 21.426 -2.100 29.823 1.00 0.00 C ATOM 1640 C ARG A 106 20.362 -3.184 29.970 1.00 0.00 C ATOM 1641 O ARG A 106 20.339 -4.155 29.208 1.00 0.00 O ATOM 1642 CB ARG A 106 22.730 -2.561 30.476 1.00 0.00 C ATOM 1643 CG ARG A 106 22.561 -2.583 31.998 1.00 0.00 C ATOM 1644 CD ARG A 106 23.453 -1.510 32.625 1.00 0.00 C ATOM 1645 NE ARG A 106 23.332 -1.540 34.078 1.00 0.00 N ATOM 1646 CZ ARG A 106 24.019 -0.695 34.841 1.00 0.00 C ATOM 1647 NH1 ARG A 106 24.819 0.178 34.292 1.00 0.00 N ATOM 1648 NH2 ARG A 106 23.894 -0.741 36.139 1.00 0.00 N ATOM 0 H ARG A 106 21.480 -0.592 31.284 1.00 0.00 H new ATOM 0 HA ARG A 106 21.600 -1.920 28.762 1.00 0.00 H new ATOM 0 HB2 ARG A 106 22.998 -3.554 30.115 1.00 0.00 H new ATOM 0 HB3 ARG A 106 23.544 -1.891 30.200 1.00 0.00 H new ATOM 0 HG2 ARG A 106 21.519 -2.404 32.262 1.00 0.00 H new ATOM 0 HG3 ARG A 106 22.825 -3.565 32.390 1.00 0.00 H new ATOM 0 HD2 ARG A 106 24.491 -1.675 32.336 1.00 0.00 H new ATOM 0 HD3 ARG A 106 23.170 -0.527 32.250 1.00 0.00 H new ATOM 0 HE ARG A 106 22.711 -2.220 34.516 1.00 0.00 H new ATOM 0 HH11 ARG A 106 24.917 0.212 33.277 1.00 0.00 H new ATOM 0 HH12 ARG A 106 25.346 0.826 34.878 1.00 0.00 H new ATOM 0 HH21 ARG A 106 23.270 -1.425 36.567 1.00 0.00 H new ATOM 0 HH22 ARG A 106 24.420 -0.093 36.725 1.00 0.00 H new ATOM 1662 N THR A 107 19.480 -3.005 30.951 1.00 0.00 N ATOM 1663 CA THR A 107 18.410 -3.966 31.196 1.00 0.00 C ATOM 1664 C THR A 107 17.695 -4.307 29.895 1.00 0.00 C ATOM 1665 O THR A 107 16.896 -5.242 29.840 1.00 0.00 O ATOM 1666 CB THR A 107 17.406 -3.383 32.185 1.00 0.00 C ATOM 1667 OG1 THR A 107 16.642 -2.374 31.541 1.00 0.00 O ATOM 1668 CG2 THR A 107 18.150 -2.785 33.382 1.00 0.00 C ATOM 0 H THR A 107 19.486 -2.207 31.586 1.00 0.00 H new ATOM 0 HA THR A 107 18.848 -4.874 31.611 1.00 0.00 H new ATOM 0 HB THR A 107 16.741 -4.172 32.536 1.00 0.00 H new ATOM 0 HG1 THR A 107 16.110 -1.891 32.207 1.00 0.00 H new ATOM 0 HG21 THR A 107 17.430 -2.369 34.087 1.00 0.00 H new ATOM 0 HG22 THR A 107 18.732 -3.564 33.875 1.00 0.00 H new ATOM 0 HG23 THR A 107 18.818 -1.996 33.038 1.00 0.00 H new ATOM 1676 N VAL A 108 17.987 -3.539 28.854 1.00 0.00 N ATOM 1677 CA VAL A 108 17.367 -3.762 27.550 1.00 0.00 C ATOM 1678 C VAL A 108 18.391 -4.264 26.535 1.00 0.00 C ATOM 1679 O VAL A 108 18.033 -4.696 25.439 1.00 0.00 O ATOM 1680 CB VAL A 108 16.747 -2.461 27.048 1.00 0.00 C ATOM 1681 CG1 VAL A 108 16.025 -2.722 25.729 1.00 0.00 C ATOM 1682 CG2 VAL A 108 15.749 -1.944 28.084 1.00 0.00 C ATOM 0 H VAL A 108 18.645 -2.760 28.884 1.00 0.00 H new ATOM 0 HA VAL A 108 16.593 -4.521 27.664 1.00 0.00 H new ATOM 0 HB VAL A 108 17.528 -1.717 26.893 1.00 0.00 H new ATOM 0 HG11 VAL A 108 15.581 -1.795 25.368 1.00 0.00 H new ATOM 0 HG12 VAL A 108 16.737 -3.095 24.992 1.00 0.00 H new ATOM 0 HG13 VAL A 108 15.241 -3.463 25.884 1.00 0.00 H new ATOM 0 HG21 VAL A 108 15.304 -1.015 27.729 1.00 0.00 H new ATOM 0 HG22 VAL A 108 14.965 -2.686 28.236 1.00 0.00 H new ATOM 0 HG23 VAL A 108 16.265 -1.762 29.027 1.00 0.00 H new ATOM 1692 N ILE A 109 19.665 -4.199 26.904 1.00 0.00 N ATOM 1693 CA ILE A 109 20.733 -4.644 26.015 1.00 0.00 C ATOM 1694 C ILE A 109 21.407 -5.896 26.556 1.00 0.00 C ATOM 1695 O ILE A 109 22.446 -6.314 26.052 1.00 0.00 O ATOM 1696 CB ILE A 109 21.769 -3.538 25.852 1.00 0.00 C ATOM 1697 CG1 ILE A 109 21.075 -2.275 25.340 1.00 0.00 C ATOM 1698 CG2 ILE A 109 22.839 -3.981 24.852 1.00 0.00 C ATOM 1699 CD1 ILE A 109 20.372 -2.575 24.012 1.00 0.00 C ATOM 0 H ILE A 109 19.983 -3.845 27.806 1.00 0.00 H new ATOM 0 HA ILE A 109 20.292 -4.878 25.046 1.00 0.00 H new ATOM 0 HB ILE A 109 22.242 -3.332 26.812 1.00 0.00 H new ATOM 0 HG12 ILE A 109 20.351 -1.923 26.075 1.00 0.00 H new ATOM 0 HG13 ILE A 109 21.805 -1.477 25.204 1.00 0.00 H new ATOM 0 HG21 ILE A 109 23.579 -3.189 24.736 1.00 0.00 H new ATOM 0 HG22 ILE A 109 23.328 -4.884 25.218 1.00 0.00 H new ATOM 0 HG23 ILE A 109 22.373 -4.186 23.888 1.00 0.00 H new ATOM 0 HD11 ILE A 109 19.878 -1.673 23.650 1.00 0.00 H new ATOM 0 HD12 ILE A 109 21.107 -2.906 23.278 1.00 0.00 H new ATOM 0 HD13 ILE A 109 19.630 -3.359 24.162 1.00 0.00 H new ATOM 1711 N ILE A 110 20.810 -6.483 27.583 1.00 0.00 N ATOM 1712 CA ILE A 110 21.352 -7.694 28.192 1.00 0.00 C ATOM 1713 C ILE A 110 20.968 -8.926 27.378 1.00 0.00 C ATOM 1714 O ILE A 110 20.531 -8.816 26.234 1.00 0.00 O ATOM 1715 CB ILE A 110 20.830 -7.845 29.619 1.00 0.00 C ATOM 1716 CG1 ILE A 110 19.349 -8.221 29.600 1.00 0.00 C ATOM 1717 CG2 ILE A 110 21.008 -6.528 30.370 1.00 0.00 C ATOM 1718 CD1 ILE A 110 18.579 -7.174 28.816 1.00 0.00 C ATOM 0 H ILE A 110 19.950 -6.142 28.014 1.00 0.00 H new ATOM 0 HA ILE A 110 22.438 -7.607 28.210 1.00 0.00 H new ATOM 0 HB ILE A 110 21.392 -8.633 30.120 1.00 0.00 H new ATOM 0 HG12 ILE A 110 19.217 -9.203 29.146 1.00 0.00 H new ATOM 0 HG13 ILE A 110 18.965 -8.286 30.618 1.00 0.00 H new ATOM 0 HG21 ILE A 110 20.635 -6.637 31.388 1.00 0.00 H new ATOM 0 HG22 ILE A 110 22.065 -6.264 30.397 1.00 0.00 H new ATOM 0 HG23 ILE A 110 20.451 -5.741 29.862 1.00 0.00 H new ATOM 0 HD11 ILE A 110 17.521 -7.437 28.799 1.00 0.00 H new ATOM 0 HD12 ILE A 110 18.703 -6.200 29.290 1.00 0.00 H new ATOM 0 HD13 ILE A 110 18.959 -7.132 27.795 1.00 0.00 H new ATOM 1730 N LYS A 111 21.135 -10.101 27.979 1.00 0.00 N ATOM 1731 CA LYS A 111 20.804 -11.353 27.304 1.00 0.00 C ATOM 1732 C LYS A 111 19.414 -11.840 27.703 1.00 0.00 C ATOM 1733 O LYS A 111 18.883 -11.454 28.744 1.00 0.00 O ATOM 1734 CB LYS A 111 21.841 -12.418 27.656 1.00 0.00 C ATOM 1735 CG LYS A 111 21.965 -13.413 26.502 1.00 0.00 C ATOM 1736 CD LYS A 111 23.154 -14.344 26.753 1.00 0.00 C ATOM 1737 CE LYS A 111 23.270 -14.639 28.249 1.00 0.00 C ATOM 1738 NZ LYS A 111 24.299 -15.694 28.470 1.00 0.00 N ATOM 0 H LYS A 111 21.495 -10.213 28.927 1.00 0.00 H new ATOM 0 HA LYS A 111 20.810 -11.174 26.229 1.00 0.00 H new ATOM 0 HB2 LYS A 111 22.806 -11.950 27.852 1.00 0.00 H new ATOM 0 HB3 LYS A 111 21.548 -12.938 28.568 1.00 0.00 H new ATOM 0 HG2 LYS A 111 21.048 -13.995 26.410 1.00 0.00 H new ATOM 0 HG3 LYS A 111 22.100 -12.879 25.561 1.00 0.00 H new ATOM 0 HD2 LYS A 111 23.024 -15.273 26.198 1.00 0.00 H new ATOM 0 HD3 LYS A 111 24.073 -13.882 26.391 1.00 0.00 H new ATOM 0 HE2 LYS A 111 23.542 -13.732 28.789 1.00 0.00 H new ATOM 0 HE3 LYS A 111 22.307 -14.967 28.641 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 24.378 -15.894 29.487 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 24.021 -16.561 27.967 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 25.217 -15.364 28.110 1.00 0.00 H new ATOM 1752 N LYS A 112 18.831 -12.693 26.865 1.00 0.00 N ATOM 1753 CA LYS A 112 17.505 -13.231 27.137 1.00 0.00 C ATOM 1754 C LYS A 112 17.532 -14.755 27.083 1.00 0.00 C ATOM 1755 O LYS A 112 18.600 -15.364 27.051 1.00 0.00 O ATOM 1756 CB LYS A 112 16.505 -12.712 26.106 1.00 0.00 C ATOM 1757 CG LYS A 112 16.474 -11.184 26.139 1.00 0.00 C ATOM 1758 CD LYS A 112 15.630 -10.711 27.326 1.00 0.00 C ATOM 1759 CE LYS A 112 15.514 -9.185 27.298 1.00 0.00 C ATOM 1760 NZ LYS A 112 14.482 -8.748 28.282 1.00 0.00 N ATOM 0 H LYS A 112 19.254 -13.024 25.998 1.00 0.00 H new ATOM 0 HA LYS A 112 17.202 -12.909 28.133 1.00 0.00 H new ATOM 0 HB2 LYS A 112 16.783 -13.058 25.110 1.00 0.00 H new ATOM 0 HB3 LYS A 112 15.512 -13.110 26.316 1.00 0.00 H new ATOM 0 HG2 LYS A 112 17.488 -10.792 26.222 1.00 0.00 H new ATOM 0 HG3 LYS A 112 16.058 -10.799 25.208 1.00 0.00 H new ATOM 0 HD2 LYS A 112 14.639 -11.162 27.283 1.00 0.00 H new ATOM 0 HD3 LYS A 112 16.087 -11.034 28.262 1.00 0.00 H new ATOM 0 HE2 LYS A 112 16.476 -8.732 27.538 1.00 0.00 H new ATOM 0 HE3 LYS A 112 15.244 -8.848 26.297 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 14.402 -7.711 28.264 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 13.565 -9.170 28.034 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 14.759 -9.057 29.236 1.00 0.00 H new ATOM 1774 N GLU A 113 16.352 -15.361 27.068 1.00 0.00 N ATOM 1775 CA GLU A 113 16.250 -16.814 27.010 1.00 0.00 C ATOM 1776 C GLU A 113 15.142 -17.231 26.053 1.00 0.00 C ATOM 1777 O GLU A 113 14.681 -18.373 26.081 1.00 0.00 O ATOM 1778 CB GLU A 113 15.966 -17.377 28.405 1.00 0.00 C ATOM 1779 CG GLU A 113 17.269 -17.886 29.022 1.00 0.00 C ATOM 1780 CD GLU A 113 17.671 -19.207 28.372 1.00 0.00 C ATOM 1781 OE1 GLU A 113 16.801 -19.863 27.823 1.00 0.00 O ATOM 1782 OE2 GLU A 113 18.841 -19.545 28.435 1.00 0.00 O ATOM 0 H GLU A 113 15.457 -14.873 27.095 1.00 0.00 H new ATOM 0 HA GLU A 113 17.198 -17.213 26.648 1.00 0.00 H new ATOM 0 HB2 GLU A 113 15.528 -16.606 29.038 1.00 0.00 H new ATOM 0 HB3 GLU A 113 15.240 -18.187 28.341 1.00 0.00 H new ATOM 0 HG2 GLU A 113 18.059 -17.148 28.885 1.00 0.00 H new ATOM 0 HG3 GLU A 113 17.144 -18.023 30.096 1.00 0.00 H new ATOM 1789 N GLU A 114 14.712 -16.298 25.209 1.00 0.00 N ATOM 1790 CA GLU A 114 13.648 -16.583 24.252 1.00 0.00 C ATOM 1791 C GLU A 114 13.638 -15.541 23.137 1.00 0.00 C ATOM 1792 O GLU A 114 14.318 -14.519 23.220 1.00 0.00 O ATOM 1793 CB GLU A 114 12.289 -16.587 24.966 1.00 0.00 C ATOM 1794 CG GLU A 114 12.481 -16.282 26.452 1.00 0.00 C ATOM 1795 CD GLU A 114 11.144 -15.912 27.084 1.00 0.00 C ATOM 1796 OE1 GLU A 114 10.194 -15.717 26.344 1.00 0.00 O ATOM 1797 OE2 GLU A 114 11.092 -15.831 28.299 1.00 0.00 O ATOM 0 H GLU A 114 15.079 -15.347 25.168 1.00 0.00 H new ATOM 0 HA GLU A 114 13.830 -17.565 23.814 1.00 0.00 H new ATOM 0 HB2 GLU A 114 11.630 -15.845 24.516 1.00 0.00 H new ATOM 0 HB3 GLU A 114 11.807 -17.557 24.844 1.00 0.00 H new ATOM 0 HG2 GLU A 114 12.904 -17.149 26.958 1.00 0.00 H new ATOM 0 HG3 GLU A 114 13.190 -15.463 26.575 1.00 0.00 H new ATOM 1804 N PRO A 115 12.878 -15.787 22.105 1.00 0.00 N ATOM 1805 CA PRO A 115 12.758 -14.861 20.939 1.00 0.00 C ATOM 1806 C PRO A 115 12.010 -13.584 21.304 1.00 0.00 C ATOM 1807 O PRO A 115 10.781 -13.506 21.192 1.00 0.00 O ATOM 1808 CB PRO A 115 11.981 -15.662 19.903 1.00 0.00 C ATOM 1809 CG PRO A 115 11.259 -16.709 20.669 1.00 0.00 C ATOM 1810 CD PRO A 115 12.050 -16.983 21.943 1.00 0.00 C ATOM 0 HA PRO A 115 13.734 -14.534 20.579 1.00 0.00 H new ATOM 0 HB2 PRO A 115 11.285 -15.026 19.357 1.00 0.00 H new ATOM 0 HB3 PRO A 115 12.651 -16.106 19.167 1.00 0.00 H new ATOM 0 HG2 PRO A 115 10.249 -16.378 20.910 1.00 0.00 H new ATOM 0 HG3 PRO A 115 11.163 -17.618 20.076 1.00 0.00 H new ATOM 0 HD2 PRO A 115 11.391 -17.132 22.798 1.00 0.00 H new ATOM 0 HD3 PRO A 115 12.660 -17.882 21.850 1.00 0.00 H new ATOM 1818 N ILE A 116 12.767 -12.589 21.741 1.00 0.00 N ATOM 1819 CA ILE A 116 12.185 -11.304 22.133 1.00 0.00 C ATOM 1820 C ILE A 116 12.785 -10.161 21.321 1.00 0.00 C ATOM 1821 O ILE A 116 14.003 -10.069 21.169 1.00 0.00 O ATOM 1822 CB ILE A 116 12.426 -11.046 23.619 1.00 0.00 C ATOM 1823 CG1 ILE A 116 11.839 -12.199 24.432 1.00 0.00 C ATOM 1824 CG2 ILE A 116 11.744 -9.737 24.029 1.00 0.00 C ATOM 1825 CD1 ILE A 116 10.343 -12.329 24.139 1.00 0.00 C ATOM 0 H ILE A 116 13.781 -12.641 21.835 1.00 0.00 H new ATOM 0 HA ILE A 116 11.114 -11.350 21.938 1.00 0.00 H new ATOM 0 HB ILE A 116 13.497 -10.971 23.807 1.00 0.00 H new ATOM 0 HG12 ILE A 116 12.350 -13.129 24.183 1.00 0.00 H new ATOM 0 HG13 ILE A 116 11.997 -12.023 25.496 1.00 0.00 H new ATOM 0 HG21 ILE A 116 11.916 -9.554 25.090 1.00 0.00 H new ATOM 0 HG22 ILE A 116 12.157 -8.914 23.446 1.00 0.00 H new ATOM 0 HG23 ILE A 116 10.673 -9.811 23.843 1.00 0.00 H new ATOM 0 HD11 ILE A 116 9.929 -13.152 24.721 1.00 0.00 H new ATOM 0 HD12 ILE A 116 9.837 -11.402 24.410 1.00 0.00 H new ATOM 0 HD13 ILE A 116 10.196 -12.525 23.077 1.00 0.00 H new ATOM 1837 N LEU A 117 11.920 -9.289 20.809 1.00 0.00 N ATOM 1838 CA LEU A 117 12.376 -8.152 20.022 1.00 0.00 C ATOM 1839 C LEU A 117 12.204 -6.854 20.800 1.00 0.00 C ATOM 1840 O LEU A 117 11.106 -6.521 21.245 1.00 0.00 O ATOM 1841 CB LEU A 117 11.593 -8.076 18.710 1.00 0.00 C ATOM 1842 CG LEU A 117 12.022 -6.834 17.920 1.00 0.00 C ATOM 1843 CD1 LEU A 117 11.943 -7.131 16.421 1.00 0.00 C ATOM 1844 CD2 LEU A 117 11.084 -5.668 18.253 1.00 0.00 C ATOM 0 H LEU A 117 10.908 -9.349 20.925 1.00 0.00 H new ATOM 0 HA LEU A 117 13.435 -8.289 19.803 1.00 0.00 H new ATOM 0 HB2 LEU A 117 11.770 -8.974 18.118 1.00 0.00 H new ATOM 0 HB3 LEU A 117 10.523 -8.036 18.916 1.00 0.00 H new ATOM 0 HG LEU A 117 13.045 -6.570 18.188 1.00 0.00 H new ATOM 0 HD11 LEU A 117 12.248 -6.248 15.859 1.00 0.00 H new ATOM 0 HD12 LEU A 117 12.606 -7.962 16.179 1.00 0.00 H new ATOM 0 HD13 LEU A 117 10.919 -7.394 16.156 1.00 0.00 H new ATOM 0 HD21 LEU A 117 11.388 -4.785 17.692 1.00 0.00 H new ATOM 0 HD22 LEU A 117 10.062 -5.935 17.984 1.00 0.00 H new ATOM 0 HD23 LEU A 117 11.134 -5.454 19.321 1.00 0.00 H new ATOM 1856 N THR A 118 13.300 -6.129 20.961 1.00 0.00 N ATOM 1857 CA THR A 118 13.265 -4.861 21.687 1.00 0.00 C ATOM 1858 C THR A 118 13.775 -3.729 20.803 1.00 0.00 C ATOM 1859 O THR A 118 14.851 -3.826 20.222 1.00 0.00 O ATOM 1860 CB THR A 118 14.118 -4.953 22.951 1.00 0.00 C ATOM 1861 OG1 THR A 118 13.610 -5.982 23.786 1.00 0.00 O ATOM 1862 CG2 THR A 118 14.067 -3.620 23.695 1.00 0.00 C ATOM 0 H THR A 118 14.219 -6.390 20.604 1.00 0.00 H new ATOM 0 HA THR A 118 12.233 -4.653 21.968 1.00 0.00 H new ATOM 0 HB THR A 118 15.150 -5.179 22.682 1.00 0.00 H new ATOM 0 HG1 THR A 118 14.156 -6.045 24.597 1.00 0.00 H new ATOM 0 HG21 THR A 118 14.675 -3.683 24.597 1.00 0.00 H new ATOM 0 HG22 THR A 118 14.453 -2.829 23.052 1.00 0.00 H new ATOM 0 HG23 THR A 118 13.036 -3.395 23.967 1.00 0.00 H new ATOM 1870 N LEU A 119 12.997 -2.658 20.703 1.00 0.00 N ATOM 1871 CA LEU A 119 13.392 -1.523 19.874 1.00 0.00 C ATOM 1872 C LEU A 119 13.713 -0.305 20.734 1.00 0.00 C ATOM 1873 O LEU A 119 12.901 0.109 21.561 1.00 0.00 O ATOM 1874 CB LEU A 119 12.256 -1.167 18.912 1.00 0.00 C ATOM 1875 CG LEU A 119 12.788 -0.279 17.788 1.00 0.00 C ATOM 1876 CD1 LEU A 119 11.694 -0.090 16.738 1.00 0.00 C ATOM 1877 CD2 LEU A 119 13.185 1.085 18.353 1.00 0.00 C ATOM 0 H LEU A 119 12.101 -2.550 21.178 1.00 0.00 H new ATOM 0 HA LEU A 119 14.284 -1.805 19.315 1.00 0.00 H new ATOM 0 HB2 LEU A 119 11.822 -2.076 18.495 1.00 0.00 H new ATOM 0 HB3 LEU A 119 11.460 -0.651 19.450 1.00 0.00 H new ATOM 0 HG LEU A 119 13.660 -0.750 17.335 1.00 0.00 H new ATOM 0 HD11 LEU A 119 12.068 0.543 15.933 1.00 0.00 H new ATOM 0 HD12 LEU A 119 11.407 -1.060 16.333 1.00 0.00 H new ATOM 0 HD13 LEU A 119 10.826 0.382 17.198 1.00 0.00 H new ATOM 0 HD21 LEU A 119 13.564 1.716 17.549 1.00 0.00 H new ATOM 0 HD22 LEU A 119 12.314 1.559 18.806 1.00 0.00 H new ATOM 0 HD23 LEU A 119 13.961 0.954 19.108 1.00 0.00 H new ATOM 1889 N THR A 120 14.896 0.268 20.525 1.00 0.00 N ATOM 1890 CA THR A 120 15.307 1.444 21.274 1.00 0.00 C ATOM 1891 C THR A 120 15.610 2.603 20.327 1.00 0.00 C ATOM 1892 O THR A 120 16.606 2.593 19.603 1.00 0.00 O ATOM 1893 CB THR A 120 16.532 1.126 22.117 1.00 0.00 C ATOM 1894 OG1 THR A 120 17.637 1.905 21.671 1.00 0.00 O ATOM 1895 CG2 THR A 120 16.867 -0.363 22.002 1.00 0.00 C ATOM 0 H THR A 120 15.581 -0.064 19.846 1.00 0.00 H new ATOM 0 HA THR A 120 14.490 1.738 21.933 1.00 0.00 H new ATOM 0 HB THR A 120 16.322 1.365 23.160 1.00 0.00 H new ATOM 0 HG1 THR A 120 17.753 1.785 20.705 1.00 0.00 H new ATOM 0 HG21 THR A 120 17.745 -0.586 22.608 1.00 0.00 H new ATOM 0 HG22 THR A 120 16.022 -0.954 22.356 1.00 0.00 H new ATOM 0 HG23 THR A 120 17.072 -0.610 20.960 1.00 0.00 H new ATOM 1903 N THR A 121 14.741 3.600 20.331 1.00 0.00 N ATOM 1904 CA THR A 121 14.920 4.752 19.458 1.00 0.00 C ATOM 1905 C THR A 121 14.654 6.048 20.202 1.00 0.00 C ATOM 1906 O THR A 121 14.254 6.036 21.363 1.00 0.00 O ATOM 1907 CB THR A 121 13.969 4.648 18.269 1.00 0.00 C ATOM 1908 OG1 THR A 121 13.904 5.899 17.595 1.00 0.00 O ATOM 1909 CG2 THR A 121 12.578 4.260 18.767 1.00 0.00 C ATOM 0 H THR A 121 13.911 3.637 20.923 1.00 0.00 H new ATOM 0 HA THR A 121 15.953 4.758 19.110 1.00 0.00 H new ATOM 0 HB THR A 121 14.334 3.888 17.578 1.00 0.00 H new ATOM 0 HG1 THR A 121 14.783 6.331 17.622 1.00 0.00 H new ATOM 0 HG21 THR A 121 11.896 4.185 17.920 1.00 0.00 H new ATOM 0 HG22 THR A 121 12.630 3.298 19.278 1.00 0.00 H new ATOM 0 HG23 THR A 121 12.214 5.019 19.459 1.00 0.00 H new ATOM 2078 N ASP A 133 16.590 9.735 27.223 1.00 0.00 N ATOM 2079 CA ASP A 133 15.498 8.768 27.306 1.00 0.00 C ATOM 2080 C ASP A 133 15.237 8.145 25.939 1.00 0.00 C ATOM 2081 O ASP A 133 15.027 8.856 24.955 1.00 0.00 O ATOM 2082 CB ASP A 133 14.227 9.449 27.816 1.00 0.00 C ATOM 2083 CG ASP A 133 14.379 9.790 29.295 1.00 0.00 C ATOM 2084 OD1 ASP A 133 15.303 9.281 29.908 1.00 0.00 O ATOM 2085 OD2 ASP A 133 13.567 10.553 29.793 1.00 0.00 O ATOM 0 HA ASP A 133 15.785 7.981 28.004 1.00 0.00 H new ATOM 0 HB2 ASP A 133 14.035 10.356 27.243 1.00 0.00 H new ATOM 0 HB3 ASP A 133 13.369 8.792 27.671 1.00 0.00 H new ATOM 2090 N ARG A 134 15.255 6.815 25.883 1.00 0.00 N ATOM 2091 CA ARG A 134 15.021 6.116 24.626 1.00 0.00 C ATOM 2092 C ARG A 134 13.721 5.318 24.687 1.00 0.00 C ATOM 2093 O ARG A 134 13.395 4.719 25.713 1.00 0.00 O ATOM 2094 CB ARG A 134 16.190 5.180 24.321 1.00 0.00 C ATOM 2095 CG ARG A 134 17.505 5.951 24.446 1.00 0.00 C ATOM 2096 CD ARG A 134 18.559 5.316 23.537 1.00 0.00 C ATOM 2097 NE ARG A 134 18.948 4.006 24.046 1.00 0.00 N ATOM 2098 CZ ARG A 134 19.723 3.196 23.332 1.00 0.00 C ATOM 2099 NH1 ARG A 134 20.147 3.568 22.154 1.00 0.00 N ATOM 2100 NH2 ARG A 134 20.061 2.030 23.808 1.00 0.00 N ATOM 0 H ARG A 134 15.427 6.208 26.684 1.00 0.00 H new ATOM 0 HA ARG A 134 14.937 6.857 23.831 1.00 0.00 H new ATOM 0 HB2 ARG A 134 16.184 4.336 25.011 1.00 0.00 H new ATOM 0 HB3 ARG A 134 16.090 4.771 23.316 1.00 0.00 H new ATOM 0 HG2 ARG A 134 17.354 6.995 24.171 1.00 0.00 H new ATOM 0 HG3 ARG A 134 17.848 5.940 25.481 1.00 0.00 H new ATOM 0 HD2 ARG A 134 18.164 5.218 22.526 1.00 0.00 H new ATOM 0 HD3 ARG A 134 19.434 5.964 23.476 1.00 0.00 H new ATOM 0 HE ARG A 134 18.620 3.707 24.964 1.00 0.00 H new ATOM 0 HH11 ARG A 134 19.883 4.480 21.782 1.00 0.00 H new ATOM 0 HH12 ARG A 134 20.742 2.946 21.606 1.00 0.00 H new ATOM 0 HH21 ARG A 134 19.731 1.740 24.728 1.00 0.00 H new ATOM 0 HH22 ARG A 134 20.656 1.408 23.260 1.00 0.00 H new ATOM 2114 N TYR A 135 12.980 5.317 23.584 1.00 0.00 N ATOM 2115 CA TYR A 135 11.707 4.595 23.534 1.00 0.00 C ATOM 2116 C TYR A 135 11.969 3.099 23.432 1.00 0.00 C ATOM 2117 O TYR A 135 12.731 2.664 22.576 1.00 0.00 O ATOM 2118 CB TYR A 135 10.887 5.063 22.333 1.00 0.00 C ATOM 2119 CG TYR A 135 9.422 4.947 22.657 1.00 0.00 C ATOM 2120 CD1 TYR A 135 8.868 5.750 23.661 1.00 0.00 C ATOM 2121 CD2 TYR A 135 8.620 4.039 21.965 1.00 0.00 C ATOM 2122 CE1 TYR A 135 7.505 5.646 23.968 1.00 0.00 C ATOM 2123 CE2 TYR A 135 7.257 3.931 22.270 1.00 0.00 C ATOM 2124 CZ TYR A 135 6.699 4.737 23.273 1.00 0.00 C ATOM 2125 OH TYR A 135 5.355 4.635 23.574 1.00 0.00 O ATOM 0 H TYR A 135 13.231 5.800 22.722 1.00 0.00 H new ATOM 0 HA TYR A 135 11.145 4.799 24.446 1.00 0.00 H new ATOM 0 HB2 TYR A 135 11.137 6.095 22.087 1.00 0.00 H new ATOM 0 HB3 TYR A 135 11.127 4.460 21.457 1.00 0.00 H new ATOM 0 HD1 TYR A 135 9.491 6.449 24.199 1.00 0.00 H new ATOM 0 HD2 TYR A 135 9.051 3.418 21.193 1.00 0.00 H new ATOM 0 HE1 TYR A 135 7.076 6.267 24.741 1.00 0.00 H new ATOM 0 HE2 TYR A 135 6.637 3.228 21.734 1.00 0.00 H new ATOM 0 HH TYR A 135 5.024 5.501 23.891 1.00 0.00 H new ATOM 2135 N ILE A 136 11.346 2.318 24.314 1.00 0.00 N ATOM 2136 CA ILE A 136 11.555 0.876 24.306 1.00 0.00 C ATOM 2137 C ILE A 136 10.291 0.123 23.897 1.00 0.00 C ATOM 2138 O ILE A 136 9.270 0.179 24.583 1.00 0.00 O ATOM 2139 CB ILE A 136 11.957 0.419 25.712 1.00 0.00 C ATOM 2140 CG1 ILE A 136 13.086 1.314 26.240 1.00 0.00 C ATOM 2141 CG2 ILE A 136 12.446 -1.034 25.663 1.00 0.00 C ATOM 2142 CD1 ILE A 136 14.369 1.076 25.443 1.00 0.00 C ATOM 0 H ILE A 136 10.703 2.655 25.031 1.00 0.00 H new ATOM 0 HA ILE A 136 12.339 0.657 23.581 1.00 0.00 H new ATOM 0 HB ILE A 136 11.093 0.491 26.373 1.00 0.00 H new ATOM 0 HG12 ILE A 136 12.793 2.361 26.167 1.00 0.00 H new ATOM 0 HG13 ILE A 136 13.261 1.105 27.295 1.00 0.00 H new ATOM 0 HG21 ILE A 136 12.731 -1.356 26.665 1.00 0.00 H new ATOM 0 HG22 ILE A 136 11.647 -1.674 25.290 1.00 0.00 H new ATOM 0 HG23 ILE A 136 13.308 -1.106 25.000 1.00 0.00 H new ATOM 0 HD11 ILE A 136 15.161 1.718 25.829 1.00 0.00 H new ATOM 0 HD12 ILE A 136 14.668 0.032 25.539 1.00 0.00 H new ATOM 0 HD13 ILE A 136 14.193 1.308 24.393 1.00 0.00 H new ATOM 2154 N ILE A 137 10.371 -0.597 22.785 1.00 0.00 N ATOM 2155 CA ILE A 137 9.233 -1.383 22.321 1.00 0.00 C ATOM 2156 C ILE A 137 9.508 -2.864 22.546 1.00 0.00 C ATOM 2157 O ILE A 137 10.316 -3.464 21.838 1.00 0.00 O ATOM 2158 CB ILE A 137 8.996 -1.129 20.833 1.00 0.00 C ATOM 2159 CG1 ILE A 137 9.031 0.376 20.569 1.00 0.00 C ATOM 2160 CG2 ILE A 137 7.632 -1.691 20.426 1.00 0.00 C ATOM 2161 CD1 ILE A 137 7.827 1.038 21.236 1.00 0.00 C ATOM 0 H ILE A 137 11.200 -0.654 22.194 1.00 0.00 H new ATOM 0 HA ILE A 137 8.345 -1.088 22.881 1.00 0.00 H new ATOM 0 HB ILE A 137 9.774 -1.621 20.249 1.00 0.00 H new ATOM 0 HG12 ILE A 137 9.956 0.803 20.957 1.00 0.00 H new ATOM 0 HG13 ILE A 137 9.017 0.568 19.496 1.00 0.00 H new ATOM 0 HG21 ILE A 137 7.465 -1.509 19.364 1.00 0.00 H new ATOM 0 HG22 ILE A 137 7.609 -2.764 20.618 1.00 0.00 H new ATOM 0 HG23 ILE A 137 6.849 -1.202 21.005 1.00 0.00 H new ATOM 0 HD11 ILE A 137 7.852 2.111 21.048 1.00 0.00 H new ATOM 0 HD12 ILE A 137 6.908 0.619 20.826 1.00 0.00 H new ATOM 0 HD13 ILE A 137 7.861 0.857 22.310 1.00 0.00 H new ATOM 2173 N GLU A 138 8.831 -3.446 23.532 1.00 0.00 N ATOM 2174 CA GLU A 138 9.014 -4.860 23.841 1.00 0.00 C ATOM 2175 C GLU A 138 7.998 -5.714 23.098 1.00 0.00 C ATOM 2176 O GLU A 138 6.805 -5.411 23.078 1.00 0.00 O ATOM 2177 CB GLU A 138 8.869 -5.086 25.346 1.00 0.00 C ATOM 2178 CG GLU A 138 9.060 -6.573 25.666 1.00 0.00 C ATOM 2179 CD GLU A 138 8.957 -6.804 27.173 1.00 0.00 C ATOM 2180 OE1 GLU A 138 8.531 -5.895 27.865 1.00 0.00 O ATOM 2181 OE2 GLU A 138 9.303 -7.889 27.610 1.00 0.00 O ATOM 0 H GLU A 138 8.156 -2.965 24.126 1.00 0.00 H new ATOM 0 HA GLU A 138 10.014 -5.153 23.521 1.00 0.00 H new ATOM 0 HB2 GLU A 138 9.605 -4.491 25.886 1.00 0.00 H new ATOM 0 HB3 GLU A 138 7.885 -4.756 25.680 1.00 0.00 H new ATOM 0 HG2 GLU A 138 8.305 -7.164 25.147 1.00 0.00 H new ATOM 0 HG3 GLU A 138 10.032 -6.909 25.304 1.00 0.00 H new ATOM 2188 N ALA A 139 8.483 -6.785 22.486 1.00 0.00 N ATOM 2189 CA ALA A 139 7.607 -7.684 21.740 1.00 0.00 C ATOM 2190 C ALA A 139 8.091 -9.128 21.845 1.00 0.00 C ATOM 2191 O ALA A 139 9.291 -9.390 21.894 1.00 0.00 O ATOM 2192 CB ALA A 139 7.554 -7.268 20.269 1.00 0.00 C ATOM 0 H ALA A 139 9.467 -7.053 22.489 1.00 0.00 H new ATOM 0 HA ALA A 139 6.609 -7.618 22.172 1.00 0.00 H new ATOM 0 HB1 ALA A 139 6.898 -7.946 19.723 1.00 0.00 H new ATOM 0 HB2 ALA A 139 7.170 -6.251 20.192 1.00 0.00 H new ATOM 0 HB3 ALA A 139 8.556 -7.311 19.842 1.00 0.00 H new ATOM 2198 N LYS A 140 7.144 -10.060 21.875 1.00 0.00 N ATOM 2199 CA LYS A 140 7.478 -11.478 21.970 1.00 0.00 C ATOM 2200 C LYS A 140 7.004 -12.234 20.738 1.00 0.00 C ATOM 2201 O LYS A 140 6.038 -11.835 20.091 1.00 0.00 O ATOM 2202 CB LYS A 140 6.834 -12.090 23.218 1.00 0.00 C ATOM 2203 CG LYS A 140 6.898 -13.616 23.132 1.00 0.00 C ATOM 2204 CD LYS A 140 6.310 -14.216 24.411 1.00 0.00 C ATOM 2205 CE LYS A 140 6.426 -15.736 24.356 1.00 0.00 C ATOM 2206 NZ LYS A 140 5.504 -16.270 23.312 1.00 0.00 N ATOM 0 H LYS A 140 6.144 -9.861 21.835 1.00 0.00 H new ATOM 0 HA LYS A 140 8.563 -11.562 22.038 1.00 0.00 H new ATOM 0 HB2 LYS A 140 7.351 -11.744 24.113 1.00 0.00 H new ATOM 0 HB3 LYS A 140 5.797 -11.763 23.302 1.00 0.00 H new ATOM 0 HG2 LYS A 140 6.342 -13.967 22.262 1.00 0.00 H new ATOM 0 HG3 LYS A 140 7.930 -13.942 23.004 1.00 0.00 H new ATOM 0 HD2 LYS A 140 6.839 -13.831 25.283 1.00 0.00 H new ATOM 0 HD3 LYS A 140 5.265 -13.923 24.517 1.00 0.00 H new ATOM 0 HE2 LYS A 140 7.453 -16.025 24.131 1.00 0.00 H new ATOM 0 HE3 LYS A 140 6.180 -16.165 25.327 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 5.403 -17.298 23.431 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 4.573 -15.817 23.407 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 5.893 -16.067 22.369 1.00 0.00 H new ATOM 2220 N LEU A 141 7.690 -13.329 20.419 1.00 0.00 N ATOM 2221 CA LEU A 141 7.315 -14.131 19.261 1.00 0.00 C ATOM 2222 C LEU A 141 6.117 -15.014 19.593 1.00 0.00 C ATOM 2223 O LEU A 141 6.160 -15.820 20.522 1.00 0.00 O ATOM 2224 CB LEU A 141 8.485 -15.016 18.842 1.00 0.00 C ATOM 2225 CG LEU A 141 8.125 -15.782 17.570 1.00 0.00 C ATOM 2226 CD1 LEU A 141 8.387 -14.897 16.354 1.00 0.00 C ATOM 2227 CD2 LEU A 141 8.979 -17.046 17.475 1.00 0.00 C ATOM 0 H LEU A 141 8.496 -13.676 20.938 1.00 0.00 H new ATOM 0 HA LEU A 141 7.051 -13.458 18.445 1.00 0.00 H new ATOM 0 HB2 LEU A 141 9.372 -14.406 18.671 1.00 0.00 H new ATOM 0 HB3 LEU A 141 8.729 -15.715 19.642 1.00 0.00 H new ATOM 0 HG LEU A 141 7.071 -16.059 17.599 1.00 0.00 H new ATOM 0 HD11 LEU A 141 8.131 -15.442 15.445 1.00 0.00 H new ATOM 0 HD12 LEU A 141 7.777 -13.996 16.421 1.00 0.00 H new ATOM 0 HD13 LEU A 141 9.441 -14.620 16.326 1.00 0.00 H new ATOM 0 HD21 LEU A 141 8.721 -17.592 16.567 1.00 0.00 H new ATOM 0 HD22 LEU A 141 10.033 -16.771 17.446 1.00 0.00 H new ATOM 0 HD23 LEU A 141 8.792 -17.678 18.343 1.00 0.00 H new ATOM 2239 N THR A 142 5.049 -14.854 18.823 1.00 0.00 N ATOM 2240 CA THR A 142 3.839 -15.640 19.033 1.00 0.00 C ATOM 2241 C THR A 142 3.700 -16.719 17.963 1.00 0.00 C ATOM 2242 O THR A 142 3.330 -17.854 18.260 1.00 0.00 O ATOM 2243 CB THR A 142 2.615 -14.730 18.992 1.00 0.00 C ATOM 2244 OG1 THR A 142 1.926 -14.906 17.760 1.00 0.00 O ATOM 2245 CG2 THR A 142 3.051 -13.274 19.123 1.00 0.00 C ATOM 0 H THR A 142 4.995 -14.190 18.050 1.00 0.00 H new ATOM 0 HA THR A 142 3.910 -16.120 20.009 1.00 0.00 H new ATOM 0 HB THR A 142 1.953 -14.987 19.819 1.00 0.00 H new ATOM 0 HG1 THR A 142 1.140 -14.321 17.738 1.00 0.00 H new ATOM 0 HG21 THR A 142 2.174 -12.627 19.093 1.00 0.00 H new ATOM 0 HG22 THR A 142 3.573 -13.134 20.070 1.00 0.00 H new ATOM 0 HG23 THR A 142 3.718 -13.018 18.300 1.00 0.00 H new ATOM 2253 N GLY A 143 3.998 -16.355 16.720 1.00 0.00 N ATOM 2254 CA GLY A 143 3.900 -17.301 15.615 1.00 0.00 C ATOM 2255 C GLY A 143 5.112 -17.190 14.696 1.00 0.00 C ATOM 2256 O GLY A 143 5.779 -16.157 14.655 1.00 0.00 O ATOM 0 H GLY A 143 4.307 -15.420 16.454 1.00 0.00 H new ATOM 0 HA2 GLY A 143 3.826 -18.316 16.005 1.00 0.00 H new ATOM 0 HA3 GLY A 143 2.989 -17.111 15.047 1.00 0.00 H new ATOM 2260 N SER A 144 5.392 -18.259 13.961 1.00 0.00 N ATOM 2261 CA SER A 144 6.526 -18.266 13.046 1.00 0.00 C ATOM 2262 C SER A 144 6.150 -18.942 11.730 1.00 0.00 C ATOM 2263 O SER A 144 5.292 -19.824 11.697 1.00 0.00 O ATOM 2264 CB SER A 144 7.702 -19.003 13.684 1.00 0.00 C ATOM 2265 OG SER A 144 7.321 -20.346 13.955 1.00 0.00 O ATOM 0 H SER A 144 4.854 -19.126 13.980 1.00 0.00 H new ATOM 0 HA SER A 144 6.811 -17.234 12.840 1.00 0.00 H new ATOM 0 HB2 SER A 144 8.563 -18.984 13.016 1.00 0.00 H new ATOM 0 HB3 SER A 144 8.002 -18.505 14.606 1.00 0.00 H new ATOM 0 HG SER A 144 8.073 -20.823 14.363 1.00 0.00 H new ATOM 2271 N TYR A 145 6.799 -18.525 10.650 1.00 0.00 N ATOM 2272 CA TYR A 145 6.531 -19.098 9.336 1.00 0.00 C ATOM 2273 C TYR A 145 7.835 -19.404 8.608 1.00 0.00 C ATOM 2274 O TYR A 145 8.850 -18.743 8.827 1.00 0.00 O ATOM 2275 CB TYR A 145 5.695 -18.127 8.500 1.00 0.00 C ATOM 2276 CG TYR A 145 4.370 -17.883 9.182 1.00 0.00 C ATOM 2277 CD1 TYR A 145 3.281 -18.718 8.908 1.00 0.00 C ATOM 2278 CD2 TYR A 145 4.231 -16.826 10.090 1.00 0.00 C ATOM 2279 CE1 TYR A 145 2.052 -18.496 9.541 1.00 0.00 C ATOM 2280 CE2 TYR A 145 3.001 -16.604 10.722 1.00 0.00 C ATOM 2281 CZ TYR A 145 1.912 -17.440 10.447 1.00 0.00 C ATOM 2282 OH TYR A 145 0.700 -17.221 11.070 1.00 0.00 O ATOM 0 H TYR A 145 7.512 -17.795 10.657 1.00 0.00 H new ATOM 0 HA TYR A 145 5.978 -20.027 9.474 1.00 0.00 H new ATOM 0 HB2 TYR A 145 6.230 -17.186 8.375 1.00 0.00 H new ATOM 0 HB3 TYR A 145 5.532 -18.536 7.503 1.00 0.00 H new ATOM 0 HD1 TYR A 145 3.389 -19.534 8.208 1.00 0.00 H new ATOM 0 HD2 TYR A 145 5.072 -16.182 10.303 1.00 0.00 H new ATOM 0 HE1 TYR A 145 1.212 -19.141 9.329 1.00 0.00 H new ATOM 0 HE2 TYR A 145 2.893 -15.788 11.421 1.00 0.00 H new ATOM 0 HH TYR A 145 0.775 -16.449 11.669 1.00 0.00 H new ATOM 2292 N SER A 146 7.800 -20.409 7.739 1.00 0.00 N ATOM 2293 CA SER A 146 8.987 -20.794 6.984 1.00 0.00 C ATOM 2294 C SER A 146 8.614 -21.165 5.552 1.00 0.00 C ATOM 2295 O SER A 146 7.652 -21.897 5.320 1.00 0.00 O ATOM 2296 CB SER A 146 9.669 -21.983 7.661 1.00 0.00 C ATOM 2297 OG SER A 146 8.884 -23.151 7.461 1.00 0.00 O ATOM 0 H SER A 146 6.970 -20.968 7.541 1.00 0.00 H new ATOM 0 HA SER A 146 9.672 -19.947 6.960 1.00 0.00 H new ATOM 0 HB2 SER A 146 10.668 -22.127 7.249 1.00 0.00 H new ATOM 0 HB3 SER A 146 9.789 -21.790 8.727 1.00 0.00 H new ATOM 0 HG SER A 146 8.282 -23.014 6.700 1.00 0.00 H new ATOM 2303 N LYS A 147 9.381 -20.651 4.596 1.00 0.00 N ATOM 2304 CA LYS A 147 9.123 -20.932 3.189 1.00 0.00 C ATOM 2305 C LYS A 147 9.367 -22.407 2.885 1.00 0.00 C ATOM 2306 O LYS A 147 9.883 -23.093 3.753 1.00 0.00 O ATOM 2307 CB LYS A 147 10.031 -20.070 2.310 1.00 0.00 C ATOM 2308 CG LYS A 147 9.211 -18.942 1.679 1.00 0.00 C ATOM 2309 CD LYS A 147 10.144 -17.988 0.931 1.00 0.00 C ATOM 2310 CE LYS A 147 9.324 -16.862 0.299 1.00 0.00 C ATOM 2311 NZ LYS A 147 10.236 -15.927 -0.418 1.00 0.00 N ATOM 2312 OXT LYS A 147 9.034 -22.829 1.790 1.00 0.00 O ATOM 0 H LYS A 147 10.181 -20.042 4.768 1.00 0.00 H new ATOM 0 HA LYS A 147 8.081 -20.696 2.975 1.00 0.00 H new ATOM 0 HB2 LYS A 147 10.843 -19.654 2.906 1.00 0.00 H new ATOM 0 HB3 LYS A 147 10.488 -20.681 1.532 1.00 0.00 H new ATOM 0 HG2 LYS A 147 8.471 -19.356 0.994 1.00 0.00 H new ATOM 0 HG3 LYS A 147 8.663 -18.401 2.451 1.00 0.00 H new ATOM 0 HD2 LYS A 147 10.883 -17.573 1.617 1.00 0.00 H new ATOM 0 HD3 LYS A 147 10.693 -18.529 0.160 1.00 0.00 H new ATOM 0 HE2 LYS A 147 8.591 -17.276 -0.394 1.00 0.00 H new ATOM 0 HE3 LYS A 147 8.768 -16.326 1.068 1.00 0.00 H new ATOM 0 HZ1 LYS A 147 9.680 -15.161 -0.848 1.00 0.00 H new ATOM 0 HZ2 LYS A 147 10.918 -15.523 0.255 1.00 0.00 H new ATOM 0 HZ3 LYS A 147 10.747 -16.443 -1.162 1.00 0.00 H new