USER MOD reduce.3.24.130724 H: found=0, std=0, add=1309, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1310 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 23 GLN :FLIP amide:sc= 0.703 F(o=-0.55,f=0.55) USER MOD Set 1.2: B 78 ASN :FLIP amide:sc= -0.156 X(o=0.23,f=0.55) USER MOD Set 2.1: B 10 GLN : amide:sc= 0.88 K(o=1.9,f=-6.8!) USER MOD Set 2.2: B 13 LYS NZ :NH3+ 179:sc= 1.03 (180deg=0) USER MOD Set 3.1: A 23 GLN :FLIP amide:sc= 0.602 F(o=-0.55,f=0.45) USER MOD Set 3.2: A 78 ASN :FLIP amide:sc= -0.156 X(o=0.23,f=0.45) USER MOD Set 4.1: A 10 GLN : amide:sc= 0.885 K(o=1.9,f=-6.6!) USER MOD Set 4.2: A 13 LYS NZ :NH3+ 179:sc= 1.02 (180deg=0) USER MOD Single : A 11 MET CE :methyl -170:sc= 0 (180deg=-0.111) USER MOD Single : A 12 GLN : amide:sc= 0 K(o=0,f=-0.57) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0.392! USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc= 0 X(o=0,f=-0.32) USER MOD Single : A 32 GLN : amide:sc= -0.0721 X(o=-0.072,f=-0.1) USER MOD Single : A 35 GLN : amide:sc= 0 X(o=0,f=-0.076) USER MOD Single : A 36 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 TYR OH : rot -64:sc= 1.19 USER MOD Single : A 42 THR OG1 : rot 129:sc= 1.19 USER MOD Single : A 45 LYS NZ :NH3+ -179:sc= 1.13 (180deg=1.12) USER MOD Single : A 48 MET CE :methyl -165:sc= -0.0627 (180deg=-0.833) USER MOD Single : A 52 SER OG : rot -63:sc= 1.25 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 ASN : amide:sc= -0.131 K(o=-0.13,f=-1.8) USER MOD Single : A 58 SER OG : rot 180:sc= -0.0124 USER MOD Single : A 61 ASN : amide:sc=-0.00877 K(o=-0.0088,f=-0.71) USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 66 GLN : amide:sc= 0.127 K(o=0.13,f=-0.72) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 GLN : amide:sc= 0.285 X(o=0.29,f=-0.031) USER MOD Single : A 72 MET CE :methyl -162:sc= -0.597 (180deg=-0.756) USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : B 1 MET CE :methyl 168:sc= 0 (180deg=-0.158) USER MOD Single : B 1 MET N :NH3+ -157:sc= 1.24 (180deg=1.1) USER MOD Single : B 2 SER OG : rot 140:sc= -0.0416 USER MOD Single : B 11 MET CE :methyl -170:sc= 0 (180deg=-0.107) USER MOD Single : B 12 GLN : amide:sc= 0 K(o=0,f=-0.6) USER MOD Single : B 14 THR OG1 : rot 30:sc= 0.542! USER MOD Single : B 16 THR OG1 : rot 180:sc= 0 USER MOD Single : B 28 GLN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : B 32 GLN : amide:sc= -0.0528 X(o=-0.053,f=-0.085) USER MOD Single : B 35 GLN : amide:sc= 0 X(o=0,f=-0.086) USER MOD Single : B 36 THR OG1 : rot 180:sc= 0 USER MOD Single : B 39 TYR OH : rot -50:sc= 1.26 USER MOD Single : B 42 THR OG1 : rot 121:sc= 1.21 USER MOD Single : B 45 LYS NZ :NH3+ -177:sc= 1.14 (180deg=1.09) USER MOD Single : B 48 MET CE :methyl -164:sc= -0.0656 (180deg=-0.793) USER MOD Single : B 52 SER OG : rot -63:sc= 1.24 USER MOD Single : B 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 54 TYR OH : rot 180:sc= 0 USER MOD Single : B 56 ASN : amide:sc= -0.124 K(o=-0.12,f=-1.9) USER MOD Single : B 58 SER OG : rot 180:sc=-0.00345 USER MOD Single : B 61 ASN : amide:sc=-0.000361 K(o=-0.00036,f=-0.71) USER MOD Single : B 65 SER OG : rot 180:sc= 0 USER MOD Single : B 66 GLN : amide:sc= 0.128 K(o=0.13,f=-0.72) USER MOD Single : B 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 69 GLN : amide:sc= 0.257 X(o=0.26,f=-0.053) USER MOD Single : B 72 MET CE :methyl -168:sc= -0.599 (180deg=-0.711) USER MOD Single : B 80 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 84 N LEU A 6 -0.833 4.448 -12.866 1.00 0.00 N ATOM 85 CA LEU A 6 -1.194 3.066 -13.168 1.00 0.00 C ATOM 86 C LEU A 6 -2.550 2.706 -12.546 1.00 0.00 C ATOM 87 O LEU A 6 -3.336 1.969 -13.138 1.00 0.00 O ATOM 88 CB LEU A 6 -0.111 2.112 -12.649 1.00 0.00 C ATOM 89 CG LEU A 6 1.237 2.178 -13.377 1.00 0.00 C ATOM 90 CD1 LEU A 6 2.264 1.345 -12.622 1.00 0.00 C ATOM 91 CD2 LEU A 6 1.070 1.677 -14.804 1.00 0.00 C ATOM 0 HA LEU A 6 -1.273 2.964 -14.250 1.00 0.00 H new ATOM 0 HB2 LEU A 6 0.057 2.322 -11.593 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -0.489 1.092 -12.715 1.00 0.00 H new ATOM 0 HG LEU A 6 1.589 3.209 -13.414 1.00 0.00 H new ATOM 0 HD11 LEU A 6 3.222 1.392 -13.140 1.00 0.00 H new ATOM 0 HD12 LEU A 6 2.378 1.737 -11.611 1.00 0.00 H new ATOM 0 HD13 LEU A 6 1.928 0.309 -12.574 1.00 0.00 H new ATOM 0 HD21 LEU A 6 2.029 1.724 -15.321 1.00 0.00 H new ATOM 0 HD22 LEU A 6 0.716 0.646 -14.789 1.00 0.00 H new ATOM 0 HD23 LEU A 6 0.345 2.301 -15.326 1.00 0.00 H new ATOM 103 N LEU A 7 -2.799 3.209 -11.344 1.00 0.00 N ATOM 104 CA LEU A 7 -4.100 3.045 -10.701 1.00 0.00 C ATOM 105 C LEU A 7 -5.184 3.795 -11.469 1.00 0.00 C ATOM 106 O LEU A 7 -6.316 3.329 -11.574 1.00 0.00 O ATOM 107 CB LEU A 7 -4.047 3.549 -9.254 1.00 0.00 C ATOM 108 CG LEU A 7 -3.207 2.705 -8.286 1.00 0.00 C ATOM 109 CD1 LEU A 7 -3.117 3.413 -6.941 1.00 0.00 C ATOM 110 CD2 LEU A 7 -3.836 1.328 -8.137 1.00 0.00 C ATOM 0 H LEU A 7 -2.119 3.734 -10.794 1.00 0.00 H new ATOM 0 HA LEU A 7 -4.345 1.983 -10.701 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -3.653 4.565 -9.257 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -5.066 3.603 -8.870 1.00 0.00 H new ATOM 0 HG LEU A 7 -2.198 2.582 -8.678 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -2.520 2.813 -6.253 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -2.648 4.388 -7.074 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -4.119 3.545 -6.532 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -3.240 0.728 -7.450 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -4.848 1.431 -7.745 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -3.872 0.837 -9.110 1.00 0.00 H new ATOM 122 N PHE A 8 -4.830 4.966 -11.987 1.00 0.00 N ATOM 123 CA PHE A 8 -5.779 5.800 -12.729 1.00 0.00 C ATOM 124 C PHE A 8 -5.407 5.896 -14.204 1.00 0.00 C ATOM 125 O PHE A 8 -5.284 6.991 -14.755 1.00 0.00 O ATOM 126 CB PHE A 8 -5.842 7.205 -12.127 1.00 0.00 C ATOM 127 CG PHE A 8 -6.948 8.055 -12.685 1.00 0.00 C ATOM 128 CD1 PHE A 8 -8.253 7.900 -12.240 1.00 0.00 C ATOM 129 CD2 PHE A 8 -6.687 9.010 -13.655 1.00 0.00 C ATOM 130 CE1 PHE A 8 -9.271 8.681 -12.752 1.00 0.00 C ATOM 131 CE2 PHE A 8 -7.703 9.793 -14.168 1.00 0.00 C ATOM 132 CZ PHE A 8 -8.997 9.628 -13.716 1.00 0.00 C ATOM 0 H PHE A 8 -3.893 5.363 -11.909 1.00 0.00 H new ATOM 0 HA PHE A 8 -6.757 5.326 -12.651 1.00 0.00 H new ATOM 0 HB2 PHE A 8 -5.969 7.122 -11.048 1.00 0.00 H new ATOM 0 HB3 PHE A 8 -4.889 7.706 -12.298 1.00 0.00 H new ATOM 0 HD1 PHE A 8 -8.475 7.161 -11.485 1.00 0.00 H new ATOM 0 HD2 PHE A 8 -5.677 9.144 -14.014 1.00 0.00 H new ATOM 0 HE1 PHE A 8 -10.282 8.550 -12.397 1.00 0.00 H new ATOM 0 HE2 PHE A 8 -7.485 10.534 -14.923 1.00 0.00 H new ATOM 0 HZ PHE A 8 -9.792 10.239 -14.116 1.00 0.00 H new ATOM 142 N GLY A 9 -5.221 4.746 -14.833 1.00 0.00 N ATOM 143 CA GLY A 9 -4.825 4.695 -16.241 1.00 0.00 C ATOM 144 C GLY A 9 -6.002 4.323 -17.134 1.00 0.00 C ATOM 145 O GLY A 9 -5.841 4.129 -18.340 1.00 0.00 O ATOM 0 H GLY A 9 -5.337 3.832 -14.395 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -4.427 5.663 -16.544 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -4.024 3.967 -16.370 1.00 0.00 H new ATOM 149 N GLN A 10 -7.181 4.219 -16.532 1.00 0.00 N ATOM 150 CA GLN A 10 -8.388 3.853 -17.267 1.00 0.00 C ATOM 151 C GLN A 10 -9.214 5.079 -17.577 1.00 0.00 C ATOM 152 O GLN A 10 -10.351 5.212 -17.124 1.00 0.00 O ATOM 153 CB GLN A 10 -9.226 2.847 -16.475 1.00 0.00 C ATOM 154 CG GLN A 10 -8.543 1.509 -16.248 1.00 0.00 C ATOM 155 CD GLN A 10 -9.408 0.544 -15.459 1.00 0.00 C ATOM 156 OE1 GLN A 10 -10.506 0.892 -15.017 1.00 0.00 O ATOM 157 NE2 GLN A 10 -8.917 -0.677 -15.278 1.00 0.00 N ATOM 0 H GLN A 10 -7.328 4.383 -15.536 1.00 0.00 H new ATOM 0 HA GLN A 10 -8.081 3.388 -18.204 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -9.478 3.282 -15.508 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -10.165 2.678 -17.003 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -8.293 1.064 -17.211 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -7.605 1.669 -15.717 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -8.004 -0.922 -15.661 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -9.453 -1.370 -14.756 1.00 0.00 H new ATOM 166 N MET A 11 -8.633 5.967 -18.356 1.00 0.00 N ATOM 167 CA MET A 11 -9.293 7.206 -18.702 1.00 0.00 C ATOM 168 C MET A 11 -9.696 7.959 -17.441 1.00 0.00 C ATOM 169 O MET A 11 -9.239 7.644 -16.341 1.00 0.00 O ATOM 170 CB MET A 11 -10.509 6.930 -19.583 1.00 0.00 C ATOM 171 CG MET A 11 -10.179 6.337 -20.945 1.00 0.00 C ATOM 172 SD MET A 11 -11.643 6.086 -21.968 1.00 0.00 S ATOM 173 CE MET A 11 -12.381 4.669 -21.161 1.00 0.00 C ATOM 0 H MET A 11 -7.704 5.853 -18.761 1.00 0.00 H new ATOM 0 HA MET A 11 -8.599 7.830 -19.265 1.00 0.00 H new ATOM 0 HB2 MET A 11 -11.177 6.248 -19.056 1.00 0.00 H new ATOM 0 HB3 MET A 11 -11.055 7.862 -19.729 1.00 0.00 H new ATOM 0 HG2 MET A 11 -9.486 6.997 -21.466 1.00 0.00 H new ATOM 0 HG3 MET A 11 -9.669 5.384 -20.808 1.00 0.00 H new ATOM 0 HE1 MET A 11 -13.194 4.283 -21.776 1.00 0.00 H new ATOM 0 HE2 MET A 11 -11.627 3.893 -21.027 1.00 0.00 H new ATOM 0 HE3 MET A 11 -12.772 4.967 -20.188 1.00 0.00 H new ATOM 183 N GLN A 12 -10.568 8.944 -17.605 1.00 0.00 N ATOM 184 CA GLN A 12 -11.086 9.686 -16.462 1.00 0.00 C ATOM 185 C GLN A 12 -12.362 9.036 -15.948 1.00 0.00 C ATOM 186 O GLN A 12 -13.267 8.709 -16.716 1.00 0.00 O ATOM 187 CB GLN A 12 -11.351 11.147 -16.838 1.00 0.00 C ATOM 188 CG GLN A 12 -11.822 12.011 -15.681 1.00 0.00 C ATOM 189 CD GLN A 12 -12.004 13.463 -16.080 1.00 0.00 C ATOM 190 OE1 GLN A 12 -12.321 13.770 -17.233 1.00 0.00 O ATOM 191 NE2 GLN A 12 -11.805 14.367 -15.127 1.00 0.00 N ATOM 0 H GLN A 12 -10.930 9.247 -18.509 1.00 0.00 H new ATOM 0 HA GLN A 12 -10.336 9.666 -15.671 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -10.437 11.576 -17.249 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -12.101 11.177 -17.628 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -12.766 11.621 -15.300 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -11.100 11.949 -14.867 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -11.544 14.068 -14.187 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -11.913 15.360 -15.335 1.00 0.00 H new ATOM 200 N LYS A 13 -12.422 8.856 -14.641 1.00 0.00 N ATOM 201 CA LYS A 13 -13.577 8.242 -14.018 1.00 0.00 C ATOM 202 C LYS A 13 -14.663 9.279 -13.726 1.00 0.00 C ATOM 203 O LYS A 13 -15.843 8.961 -13.778 1.00 0.00 O ATOM 204 CB LYS A 13 -13.166 7.525 -12.731 1.00 0.00 C ATOM 205 CG LYS A 13 -12.192 6.372 -12.937 1.00 0.00 C ATOM 206 CD LYS A 13 -12.812 5.267 -13.779 1.00 0.00 C ATOM 207 CE LYS A 13 -11.860 4.091 -13.939 1.00 0.00 C ATOM 208 NZ LYS A 13 -12.446 3.010 -14.776 1.00 0.00 N ATOM 0 H LYS A 13 -11.684 9.127 -13.992 1.00 0.00 H new ATOM 0 HA LYS A 13 -13.988 7.511 -14.714 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -12.714 8.250 -12.054 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -14.061 7.145 -12.239 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -11.288 6.739 -13.424 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -11.892 5.970 -11.969 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -13.737 4.928 -13.313 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -13.076 5.660 -14.761 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -10.930 4.436 -14.391 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -11.608 3.692 -12.956 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -11.759 2.236 -14.874 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -13.311 2.651 -14.323 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -12.679 3.387 -15.717 1.00 0.00 H new ATOM 222 N THR A 14 -14.254 10.511 -13.419 1.00 0.00 N ATOM 223 CA THR A 14 -15.197 11.589 -13.078 1.00 0.00 C ATOM 224 C THR A 14 -16.398 11.047 -12.296 1.00 0.00 C ATOM 225 O THR A 14 -16.304 10.031 -11.609 1.00 0.00 O ATOM 226 CB THR A 14 -15.692 12.315 -14.343 1.00 0.00 C ATOM 227 OG1 THR A 14 -16.554 13.398 -13.968 1.00 0.00 O ATOM 228 CG2 THR A 14 -16.452 11.357 -15.246 1.00 0.00 C ATOM 0 H THR A 14 -13.274 10.792 -13.398 1.00 0.00 H new ATOM 0 HA THR A 14 -14.659 12.300 -12.450 1.00 0.00 H new ATOM 0 HB THR A 14 -14.828 12.699 -14.885 1.00 0.00 H new ATOM 0 HG1 THR A 14 -16.867 13.861 -14.773 1.00 0.00 H new ATOM 0 HG21 THR A 14 -16.794 11.888 -16.134 1.00 0.00 H new ATOM 0 HG22 THR A 14 -15.796 10.539 -15.542 1.00 0.00 H new ATOM 0 HG23 THR A 14 -17.312 10.956 -14.710 1.00 0.00 H new ATOM 236 N ALA A 15 -17.526 11.739 -12.392 1.00 0.00 N ATOM 237 CA ALA A 15 -18.706 11.359 -11.624 1.00 0.00 C ATOM 238 C ALA A 15 -18.438 11.479 -10.126 1.00 0.00 C ATOM 239 O ALA A 15 -17.457 10.940 -9.616 1.00 0.00 O ATOM 240 CB ALA A 15 -19.097 9.916 -11.968 1.00 0.00 C ATOM 0 H ALA A 15 -17.649 12.558 -12.987 1.00 0.00 H new ATOM 0 HA ALA A 15 -19.523 12.032 -11.882 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -19.979 9.631 -11.394 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -19.318 9.843 -13.033 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -18.272 9.247 -11.722 1.00 0.00 H new ATOM 246 N THR A 16 -19.321 12.186 -9.426 1.00 0.00 N ATOM 247 CA THR A 16 -19.185 12.348 -7.983 1.00 0.00 C ATOM 248 C THR A 16 -20.043 11.323 -7.253 1.00 0.00 C ATOM 249 O THR A 16 -21.242 11.209 -7.505 1.00 0.00 O ATOM 250 CB THR A 16 -19.577 13.769 -7.538 1.00 0.00 C ATOM 251 OG1 THR A 16 -18.708 14.725 -8.160 1.00 0.00 O ATOM 252 CG2 THR A 16 -19.473 13.903 -6.026 1.00 0.00 C ATOM 0 H THR A 16 -20.132 12.652 -9.832 1.00 0.00 H new ATOM 0 HA THR A 16 -18.137 12.188 -7.729 1.00 0.00 H new ATOM 0 HB THR A 16 -20.608 13.956 -7.839 1.00 0.00 H new ATOM 0 HG1 THR A 16 -18.960 15.629 -7.877 1.00 0.00 H new ATOM 0 HG21 THR A 16 -19.754 14.914 -5.730 1.00 0.00 H new ATOM 0 HG22 THR A 16 -20.143 13.186 -5.550 1.00 0.00 H new ATOM 0 HG23 THR A 16 -18.448 13.705 -5.713 1.00 0.00 H new ATOM 260 N VAL A 17 -19.419 10.577 -6.349 1.00 0.00 N ATOM 261 CA VAL A 17 -20.132 9.560 -5.587 1.00 0.00 C ATOM 262 C VAL A 17 -20.233 9.968 -4.119 1.00 0.00 C ATOM 263 O VAL A 17 -20.922 9.323 -3.329 1.00 0.00 O ATOM 264 CB VAL A 17 -19.414 8.202 -5.697 1.00 0.00 C ATOM 265 CG1 VAL A 17 -19.370 7.739 -7.146 1.00 0.00 C ATOM 266 CG2 VAL A 17 -18.009 8.311 -5.124 1.00 0.00 C ATOM 0 H VAL A 17 -18.427 10.657 -6.127 1.00 0.00 H new ATOM 0 HA VAL A 17 -21.136 9.466 -6.001 1.00 0.00 H new ATOM 0 HB VAL A 17 -19.969 7.461 -5.122 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -18.859 6.778 -7.206 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -20.386 7.634 -7.525 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -18.833 8.473 -7.746 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -17.507 7.347 -5.205 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -17.446 9.061 -5.680 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -18.065 8.604 -4.076 1.00 0.00 H new ATOM 276 N ALA A 18 -19.533 11.044 -3.762 1.00 0.00 N ATOM 277 CA ALA A 18 -19.618 11.591 -2.412 1.00 0.00 C ATOM 278 C ALA A 18 -19.133 10.568 -1.390 1.00 0.00 C ATOM 279 O ALA A 18 -19.661 10.487 -0.281 1.00 0.00 O ATOM 280 CB ALA A 18 -21.061 11.985 -2.095 1.00 0.00 C ATOM 0 H ALA A 18 -18.905 11.550 -4.386 1.00 0.00 H new ATOM 0 HA ALA A 18 -18.982 12.474 -2.358 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -21.114 12.392 -1.085 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -21.398 12.738 -2.808 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -21.702 11.106 -2.166 1.00 0.00 H new ATOM 286 N ARG A 19 -18.130 9.786 -1.777 1.00 0.00 N ATOM 287 CA ARG A 19 -17.563 8.767 -0.893 1.00 0.00 C ATOM 288 C ARG A 19 -16.043 8.745 -1.019 1.00 0.00 C ATOM 289 O ARG A 19 -15.485 9.117 -2.055 1.00 0.00 O ATOM 290 CB ARG A 19 -18.121 7.391 -1.222 1.00 0.00 C ATOM 291 CG ARG A 19 -19.615 7.232 -0.983 1.00 0.00 C ATOM 292 CD ARG A 19 -19.943 7.242 0.466 1.00 0.00 C ATOM 293 NE ARG A 19 -21.353 6.982 0.704 1.00 0.00 N ATOM 294 CZ ARG A 19 -22.315 7.926 0.707 1.00 0.00 C ATOM 295 NH1 ARG A 19 -22.002 9.183 0.484 1.00 0.00 N ATOM 296 NH2 ARG A 19 -23.572 7.588 0.935 1.00 0.00 N ATOM 0 H ARG A 19 -17.691 9.837 -2.697 1.00 0.00 H new ATOM 0 HA ARG A 19 -17.838 9.020 0.131 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -17.910 7.170 -2.268 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -17.591 6.648 -0.626 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -20.152 8.038 -1.483 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -19.957 6.297 -1.427 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -19.343 6.490 0.979 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -19.675 8.209 0.892 1.00 0.00 H new ATOM 0 HE ARG A 19 -21.634 6.018 0.881 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -21.032 9.444 0.309 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -22.730 9.898 0.486 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -23.814 6.613 1.109 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -24.300 8.303 0.937 1.00 0.00 H new ATOM 310 N ASP A 20 -15.376 8.312 0.053 1.00 0.00 N ATOM 311 CA ASP A 20 -13.920 8.202 0.054 1.00 0.00 C ATOM 312 C ASP A 20 -13.511 6.766 -0.247 1.00 0.00 C ATOM 313 O ASP A 20 -14.221 5.828 0.103 1.00 0.00 O ATOM 314 CB ASP A 20 -13.339 8.641 1.401 1.00 0.00 C ATOM 315 CG ASP A 20 -13.506 10.132 1.661 1.00 0.00 C ATOM 316 OD1 ASP A 20 -13.677 10.864 0.715 1.00 0.00 O ATOM 317 OD2 ASP A 20 -13.462 10.524 2.802 1.00 0.00 O ATOM 0 H ASP A 20 -15.821 8.033 0.927 1.00 0.00 H new ATOM 0 HA ASP A 20 -13.524 8.861 -0.719 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -13.825 8.081 2.200 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -12.279 8.388 1.434 1.00 0.00 H new ATOM 322 N ARG A 21 -12.370 6.602 -0.911 1.00 0.00 N ATOM 323 CA ARG A 21 -11.879 5.276 -1.284 1.00 0.00 C ATOM 324 C ARG A 21 -10.392 5.168 -0.981 1.00 0.00 C ATOM 325 O ARG A 21 -9.594 5.992 -1.434 1.00 0.00 O ATOM 326 CB ARG A 21 -12.120 5.001 -2.761 1.00 0.00 C ATOM 327 CG ARG A 21 -11.691 3.620 -3.232 1.00 0.00 C ATOM 328 CD ARG A 21 -12.208 3.318 -4.591 1.00 0.00 C ATOM 329 NE ARG A 21 -11.681 4.237 -5.588 1.00 0.00 N ATOM 330 CZ ARG A 21 -11.861 4.109 -6.917 1.00 0.00 C ATOM 331 NH1 ARG A 21 -12.554 3.098 -7.392 1.00 0.00 N ATOM 332 NH2 ARG A 21 -11.340 5.000 -7.743 1.00 0.00 N ATOM 0 H ARG A 21 -11.767 7.371 -1.203 1.00 0.00 H new ATOM 0 HA ARG A 21 -12.425 4.535 -0.700 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -13.182 5.127 -2.971 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -11.588 5.751 -3.347 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -10.603 3.558 -3.235 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -12.051 2.868 -2.530 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -11.942 2.296 -4.862 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -13.297 3.373 -4.586 1.00 0.00 H new ATOM 0 HE ARG A 21 -11.137 5.034 -5.258 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -12.955 2.410 -6.754 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -12.690 3.001 -8.398 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -10.802 5.784 -7.374 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -11.476 4.903 -8.749 1.00 0.00 H new ATOM 346 N LEU A 22 -10.024 4.146 -0.216 1.00 0.00 N ATOM 347 CA LEU A 22 -8.619 3.877 0.088 1.00 0.00 C ATOM 348 C LEU A 22 -8.121 2.711 -0.761 1.00 0.00 C ATOM 349 O LEU A 22 -8.771 1.673 -0.850 1.00 0.00 O ATOM 350 CB LEU A 22 -8.441 3.557 1.578 1.00 0.00 C ATOM 351 CG LEU A 22 -9.004 4.597 2.554 1.00 0.00 C ATOM 352 CD1 LEU A 22 -8.815 4.108 3.984 1.00 0.00 C ATOM 353 CD2 LEU A 22 -8.303 5.930 2.336 1.00 0.00 C ATOM 0 H LEU A 22 -10.679 3.488 0.207 1.00 0.00 H new ATOM 0 HA LEU A 22 -8.034 4.767 -0.145 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -8.916 2.598 1.784 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -7.377 3.435 1.780 1.00 0.00 H new ATOM 0 HG LEU A 22 -10.070 4.735 2.376 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -9.215 4.848 4.677 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -9.341 3.163 4.118 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -7.753 3.963 4.182 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -8.703 6.669 3.030 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -7.233 5.811 2.509 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -8.470 6.266 1.312 1.00 0.00 H new ATOM 365 N GLN A 23 -6.956 2.901 -1.382 1.00 0.00 N ATOM 366 CA GLN A 23 -6.298 1.838 -2.143 1.00 0.00 C ATOM 367 C GLN A 23 -4.967 1.493 -1.497 1.00 0.00 C ATOM 368 O GLN A 23 -3.987 2.223 -1.643 1.00 0.00 O ATOM 369 CB GLN A 23 -6.085 2.256 -3.601 1.00 0.00 C ATOM 370 CG GLN A 23 -5.365 1.220 -4.447 1.00 0.00 C ATOM 371 CD GLN A 23 -6.273 0.078 -4.860 1.00 0.00 C ATOM 372 OE1 GLN A 23 -5.890 -1.142 -4.498 1.00 0.00 O flip ATOM 373 NE2 GLN A 23 -7.308 0.289 -5.498 1.00 0.00 N flip ATOM 0 H GLN A 23 -6.447 3.785 -1.373 1.00 0.00 H new ATOM 0 HA GLN A 23 -6.942 0.959 -2.135 1.00 0.00 H new ATOM 0 HB2 GLN A 23 -7.055 2.467 -4.052 1.00 0.00 H new ATOM 0 HB3 GLN A 23 -5.515 3.185 -3.621 1.00 0.00 H new ATOM 0 HG2 GLN A 23 -4.961 1.700 -5.338 1.00 0.00 H new ATOM 0 HG3 GLN A 23 -4.518 0.823 -3.887 1.00 0.00 H new ATOM 0 HE21 GLN A 23 -7.563 1.243 -5.755 1.00 0.00 H new ATOM 0 HE22 GLN A 23 -7.908 -0.490 -5.769 1.00 0.00 H new ATOM 382 N ILE A 24 -4.941 0.377 -0.775 1.00 0.00 N ATOM 383 CA ILE A 24 -3.761 0.000 0.000 1.00 0.00 C ATOM 384 C ILE A 24 -3.088 -1.213 -0.622 1.00 0.00 C ATOM 385 O ILE A 24 -3.683 -2.287 -0.717 1.00 0.00 O ATOM 386 CB ILE A 24 -4.168 -0.339 1.437 1.00 0.00 C ATOM 387 CG1 ILE A 24 -4.832 0.880 2.085 1.00 0.00 C ATOM 388 CG2 ILE A 24 -2.924 -0.726 2.239 1.00 0.00 C ATOM 389 CD1 ILE A 24 -5.460 0.470 3.419 1.00 0.00 C ATOM 0 H ILE A 24 -5.719 -0.280 -0.710 1.00 0.00 H new ATOM 0 HA ILE A 24 -3.066 0.839 0.001 1.00 0.00 H new ATOM 0 HB ILE A 24 -4.871 -1.172 1.427 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -4.095 1.667 2.244 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -5.595 1.287 1.422 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -3.211 -0.968 3.262 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -2.451 -1.594 1.780 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -2.222 0.108 2.247 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -5.933 1.337 3.880 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -6.209 -0.303 3.246 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -4.686 0.083 4.082 1.00 0.00 H new ATOM 401 N ILE A 25 -1.837 -1.034 -1.039 1.00 0.00 N ATOM 402 CA ILE A 25 -1.040 -2.137 -1.572 1.00 0.00 C ATOM 403 C ILE A 25 0.066 -2.496 -0.591 1.00 0.00 C ATOM 404 O ILE A 25 0.931 -1.676 -0.286 1.00 0.00 O ATOM 405 CB ILE A 25 -0.429 -1.778 -2.939 1.00 0.00 C ATOM 406 CG1 ILE A 25 -1.525 -1.356 -3.920 1.00 0.00 C ATOM 407 CG2 ILE A 25 0.362 -2.954 -3.493 1.00 0.00 C ATOM 408 CD1 ILE A 25 -2.563 -2.425 -4.174 1.00 0.00 C ATOM 0 H ILE A 25 -1.353 -0.136 -1.018 1.00 0.00 H new ATOM 0 HA ILE A 25 -1.699 -2.994 -1.711 1.00 0.00 H new ATOM 0 HB ILE A 25 0.253 -0.939 -2.804 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -2.021 -0.466 -3.534 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -1.064 -1.078 -4.868 1.00 0.00 H new ATOM 0 HG21 ILE A 25 0.787 -2.684 -4.460 1.00 0.00 H new ATOM 0 HG22 ILE A 25 1.165 -3.210 -2.802 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -0.299 -3.812 -3.615 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -3.305 -2.051 -4.879 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -2.080 -3.309 -4.590 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -3.053 -2.687 -3.236 1.00 0.00 H new ATOM 420 N ILE A 26 0.028 -3.729 -0.098 1.00 0.00 N ATOM 421 CA ILE A 26 1.074 -4.235 0.790 1.00 0.00 C ATOM 422 C ILE A 26 1.846 -5.355 0.111 1.00 0.00 C ATOM 423 O ILE A 26 1.488 -6.523 0.234 1.00 0.00 O ATOM 424 CB ILE A 26 0.482 -4.746 2.116 1.00 0.00 C ATOM 425 CG1 ILE A 26 -0.345 -3.648 2.789 1.00 0.00 C ATOM 426 CG2 ILE A 26 1.589 -5.226 3.042 1.00 0.00 C ATOM 427 CD1 ILE A 26 -1.190 -4.140 3.942 1.00 0.00 C ATOM 0 H ILE A 26 -0.715 -4.399 -0.297 1.00 0.00 H new ATOM 0 HA ILE A 26 1.751 -3.409 1.010 1.00 0.00 H new ATOM 0 HB ILE A 26 -0.175 -5.589 1.901 1.00 0.00 H new ATOM 0 HG12 ILE A 26 0.327 -2.869 3.150 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -0.995 -3.188 2.045 1.00 0.00 H new ATOM 0 HG21 ILE A 26 1.153 -5.584 3.975 1.00 0.00 H new ATOM 0 HG22 ILE A 26 2.138 -6.037 2.563 1.00 0.00 H new ATOM 0 HG23 ILE A 26 2.270 -4.402 3.253 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -1.747 -3.305 4.367 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -1.888 -4.897 3.584 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -0.545 -4.573 4.707 1.00 0.00 H new ATOM 439 N ALA A 27 2.911 -4.991 -0.601 1.00 0.00 N ATOM 440 CA ALA A 27 3.624 -5.942 -1.460 1.00 0.00 C ATOM 441 C ALA A 27 4.941 -6.340 -0.813 1.00 0.00 C ATOM 442 O ALA A 27 5.791 -5.493 -0.532 1.00 0.00 O ATOM 443 CB ALA A 27 3.897 -5.314 -2.828 1.00 0.00 C ATOM 0 H ALA A 27 3.300 -4.048 -0.602 1.00 0.00 H new ATOM 0 HA ALA A 27 3.003 -6.828 -1.590 1.00 0.00 H new ATOM 0 HB1 ALA A 27 4.427 -6.029 -3.457 1.00 0.00 H new ATOM 0 HB2 ALA A 27 2.952 -5.045 -3.300 1.00 0.00 H new ATOM 0 HB3 ALA A 27 4.507 -4.419 -2.702 1.00 0.00 H new ATOM 449 N GLN A 28 5.104 -7.639 -0.576 1.00 0.00 N ATOM 450 CA GLN A 28 6.348 -8.164 -0.020 1.00 0.00 C ATOM 451 C GLN A 28 7.053 -9.051 -1.033 1.00 0.00 C ATOM 452 O GLN A 28 6.636 -10.183 -1.277 1.00 0.00 O ATOM 453 CB GLN A 28 6.080 -8.948 1.267 1.00 0.00 C ATOM 454 CG GLN A 28 7.328 -9.508 1.927 1.00 0.00 C ATOM 455 CD GLN A 28 7.022 -10.233 3.223 1.00 0.00 C ATOM 456 OE1 GLN A 28 6.004 -10.920 3.341 1.00 0.00 O ATOM 457 NE2 GLN A 28 7.904 -10.085 4.205 1.00 0.00 N ATOM 0 H GLN A 28 4.392 -8.346 -0.760 1.00 0.00 H new ATOM 0 HA GLN A 28 6.994 -7.319 0.217 1.00 0.00 H new ATOM 0 HB2 GLN A 28 5.569 -8.297 1.976 1.00 0.00 H new ATOM 0 HB3 GLN A 28 5.401 -9.771 1.043 1.00 0.00 H new ATOM 0 HG2 GLN A 28 7.823 -10.193 1.239 1.00 0.00 H new ATOM 0 HG3 GLN A 28 8.027 -8.695 2.125 1.00 0.00 H new ATOM 0 HE21 GLN A 28 8.733 -9.507 4.064 1.00 0.00 H new ATOM 0 HE22 GLN A 28 7.753 -10.549 5.101 1.00 0.00 H new ATOM 466 N GLU A 29 8.135 -8.535 -1.611 1.00 0.00 N ATOM 467 CA GLU A 29 8.874 -9.259 -2.647 1.00 0.00 C ATOM 468 C GLU A 29 10.003 -10.053 -2.003 1.00 0.00 C ATOM 469 O GLU A 29 10.953 -9.478 -1.474 1.00 0.00 O ATOM 470 CB GLU A 29 9.437 -8.295 -3.693 1.00 0.00 C ATOM 471 CG GLU A 29 10.176 -8.972 -4.839 1.00 0.00 C ATOM 472 CD GLU A 29 10.662 -8.000 -5.878 1.00 0.00 C ATOM 473 OE1 GLU A 29 10.351 -6.838 -5.768 1.00 0.00 O ATOM 474 OE2 GLU A 29 11.345 -8.419 -6.782 1.00 0.00 O ATOM 0 H GLU A 29 8.521 -7.619 -1.381 1.00 0.00 H new ATOM 0 HA GLU A 29 8.190 -9.941 -3.152 1.00 0.00 H new ATOM 0 HB2 GLU A 29 8.618 -7.705 -4.103 1.00 0.00 H new ATOM 0 HB3 GLU A 29 10.116 -7.599 -3.200 1.00 0.00 H new ATOM 0 HG2 GLU A 29 11.027 -9.525 -4.440 1.00 0.00 H new ATOM 0 HG3 GLU A 29 9.516 -9.700 -5.311 1.00 0.00 H new ATOM 481 N ARG A 30 9.894 -11.379 -2.050 1.00 0.00 N ATOM 482 CA ARG A 30 10.888 -12.255 -1.429 1.00 0.00 C ATOM 483 C ARG A 30 11.509 -13.178 -2.467 1.00 0.00 C ATOM 484 O ARG A 30 12.203 -12.729 -3.379 1.00 0.00 O ATOM 485 CB ARG A 30 10.261 -13.090 -0.323 1.00 0.00 C ATOM 486 CG ARG A 30 9.807 -12.300 0.895 1.00 0.00 C ATOM 487 CD ARG A 30 9.081 -13.158 1.866 1.00 0.00 C ATOM 488 NE ARG A 30 7.789 -13.584 1.353 1.00 0.00 N ATOM 489 CZ ARG A 30 6.930 -14.385 2.013 1.00 0.00 C ATOM 490 NH1 ARG A 30 7.239 -14.836 3.209 1.00 0.00 N ATOM 491 NH2 ARG A 30 5.777 -14.716 1.459 1.00 0.00 N ATOM 0 H ARG A 30 9.129 -11.871 -2.511 1.00 0.00 H new ATOM 0 HA ARG A 30 11.664 -11.623 -0.998 1.00 0.00 H new ATOM 0 HB2 ARG A 30 9.403 -13.624 -0.732 1.00 0.00 H new ATOM 0 HB3 ARG A 30 10.982 -13.842 -0.002 1.00 0.00 H new ATOM 0 HG2 ARG A 30 10.673 -11.852 1.382 1.00 0.00 H new ATOM 0 HG3 ARG A 30 9.161 -11.482 0.578 1.00 0.00 H new ATOM 0 HD2 ARG A 30 9.686 -14.034 2.099 1.00 0.00 H new ATOM 0 HD3 ARG A 30 8.939 -12.611 2.798 1.00 0.00 H new ATOM 0 HE ARG A 30 7.514 -13.253 0.428 1.00 0.00 H new ATOM 0 HH11 ARG A 30 8.129 -14.579 3.637 1.00 0.00 H new ATOM 0 HH12 ARG A 30 6.589 -15.442 3.709 1.00 0.00 H new ATOM 0 HH21 ARG A 30 5.537 -14.365 0.532 1.00 0.00 H new ATOM 0 HH22 ARG A 30 5.127 -15.322 1.959 1.00 0.00 H new ATOM 505 N ALA A 31 11.255 -14.475 -2.319 1.00 0.00 N ATOM 506 CA ALA A 31 11.992 -15.481 -3.077 1.00 0.00 C ATOM 507 C ALA A 31 11.423 -16.867 -2.793 1.00 0.00 C ATOM 508 O ALA A 31 10.543 -17.017 -1.945 1.00 0.00 O ATOM 509 CB ALA A 31 13.471 -15.439 -2.682 1.00 0.00 C ATOM 0 H ALA A 31 10.550 -14.852 -1.686 1.00 0.00 H new ATOM 0 HA ALA A 31 11.895 -15.269 -4.142 1.00 0.00 H new ATOM 0 HB1 ALA A 31 14.020 -16.191 -3.249 1.00 0.00 H new ATOM 0 HB2 ALA A 31 13.878 -14.451 -2.900 1.00 0.00 H new ATOM 0 HB3 ALA A 31 13.569 -15.645 -1.616 1.00 0.00 H new ATOM 515 N GLN A 32 11.919 -17.873 -3.511 1.00 0.00 N ATOM 516 CA GLN A 32 11.527 -19.261 -3.254 1.00 0.00 C ATOM 517 C GLN A 32 11.924 -19.690 -1.844 1.00 0.00 C ATOM 518 O GLN A 32 11.204 -20.444 -1.188 1.00 0.00 O ATOM 519 CB GLN A 32 12.162 -20.199 -4.284 1.00 0.00 C ATOM 520 CG GLN A 32 11.728 -21.649 -4.156 1.00 0.00 C ATOM 521 CD GLN A 32 10.247 -21.835 -4.427 1.00 0.00 C ATOM 522 OE1 GLN A 32 9.730 -21.395 -5.458 1.00 0.00 O ATOM 523 NE2 GLN A 32 9.555 -22.491 -3.502 1.00 0.00 N ATOM 0 H GLN A 32 12.589 -17.756 -4.271 1.00 0.00 H new ATOM 0 HA GLN A 32 10.442 -19.323 -3.341 1.00 0.00 H new ATOM 0 HB2 GLN A 32 11.913 -19.844 -5.284 1.00 0.00 H new ATOM 0 HB3 GLN A 32 13.246 -20.146 -4.187 1.00 0.00 H new ATOM 0 HG2 GLN A 32 12.302 -22.260 -4.853 1.00 0.00 H new ATOM 0 HG3 GLN A 32 11.959 -22.007 -3.153 1.00 0.00 H new ATOM 0 HE21 GLN A 32 10.023 -22.837 -2.665 1.00 0.00 H new ATOM 0 HE22 GLN A 32 8.555 -22.648 -3.629 1.00 0.00 H new ATOM 532 N GLU A 33 13.071 -19.199 -1.384 1.00 0.00 N ATOM 533 CA GLU A 33 13.505 -19.454 -0.017 1.00 0.00 C ATOM 534 C GLU A 33 12.809 -18.489 0.937 1.00 0.00 C ATOM 535 O GLU A 33 12.731 -17.288 0.677 1.00 0.00 O ATOM 536 CB GLU A 33 15.024 -19.313 0.104 1.00 0.00 C ATOM 537 CG GLU A 33 15.579 -19.646 1.482 1.00 0.00 C ATOM 538 CD GLU A 33 17.077 -19.539 1.551 1.00 0.00 C ATOM 539 OE1 GLU A 33 17.678 -19.229 0.551 1.00 0.00 O ATOM 540 OE2 GLU A 33 17.621 -19.768 2.606 1.00 0.00 O ATOM 0 H GLU A 33 13.712 -18.627 -1.934 1.00 0.00 H new ATOM 0 HA GLU A 33 13.234 -20.476 0.248 1.00 0.00 H new ATOM 0 HB2 GLU A 33 15.497 -19.964 -0.632 1.00 0.00 H new ATOM 0 HB3 GLU A 33 15.303 -18.290 -0.149 1.00 0.00 H new ATOM 0 HG2 GLU A 33 15.138 -18.974 2.218 1.00 0.00 H new ATOM 0 HG3 GLU A 33 15.279 -20.658 1.754 1.00 0.00 H new ATOM 547 N GLY A 34 12.301 -19.028 2.041 1.00 0.00 N ATOM 548 CA GLY A 34 11.577 -18.224 3.025 1.00 0.00 C ATOM 549 C GLY A 34 10.974 -19.109 4.107 1.00 0.00 C ATOM 550 O GLY A 34 10.943 -20.332 3.978 1.00 0.00 O ATOM 0 H GLY A 34 12.376 -20.017 2.278 1.00 0.00 H new ATOM 0 HA2 GLY A 34 12.253 -17.499 3.477 1.00 0.00 H new ATOM 0 HA3 GLY A 34 10.788 -17.658 2.530 1.00 0.00 H new ATOM 554 N GLN A 35 10.493 -18.482 5.178 1.00 0.00 N ATOM 555 CA GLN A 35 9.912 -19.221 6.302 1.00 0.00 C ATOM 556 C GLN A 35 9.227 -18.266 7.273 1.00 0.00 C ATOM 557 O GLN A 35 9.171 -17.058 7.039 1.00 0.00 O ATOM 558 CB GLN A 35 10.985 -20.032 7.032 1.00 0.00 C ATOM 559 CG GLN A 35 12.064 -19.187 7.689 1.00 0.00 C ATOM 560 CD GLN A 35 13.140 -20.031 8.345 1.00 0.00 C ATOM 561 OE1 GLN A 35 13.697 -20.942 7.726 1.00 0.00 O ATOM 562 NE2 GLN A 35 13.440 -19.733 9.604 1.00 0.00 N ATOM 0 H GLN A 35 10.493 -17.469 5.294 1.00 0.00 H new ATOM 0 HA GLN A 35 9.168 -19.911 5.904 1.00 0.00 H new ATOM 0 HB2 GLN A 35 10.505 -20.646 7.794 1.00 0.00 H new ATOM 0 HB3 GLN A 35 11.454 -20.714 6.323 1.00 0.00 H new ATOM 0 HG2 GLN A 35 12.520 -18.539 6.941 1.00 0.00 H new ATOM 0 HG3 GLN A 35 11.608 -18.538 8.437 1.00 0.00 H new ATOM 0 HE21 GLN A 35 12.954 -18.971 10.077 1.00 0.00 H new ATOM 0 HE22 GLN A 35 14.156 -20.266 10.097 1.00 0.00 H new ATOM 571 N THR A 36 8.703 -18.820 8.359 1.00 0.00 N ATOM 572 CA THR A 36 8.015 -18.010 9.354 1.00 0.00 C ATOM 573 C THR A 36 7.050 -17.042 8.660 1.00 0.00 C ATOM 574 O THR A 36 7.312 -15.844 8.605 1.00 0.00 O ATOM 575 CB THR A 36 9.013 -17.228 10.228 1.00 0.00 C ATOM 576 OG1 THR A 36 10.043 -18.113 10.690 1.00 0.00 O ATOM 577 CG2 THR A 36 8.306 -16.611 11.425 1.00 0.00 C ATOM 0 H THR A 36 8.741 -19.817 8.571 1.00 0.00 H new ATOM 0 HA THR A 36 7.452 -18.678 10.006 1.00 0.00 H new ATOM 0 HB THR A 36 9.451 -16.431 9.628 1.00 0.00 H new ATOM 0 HG1 THR A 36 10.678 -17.614 11.245 1.00 0.00 H new ATOM 0 HG21 THR A 36 9.027 -16.063 12.031 1.00 0.00 H new ATOM 0 HG22 THR A 36 7.531 -15.928 11.077 1.00 0.00 H new ATOM 0 HG23 THR A 36 7.853 -17.399 12.026 1.00 0.00 H new ATOM 585 N PRO A 37 5.956 -17.538 8.126 1.00 0.00 N ATOM 586 CA PRO A 37 4.925 -16.679 7.457 1.00 0.00 C ATOM 587 C PRO A 37 4.230 -15.713 8.443 1.00 0.00 C ATOM 588 O PRO A 37 4.566 -15.693 9.613 1.00 0.00 O ATOM 589 CB PRO A 37 3.934 -17.705 6.898 1.00 0.00 C ATOM 590 CG PRO A 37 4.716 -18.972 6.834 1.00 0.00 C ATOM 591 CD PRO A 37 5.588 -18.935 8.061 1.00 0.00 C ATOM 0 HA PRO A 37 5.357 -16.027 6.698 1.00 0.00 H new ATOM 0 HB2 PRO A 37 3.061 -17.808 7.543 1.00 0.00 H new ATOM 0 HB3 PRO A 37 3.570 -17.412 5.913 1.00 0.00 H new ATOM 0 HG2 PRO A 37 4.062 -19.844 6.838 1.00 0.00 H new ATOM 0 HG3 PRO A 37 5.313 -19.025 5.924 1.00 0.00 H new ATOM 0 HD2 PRO A 37 5.051 -19.257 8.953 1.00 0.00 H new ATOM 0 HD3 PRO A 37 6.459 -19.582 7.962 1.00 0.00 H new ATOM 599 N ASP A 38 3.231 -14.965 7.979 1.00 0.00 N ATOM 600 CA ASP A 38 2.407 -14.107 8.856 1.00 0.00 C ATOM 601 C ASP A 38 2.927 -12.669 8.914 1.00 0.00 C ATOM 602 O ASP A 38 3.279 -12.171 9.983 1.00 0.00 O ATOM 603 CB ASP A 38 2.358 -14.683 10.273 1.00 0.00 C ATOM 604 CG ASP A 38 1.199 -14.136 11.095 1.00 0.00 C ATOM 605 OD1 ASP A 38 0.243 -13.685 10.511 1.00 0.00 O ATOM 606 OD2 ASP A 38 1.282 -14.174 12.300 1.00 0.00 O ATOM 0 H ASP A 38 2.964 -14.930 6.995 1.00 0.00 H new ATOM 0 HA ASP A 38 1.405 -14.087 8.427 1.00 0.00 H new ATOM 0 HB2 ASP A 38 2.276 -15.768 10.216 1.00 0.00 H new ATOM 0 HB3 ASP A 38 3.295 -14.461 10.783 1.00 0.00 H new ATOM 611 N TYR A 39 2.948 -11.999 7.762 1.00 0.00 N ATOM 612 CA TYR A 39 3.386 -10.601 7.688 1.00 0.00 C ATOM 613 C TYR A 39 2.275 -9.728 7.105 1.00 0.00 C ATOM 614 O TYR A 39 1.956 -8.668 7.639 1.00 0.00 O ATOM 615 CB TYR A 39 4.661 -10.475 6.851 1.00 0.00 C ATOM 616 CG TYR A 39 5.798 -11.349 7.333 1.00 0.00 C ATOM 617 CD1 TYR A 39 6.165 -12.472 6.608 1.00 0.00 C ATOM 618 CD2 TYR A 39 6.472 -11.026 8.502 1.00 0.00 C ATOM 619 CE1 TYR A 39 7.203 -13.270 7.049 1.00 0.00 C ATOM 620 CE2 TYR A 39 7.510 -11.824 8.943 1.00 0.00 C ATOM 621 CZ TYR A 39 7.876 -12.942 8.221 1.00 0.00 C ATOM 622 OH TYR A 39 8.910 -13.737 8.660 1.00 0.00 O ATOM 0 H TYR A 39 2.668 -12.399 6.867 1.00 0.00 H new ATOM 0 HA TYR A 39 3.607 -10.256 8.698 1.00 0.00 H new ATOM 0 HB2 TYR A 39 4.432 -10.731 5.817 1.00 0.00 H new ATOM 0 HB3 TYR A 39 4.987 -9.435 6.857 1.00 0.00 H new ATOM 0 HD1 TYR A 39 5.640 -12.723 5.698 1.00 0.00 H new ATOM 0 HD2 TYR A 39 6.185 -10.151 9.067 1.00 0.00 H new ATOM 0 HE1 TYR A 39 7.491 -14.145 6.486 1.00 0.00 H new ATOM 0 HE2 TYR A 39 8.035 -11.573 9.853 1.00 0.00 H new ATOM 0 HH TYR A 39 8.566 -14.627 8.883 1.00 0.00 H new ATOM 632 N LEU A 40 1.684 -10.194 6.010 1.00 0.00 N ATOM 633 CA LEU A 40 0.629 -9.441 5.337 1.00 0.00 C ATOM 634 C LEU A 40 -0.594 -9.317 6.264 1.00 0.00 C ATOM 635 O LEU A 40 -1.115 -8.216 6.454 1.00 0.00 O ATOM 636 CB LEU A 40 0.233 -10.131 4.025 1.00 0.00 C ATOM 637 CG LEU A 40 1.292 -10.108 2.916 1.00 0.00 C ATOM 638 CD1 LEU A 40 0.813 -10.947 1.739 1.00 0.00 C ATOM 639 CD2 LEU A 40 1.553 -8.670 2.493 1.00 0.00 C ATOM 0 H LEU A 40 1.915 -11.085 5.570 1.00 0.00 H new ATOM 0 HA LEU A 40 1.001 -8.444 5.103 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -0.016 -11.170 4.243 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -0.673 -9.658 3.646 1.00 0.00 H new ATOM 0 HG LEU A 40 2.226 -10.533 3.283 1.00 0.00 H new ATOM 0 HD11 LEU A 40 1.565 -10.931 0.951 1.00 0.00 H new ATOM 0 HD12 LEU A 40 0.652 -11.974 2.066 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -0.122 -10.537 1.357 1.00 0.00 H new ATOM 0 HD21 LEU A 40 2.306 -8.654 1.705 1.00 0.00 H new ATOM 0 HD22 LEU A 40 0.629 -8.227 2.122 1.00 0.00 H new ATOM 0 HD23 LEU A 40 1.911 -8.098 3.349 1.00 0.00 H new ATOM 651 N PRO A 41 -1.059 -10.402 6.858 1.00 0.00 N ATOM 652 CA PRO A 41 -2.257 -10.367 7.761 1.00 0.00 C ATOM 653 C PRO A 41 -1.939 -9.723 9.111 1.00 0.00 C ATOM 654 O PRO A 41 -2.837 -9.252 9.810 1.00 0.00 O ATOM 655 CB PRO A 41 -2.638 -11.850 7.925 1.00 0.00 C ATOM 656 CG PRO A 41 -1.350 -12.583 7.755 1.00 0.00 C ATOM 657 CD PRO A 41 -0.596 -11.824 6.669 1.00 0.00 C ATOM 0 HA PRO A 41 -3.066 -9.764 7.348 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -3.078 -12.042 8.903 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -3.372 -12.157 7.180 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -0.783 -12.604 8.686 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -1.522 -13.619 7.463 1.00 0.00 H new ATOM 0 HD2 PRO A 41 0.483 -11.915 6.789 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -0.839 -12.198 5.674 1.00 0.00 H new ATOM 665 N THR A 42 -0.657 -9.688 9.466 1.00 0.00 N ATOM 666 CA THR A 42 -0.234 -8.980 10.670 1.00 0.00 C ATOM 667 C THR A 42 -0.440 -7.473 10.520 1.00 0.00 C ATOM 668 O THR A 42 -1.039 -6.828 11.382 1.00 0.00 O ATOM 669 CB THR A 42 1.243 -9.273 10.995 1.00 0.00 C ATOM 670 OG1 THR A 42 1.407 -10.671 11.266 1.00 0.00 O ATOM 671 CG2 THR A 42 1.692 -8.469 12.206 1.00 0.00 C ATOM 0 H THR A 42 0.097 -10.135 8.945 1.00 0.00 H new ATOM 0 HA THR A 42 -0.852 -9.339 11.493 1.00 0.00 H new ATOM 0 HB THR A 42 1.852 -8.989 10.137 1.00 0.00 H new ATOM 0 HG1 THR A 42 2.136 -11.027 10.717 1.00 0.00 H new ATOM 0 HG21 THR A 42 2.738 -8.689 12.421 1.00 0.00 H new ATOM 0 HG22 THR A 42 1.580 -7.405 11.998 1.00 0.00 H new ATOM 0 HG23 THR A 42 1.080 -8.737 13.068 1.00 0.00 H new ATOM 679 N LEU A 43 0.061 -6.915 9.420 1.00 0.00 N ATOM 680 CA LEU A 43 -0.152 -5.505 9.118 1.00 0.00 C ATOM 681 C LEU A 43 -1.623 -5.230 8.826 1.00 0.00 C ATOM 682 O LEU A 43 -2.171 -4.219 9.258 1.00 0.00 O ATOM 683 CB LEU A 43 0.704 -5.083 7.917 1.00 0.00 C ATOM 684 CG LEU A 43 0.590 -3.610 7.504 1.00 0.00 C ATOM 685 CD1 LEU A 43 0.941 -2.721 8.689 1.00 0.00 C ATOM 686 CD2 LEU A 43 1.514 -3.340 6.326 1.00 0.00 C ATOM 0 H LEU A 43 0.615 -7.417 8.726 1.00 0.00 H new ATOM 0 HA LEU A 43 0.144 -4.923 9.991 1.00 0.00 H new ATOM 0 HB2 LEU A 43 1.748 -5.298 8.145 1.00 0.00 H new ATOM 0 HB3 LEU A 43 0.430 -5.703 7.063 1.00 0.00 H new ATOM 0 HG LEU A 43 -0.432 -3.387 7.198 1.00 0.00 H new ATOM 0 HD11 LEU A 43 0.860 -1.674 8.395 1.00 0.00 H new ATOM 0 HD12 LEU A 43 0.253 -2.922 9.511 1.00 0.00 H new ATOM 0 HD13 LEU A 43 1.961 -2.930 9.011 1.00 0.00 H new ATOM 0 HD21 LEU A 43 1.433 -2.293 6.032 1.00 0.00 H new ATOM 0 HD22 LEU A 43 2.543 -3.558 6.613 1.00 0.00 H new ATOM 0 HD23 LEU A 43 1.229 -3.975 5.487 1.00 0.00 H new ATOM 698 N ARG A 44 -2.255 -6.138 8.097 1.00 0.00 N ATOM 699 CA ARG A 44 -3.680 -6.009 7.818 1.00 0.00 C ATOM 700 C ARG A 44 -4.467 -5.831 9.110 1.00 0.00 C ATOM 701 O ARG A 44 -5.320 -4.952 9.205 1.00 0.00 O ATOM 702 CB ARG A 44 -4.196 -7.232 7.074 1.00 0.00 C ATOM 703 CG ARG A 44 -5.667 -7.175 6.694 1.00 0.00 C ATOM 704 CD ARG A 44 -6.164 -8.494 6.224 1.00 0.00 C ATOM 705 NE ARG A 44 -6.158 -9.486 7.288 1.00 0.00 N ATOM 706 CZ ARG A 44 -6.245 -10.816 7.094 1.00 0.00 C ATOM 707 NH1 ARG A 44 -6.342 -11.298 5.874 1.00 0.00 N ATOM 708 NH2 ARG A 44 -6.231 -11.637 8.129 1.00 0.00 N ATOM 0 H ARG A 44 -1.812 -6.963 7.692 1.00 0.00 H new ATOM 0 HA ARG A 44 -3.818 -5.128 7.192 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -3.606 -7.363 6.167 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -4.029 -8.113 7.693 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -6.253 -6.851 7.554 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -5.812 -6.431 5.911 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -7.177 -8.383 5.836 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -5.543 -8.843 5.399 1.00 0.00 H new ATOM 0 HE ARG A 44 -6.083 -9.151 8.248 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -6.351 -10.665 5.075 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -6.408 -12.305 5.727 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -6.154 -11.264 9.075 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -6.297 -12.644 7.982 1.00 0.00 H new ATOM 722 N LYS A 45 -4.195 -6.676 10.092 1.00 0.00 N ATOM 723 CA LYS A 45 -4.861 -6.551 11.379 1.00 0.00 C ATOM 724 C LYS A 45 -4.630 -5.175 11.997 1.00 0.00 C ATOM 725 O LYS A 45 -5.562 -4.549 12.502 1.00 0.00 O ATOM 726 CB LYS A 45 -4.380 -7.645 12.334 1.00 0.00 C ATOM 727 CG LYS A 45 -5.019 -7.599 13.716 1.00 0.00 C ATOM 728 CD LYS A 45 -4.555 -8.764 14.578 1.00 0.00 C ATOM 729 CE LYS A 45 -5.249 -8.761 15.932 1.00 0.00 C ATOM 730 NZ LYS A 45 -4.752 -7.667 16.810 1.00 0.00 N ATOM 0 H LYS A 45 -3.528 -7.445 10.025 1.00 0.00 H new ATOM 0 HA LYS A 45 -5.932 -6.668 11.212 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -4.583 -8.617 11.885 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -3.299 -7.565 12.444 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -4.766 -6.658 14.205 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -6.104 -7.626 13.618 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -4.760 -9.703 14.064 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -3.476 -8.707 14.720 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -6.324 -8.651 15.788 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -5.090 -9.721 16.423 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -5.238 -7.711 17.728 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -3.728 -7.776 16.955 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -4.942 -6.748 16.361 1.00 0.00 H new ATOM 744 N ALA A 46 -3.383 -4.720 11.977 1.00 0.00 N ATOM 745 CA ALA A 46 -3.052 -3.425 12.552 1.00 0.00 C ATOM 746 C ALA A 46 -3.789 -2.319 11.833 1.00 0.00 C ATOM 747 O ALA A 46 -4.258 -1.365 12.450 1.00 0.00 O ATOM 748 CB ALA A 46 -1.549 -3.165 12.472 1.00 0.00 C ATOM 0 H ALA A 46 -2.593 -5.223 11.573 1.00 0.00 H new ATOM 0 HA ALA A 46 -3.357 -3.439 13.598 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -1.324 -2.191 12.908 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -1.016 -3.940 13.022 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -1.233 -3.177 11.429 1.00 0.00 H new ATOM 754 N LEU A 47 -3.898 -2.453 10.528 1.00 0.00 N ATOM 755 CA LEU A 47 -4.617 -1.466 9.735 1.00 0.00 C ATOM 756 C LEU A 47 -6.107 -1.476 10.061 1.00 0.00 C ATOM 757 O LEU A 47 -6.759 -0.434 10.060 1.00 0.00 O ATOM 758 CB LEU A 47 -4.410 -1.738 8.239 1.00 0.00 C ATOM 759 CG LEU A 47 -2.994 -1.485 7.707 1.00 0.00 C ATOM 760 CD1 LEU A 47 -2.900 -1.966 6.265 1.00 0.00 C ATOM 761 CD2 LEU A 47 -2.669 -0.003 7.812 1.00 0.00 C ATOM 0 H LEU A 47 -3.503 -3.227 9.993 1.00 0.00 H new ATOM 0 HA LEU A 47 -4.219 -0.482 9.982 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -4.674 -2.776 8.037 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -5.106 -1.117 7.676 1.00 0.00 H new ATOM 0 HG LEU A 47 -2.268 -2.038 8.302 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -1.894 -1.786 5.886 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -3.119 -3.033 6.222 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -3.620 -1.423 5.653 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -1.663 0.176 7.434 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -3.385 0.569 7.223 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -2.726 0.309 8.855 1.00 0.00 H new ATOM 773 N MET A 48 -6.632 -2.658 10.341 1.00 0.00 N ATOM 774 CA MET A 48 -8.034 -2.801 10.711 1.00 0.00 C ATOM 775 C MET A 48 -8.294 -2.205 12.092 1.00 0.00 C ATOM 776 O MET A 48 -9.367 -1.656 12.350 1.00 0.00 O ATOM 777 CB MET A 48 -8.443 -4.272 10.677 1.00 0.00 C ATOM 778 CG MET A 48 -8.596 -4.851 9.277 1.00 0.00 C ATOM 779 SD MET A 48 -9.751 -3.912 8.259 1.00 0.00 S ATOM 780 CE MET A 48 -11.243 -4.031 9.242 1.00 0.00 C ATOM 0 H MET A 48 -6.109 -3.534 10.320 1.00 0.00 H new ATOM 0 HA MET A 48 -8.638 -2.254 9.987 1.00 0.00 H new ATOM 0 HB2 MET A 48 -7.699 -4.856 11.219 1.00 0.00 H new ATOM 0 HB3 MET A 48 -9.387 -4.386 11.209 1.00 0.00 H new ATOM 0 HG2 MET A 48 -7.622 -4.872 8.789 1.00 0.00 H new ATOM 0 HG3 MET A 48 -8.939 -5.883 9.350 1.00 0.00 H new ATOM 0 HE1 MET A 48 -12.101 -3.739 8.637 1.00 0.00 H new ATOM 0 HE2 MET A 48 -11.373 -5.058 9.584 1.00 0.00 H new ATOM 0 HE3 MET A 48 -11.164 -3.369 10.104 1.00 0.00 H new ATOM 790 N GLU A 49 -7.304 -2.309 12.970 1.00 0.00 N ATOM 791 CA GLU A 49 -7.369 -1.651 14.269 1.00 0.00 C ATOM 792 C GLU A 49 -7.438 -0.131 14.117 1.00 0.00 C ATOM 793 O GLU A 49 -8.285 0.524 14.724 1.00 0.00 O ATOM 794 CB GLU A 49 -6.156 -2.036 15.119 1.00 0.00 C ATOM 795 CG GLU A 49 -6.151 -3.485 15.586 1.00 0.00 C ATOM 796 CD GLU A 49 -4.868 -3.876 16.266 1.00 0.00 C ATOM 797 OE1 GLU A 49 -3.994 -3.048 16.364 1.00 0.00 O ATOM 798 OE2 GLU A 49 -4.761 -5.004 16.686 1.00 0.00 O ATOM 0 H GLU A 49 -6.449 -2.841 12.807 1.00 0.00 H new ATOM 0 HA GLU A 49 -8.278 -1.985 14.769 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -5.250 -1.849 14.543 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -6.118 -1.385 15.993 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -6.983 -3.643 16.272 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -6.316 -4.138 14.729 1.00 0.00 H new ATOM 805 N VAL A 50 -6.565 0.424 13.284 1.00 0.00 N ATOM 806 CA VAL A 50 -6.613 1.853 12.993 1.00 0.00 C ATOM 807 C VAL A 50 -7.932 2.210 12.319 1.00 0.00 C ATOM 808 O VAL A 50 -8.530 3.244 12.609 1.00 0.00 O ATOM 809 CB VAL A 50 -5.440 2.260 12.081 1.00 0.00 C ATOM 810 CG1 VAL A 50 -5.601 3.700 11.617 1.00 0.00 C ATOM 811 CG2 VAL A 50 -4.123 2.074 12.818 1.00 0.00 C ATOM 0 H VAL A 50 -5.824 -0.086 12.803 1.00 0.00 H new ATOM 0 HA VAL A 50 -6.532 2.396 13.935 1.00 0.00 H new ATOM 0 HB VAL A 50 -5.439 1.620 11.199 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -4.764 3.971 10.974 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -6.533 3.801 11.061 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -5.622 4.361 12.483 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -3.298 2.364 12.167 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -4.116 2.697 13.713 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -4.010 1.028 13.103 1.00 0.00 H new ATOM 821 N LEU A 51 -8.373 1.350 11.407 1.00 0.00 N ATOM 822 CA LEU A 51 -9.662 1.555 10.765 1.00 0.00 C ATOM 823 C LEU A 51 -10.763 1.688 11.811 1.00 0.00 C ATOM 824 O LEU A 51 -11.527 2.649 11.798 1.00 0.00 O ATOM 825 CB LEU A 51 -9.978 0.391 9.818 1.00 0.00 C ATOM 826 CG LEU A 51 -11.290 0.509 9.032 1.00 0.00 C ATOM 827 CD1 LEU A 51 -11.127 -0.148 7.668 1.00 0.00 C ATOM 828 CD2 LEU A 51 -12.415 -0.143 9.822 1.00 0.00 C ATOM 0 H LEU A 51 -7.866 0.519 11.101 1.00 0.00 H new ATOM 0 HA LEU A 51 -9.614 2.477 10.186 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -9.158 0.293 9.107 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -10.007 -0.530 10.401 1.00 0.00 H new ATOM 0 HG LEU A 51 -11.540 1.559 8.880 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -12.059 -0.064 7.110 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -10.329 0.350 7.118 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -10.876 -1.201 7.799 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -13.347 -0.059 9.264 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -12.183 -1.195 9.985 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -12.522 0.358 10.784 1.00 0.00 H new ATOM 840 N SER A 52 -10.841 0.737 12.728 1.00 0.00 N ATOM 841 CA SER A 52 -11.923 0.739 13.701 1.00 0.00 C ATOM 842 C SER A 52 -11.923 2.040 14.504 1.00 0.00 C ATOM 843 O SER A 52 -12.975 2.517 14.927 1.00 0.00 O ATOM 844 CB SER A 52 -11.788 -0.449 14.634 1.00 0.00 C ATOM 845 OG SER A 52 -10.678 -0.303 15.476 1.00 0.00 O ATOM 0 H SER A 52 -10.180 -0.035 12.820 1.00 0.00 H new ATOM 0 HA SER A 52 -12.869 0.664 13.165 1.00 0.00 H new ATOM 0 HB2 SER A 52 -12.693 -0.550 15.233 1.00 0.00 H new ATOM 0 HB3 SER A 52 -11.689 -1.364 14.051 1.00 0.00 H new ATOM 0 HG SER A 52 -9.859 -0.283 14.938 1.00 0.00 H new ATOM 851 N LYS A 53 -10.736 2.611 14.706 1.00 0.00 N ATOM 852 CA LYS A 53 -10.605 3.872 15.445 1.00 0.00 C ATOM 853 C LYS A 53 -11.202 5.045 14.662 1.00 0.00 C ATOM 854 O LYS A 53 -12.014 5.807 15.189 1.00 0.00 O ATOM 855 CB LYS A 53 -9.136 4.151 15.767 1.00 0.00 C ATOM 856 CG LYS A 53 -8.534 3.223 16.814 1.00 0.00 C ATOM 857 CD LYS A 53 -7.065 3.537 17.052 1.00 0.00 C ATOM 858 CE LYS A 53 -6.458 2.602 18.088 1.00 0.00 C ATOM 859 NZ LYS A 53 -5.018 2.892 18.323 1.00 0.00 N ATOM 0 H LYS A 53 -9.853 2.225 14.371 1.00 0.00 H new ATOM 0 HA LYS A 53 -11.162 3.769 16.376 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -8.554 4.070 14.849 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -9.042 5.180 16.114 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -9.085 3.321 17.749 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -8.639 2.188 16.489 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -6.516 3.449 16.114 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -6.962 4.569 17.386 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -7.005 2.696 19.026 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -6.571 1.570 17.756 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -4.643 2.233 19.035 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -4.491 2.777 17.434 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -4.912 3.868 18.665 1.00 0.00 H new ATOM 873 N TYR A 54 -10.778 5.189 13.411 1.00 0.00 N ATOM 874 CA TYR A 54 -10.929 6.449 12.685 1.00 0.00 C ATOM 875 C TYR A 54 -11.877 6.297 11.503 1.00 0.00 C ATOM 876 O TYR A 54 -12.519 7.263 11.091 1.00 0.00 O ATOM 877 CB TYR A 54 -9.567 6.958 12.208 1.00 0.00 C ATOM 878 CG TYR A 54 -8.582 7.209 13.329 1.00 0.00 C ATOM 879 CD1 TYR A 54 -7.496 6.364 13.500 1.00 0.00 C ATOM 880 CD2 TYR A 54 -8.766 8.285 14.185 1.00 0.00 C ATOM 881 CE1 TYR A 54 -6.597 6.593 14.524 1.00 0.00 C ATOM 882 CE2 TYR A 54 -7.867 8.514 15.209 1.00 0.00 C ATOM 883 CZ TYR A 54 -6.786 7.673 15.379 1.00 0.00 C ATOM 884 OH TYR A 54 -5.891 7.902 16.398 1.00 0.00 O ATOM 0 H TYR A 54 -10.326 4.448 12.876 1.00 0.00 H new ATOM 0 HA TYR A 54 -11.359 7.179 13.371 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -9.140 6.231 11.517 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -9.711 7.883 11.649 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -7.353 5.527 12.833 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -9.612 8.943 14.051 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -5.751 5.936 14.660 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -8.010 9.351 15.876 1.00 0.00 H new ATOM 0 HH TYR A 54 -6.166 8.696 16.903 1.00 0.00 H new ATOM 894 N VAL A 55 -11.958 5.087 10.955 1.00 0.00 N ATOM 895 CA VAL A 55 -12.646 4.862 9.677 1.00 0.00 C ATOM 896 C VAL A 55 -13.732 3.797 9.830 1.00 0.00 C ATOM 897 O VAL A 55 -13.441 2.604 9.909 1.00 0.00 O ATOM 898 CB VAL A 55 -11.643 4.420 8.594 1.00 0.00 C ATOM 899 CG1 VAL A 55 -12.362 4.152 7.280 1.00 0.00 C ATOM 900 CG2 VAL A 55 -10.571 5.483 8.416 1.00 0.00 C ATOM 0 H VAL A 55 -11.558 4.246 11.371 1.00 0.00 H new ATOM 0 HA VAL A 55 -13.109 5.801 9.375 1.00 0.00 H new ATOM 0 HB VAL A 55 -11.165 3.494 8.912 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -11.639 3.841 6.526 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -13.099 3.362 7.423 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -12.864 5.061 6.948 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -9.866 5.164 7.649 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -11.036 6.421 8.113 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -10.042 5.627 9.358 1.00 0.00 H new ATOM 910 N ASN A 56 -14.987 4.243 9.893 1.00 0.00 N ATOM 911 CA ASN A 56 -16.114 3.347 10.168 1.00 0.00 C ATOM 912 C ASN A 56 -16.549 2.599 8.916 1.00 0.00 C ATOM 913 O ASN A 56 -17.551 2.945 8.299 1.00 0.00 O ATOM 914 CB ASN A 56 -17.282 4.119 10.756 1.00 0.00 C ATOM 915 CG ASN A 56 -18.383 3.218 11.242 1.00 0.00 C ATOM 916 OD1 ASN A 56 -18.248 1.989 11.231 1.00 0.00 O ATOM 917 ND2 ASN A 56 -19.471 3.806 11.670 1.00 0.00 N ATOM 0 H ASN A 56 -15.250 5.219 9.758 1.00 0.00 H new ATOM 0 HA ASN A 56 -15.779 2.611 10.898 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -16.927 4.733 11.584 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -17.680 4.799 10.003 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -20.252 3.247 12.013 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -19.538 4.824 11.661 1.00 0.00 H new ATOM 924 N VAL A 57 -15.799 1.564 8.553 1.00 0.00 N ATOM 925 CA VAL A 57 -16.147 0.743 7.391 1.00 0.00 C ATOM 926 C VAL A 57 -16.170 -0.732 7.772 1.00 0.00 C ATOM 927 O VAL A 57 -15.323 -1.203 8.529 1.00 0.00 O ATOM 928 CB VAL A 57 -15.136 0.962 6.250 1.00 0.00 C ATOM 929 CG1 VAL A 57 -15.458 0.056 5.071 1.00 0.00 C ATOM 930 CG2 VAL A 57 -15.143 2.423 5.825 1.00 0.00 C ATOM 0 H VAL A 57 -14.952 1.272 9.040 1.00 0.00 H new ATOM 0 HA VAL A 57 -17.138 1.042 7.050 1.00 0.00 H new ATOM 0 HB VAL A 57 -14.138 0.708 6.608 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -14.733 0.224 4.274 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -15.412 -0.985 5.389 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -16.460 0.279 4.704 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -14.426 2.571 5.018 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -16.140 2.697 5.479 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -14.869 3.050 6.673 1.00 0.00 H new ATOM 940 N SER A 58 -17.146 -1.457 7.234 1.00 0.00 N ATOM 941 CA SER A 58 -17.323 -2.861 7.576 1.00 0.00 C ATOM 942 C SER A 58 -16.601 -3.728 6.558 1.00 0.00 C ATOM 943 O SER A 58 -16.358 -3.292 5.439 1.00 0.00 O ATOM 944 CB SER A 58 -18.796 -3.220 7.619 1.00 0.00 C ATOM 945 OG SER A 58 -18.972 -4.602 7.765 1.00 0.00 O ATOM 0 H SER A 58 -17.823 -1.096 6.562 1.00 0.00 H new ATOM 0 HA SER A 58 -16.900 -3.038 8.565 1.00 0.00 H new ATOM 0 HB2 SER A 58 -19.277 -2.699 8.447 1.00 0.00 H new ATOM 0 HB3 SER A 58 -19.283 -2.882 6.704 1.00 0.00 H new ATOM 0 HG SER A 58 -19.930 -4.809 7.792 1.00 0.00 H new ATOM 951 N LEU A 59 -16.265 -4.953 6.944 1.00 0.00 N ATOM 952 CA LEU A 59 -15.578 -5.879 6.046 1.00 0.00 C ATOM 953 C LEU A 59 -16.489 -6.270 4.875 1.00 0.00 C ATOM 954 O LEU A 59 -16.026 -6.817 3.877 1.00 0.00 O ATOM 955 CB LEU A 59 -15.139 -7.135 6.809 1.00 0.00 C ATOM 956 CG LEU A 59 -13.988 -6.940 7.804 1.00 0.00 C ATOM 957 CD1 LEU A 59 -13.794 -8.216 8.613 1.00 0.00 C ATOM 958 CD2 LEU A 59 -12.720 -6.573 7.048 1.00 0.00 C ATOM 0 H LEU A 59 -16.456 -5.330 7.872 1.00 0.00 H new ATOM 0 HA LEU A 59 -14.694 -5.379 5.650 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -16.000 -7.529 7.350 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -14.844 -7.894 6.084 1.00 0.00 H new ATOM 0 HG LEU A 59 -14.224 -6.129 8.493 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -12.976 -8.078 9.320 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -14.710 -8.444 9.158 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -13.557 -9.041 7.941 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -11.902 -6.434 7.755 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -12.467 -7.373 6.352 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -12.881 -5.648 6.494 1.00 0.00 H new ATOM 970 N ASP A 60 -17.778 -5.977 5.011 1.00 0.00 N ATOM 971 CA ASP A 60 -18.720 -6.179 3.917 1.00 0.00 C ATOM 972 C ASP A 60 -18.418 -5.236 2.751 1.00 0.00 C ATOM 973 O ASP A 60 -18.800 -5.514 1.613 1.00 0.00 O ATOM 974 CB ASP A 60 -20.157 -5.963 4.401 1.00 0.00 C ATOM 975 CG ASP A 60 -20.646 -7.076 5.318 1.00 0.00 C ATOM 976 OD1 ASP A 60 -20.029 -8.114 5.343 1.00 0.00 O ATOM 977 OD2 ASP A 60 -21.633 -6.876 5.985 1.00 0.00 O ATOM 0 H ASP A 60 -18.192 -5.601 5.864 1.00 0.00 H new ATOM 0 HA ASP A 60 -18.612 -7.206 3.568 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -20.218 -5.011 4.928 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -20.819 -5.893 3.538 1.00 0.00 H new ATOM 982 N ASN A 61 -17.734 -4.120 3.031 1.00 0.00 N ATOM 983 CA ASN A 61 -17.397 -3.135 1.994 1.00 0.00 C ATOM 984 C ASN A 61 -15.897 -3.152 1.696 1.00 0.00 C ATOM 985 O ASN A 61 -15.454 -2.605 0.690 1.00 0.00 O ATOM 986 CB ASN A 61 -17.844 -1.745 2.406 1.00 0.00 C ATOM 987 CG ASN A 61 -19.340 -1.622 2.496 1.00 0.00 C ATOM 988 OD1 ASN A 61 -20.072 -2.197 1.683 1.00 0.00 O ATOM 989 ND2 ASN A 61 -19.808 -0.883 3.469 1.00 0.00 N ATOM 0 H ASN A 61 -17.403 -3.876 3.965 1.00 0.00 H new ATOM 0 HA ASN A 61 -17.929 -3.408 1.083 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -17.404 -1.497 3.372 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -17.466 -1.018 1.687 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -20.815 -0.763 3.579 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -19.166 -0.427 4.117 1.00 0.00 H new ATOM 996 N ILE A 62 -15.121 -3.785 2.579 1.00 0.00 N ATOM 997 CA ILE A 62 -13.666 -3.872 2.404 1.00 0.00 C ATOM 998 C ILE A 62 -13.287 -5.104 1.584 1.00 0.00 C ATOM 999 O ILE A 62 -13.599 -6.233 1.961 1.00 0.00 O ATOM 1000 CB ILE A 62 -12.946 -3.918 3.764 1.00 0.00 C ATOM 1001 CG1 ILE A 62 -13.248 -2.653 4.571 1.00 0.00 C ATOM 1002 CG2 ILE A 62 -11.447 -4.083 3.567 1.00 0.00 C ATOM 1003 CD1 ILE A 62 -12.841 -2.745 6.024 1.00 0.00 C ATOM 0 H ILE A 62 -15.472 -4.244 3.420 1.00 0.00 H new ATOM 0 HA ILE A 62 -13.349 -2.978 1.868 1.00 0.00 H new ATOM 0 HB ILE A 62 -13.315 -4.778 4.323 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -12.733 -1.809 4.112 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -14.316 -2.444 4.515 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -10.954 -4.114 4.538 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -11.251 -5.011 3.031 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -11.061 -3.242 2.990 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -13.087 -1.812 6.530 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -13.375 -3.567 6.500 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -11.768 -2.922 6.091 1.00 0.00 H new ATOM 1015 N ARG A 63 -12.583 -4.871 0.482 1.00 0.00 N ATOM 1016 CA ARG A 63 -12.144 -5.961 -0.384 1.00 0.00 C ATOM 1017 C ARG A 63 -10.746 -6.404 0.029 1.00 0.00 C ATOM 1018 O ARG A 63 -9.804 -5.613 0.019 1.00 0.00 O ATOM 1019 CB ARG A 63 -12.137 -5.532 -1.844 1.00 0.00 C ATOM 1020 CG ARG A 63 -11.719 -6.614 -2.826 1.00 0.00 C ATOM 1021 CD ARG A 63 -11.866 -6.165 -4.234 1.00 0.00 C ATOM 1022 NE ARG A 63 -11.444 -7.188 -5.177 1.00 0.00 N ATOM 1023 CZ ARG A 63 -10.197 -7.305 -5.673 1.00 0.00 C ATOM 1024 NH1 ARG A 63 -9.262 -6.457 -5.307 1.00 0.00 N ATOM 1025 NH2 ARG A 63 -9.914 -8.273 -6.527 1.00 0.00 N ATOM 0 H ARG A 63 -12.305 -3.942 0.167 1.00 0.00 H new ATOM 0 HA ARG A 63 -12.843 -6.791 -0.277 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -13.135 -5.185 -2.111 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -11.464 -4.682 -1.955 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -10.682 -6.894 -2.640 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -12.324 -7.506 -2.664 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -12.907 -5.903 -4.425 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -11.276 -5.262 -4.390 1.00 0.00 H new ATOM 0 HE ARG A 63 -12.142 -7.865 -5.485 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -9.481 -5.710 -4.647 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -8.318 -6.546 -5.683 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -10.640 -8.931 -6.810 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -8.970 -8.362 -6.903 1.00 0.00 H new ATOM 1039 N ILE A 64 -10.625 -7.675 0.404 1.00 0.00 N ATOM 1040 CA ILE A 64 -9.344 -8.246 0.824 1.00 0.00 C ATOM 1041 C ILE A 64 -8.933 -9.367 -0.109 1.00 0.00 C ATOM 1042 O ILE A 64 -9.570 -10.419 -0.158 1.00 0.00 O ATOM 1043 CB ILE A 64 -9.416 -8.779 2.267 1.00 0.00 C ATOM 1044 CG1 ILE A 64 -9.823 -7.660 3.229 1.00 0.00 C ATOM 1045 CG2 ILE A 64 -8.081 -9.380 2.678 1.00 0.00 C ATOM 1046 CD1 ILE A 64 -10.101 -8.137 4.637 1.00 0.00 C ATOM 0 H ILE A 64 -11.403 -8.334 0.426 1.00 0.00 H new ATOM 0 HA ILE A 64 -8.600 -7.450 0.785 1.00 0.00 H new ATOM 0 HB ILE A 64 -10.173 -9.562 2.311 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -9.030 -6.913 3.258 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -10.713 -7.165 2.840 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -8.149 -9.752 3.700 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -7.831 -10.203 2.008 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -7.305 -8.617 2.620 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -10.383 -7.288 5.260 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -10.915 -8.862 4.622 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -9.206 -8.605 5.046 1.00 0.00 H new ATOM 1058 N SER A 65 -7.850 -9.137 -0.840 1.00 0.00 N ATOM 1059 CA SER A 65 -7.384 -10.102 -1.823 1.00 0.00 C ATOM 1060 C SER A 65 -5.862 -10.146 -1.836 1.00 0.00 C ATOM 1061 O SER A 65 -5.200 -9.112 -1.940 1.00 0.00 O ATOM 1062 CB SER A 65 -7.908 -9.746 -3.200 1.00 0.00 C ATOM 1063 OG SER A 65 -7.432 -10.644 -4.166 1.00 0.00 O ATOM 0 H SER A 65 -7.281 -8.294 -0.770 1.00 0.00 H new ATOM 0 HA SER A 65 -7.762 -11.087 -1.550 1.00 0.00 H new ATOM 0 HB2 SER A 65 -8.998 -9.758 -3.193 1.00 0.00 H new ATOM 0 HB3 SER A 65 -7.602 -8.732 -3.459 1.00 0.00 H new ATOM 0 HG SER A 65 -7.785 -10.395 -5.046 1.00 0.00 H new ATOM 1069 N GLN A 66 -5.310 -11.354 -1.725 1.00 0.00 N ATOM 1070 CA GLN A 66 -3.870 -11.547 -1.846 1.00 0.00 C ATOM 1071 C GLN A 66 -3.531 -12.136 -3.207 1.00 0.00 C ATOM 1072 O GLN A 66 -4.213 -13.037 -3.695 1.00 0.00 O ATOM 1073 CB GLN A 66 -3.348 -12.459 -0.732 1.00 0.00 C ATOM 1074 CG GLN A 66 -1.850 -12.703 -0.779 1.00 0.00 C ATOM 1075 CD GLN A 66 -1.376 -13.611 0.340 1.00 0.00 C ATOM 1076 OE1 GLN A 66 -2.003 -13.691 1.401 1.00 0.00 O ATOM 1077 NE2 GLN A 66 -0.265 -14.301 0.111 1.00 0.00 N ATOM 0 H GLN A 66 -5.838 -12.209 -1.552 1.00 0.00 H new ATOM 0 HA GLN A 66 -3.385 -10.575 -1.750 1.00 0.00 H new ATOM 0 HB2 GLN A 66 -3.603 -12.019 0.232 1.00 0.00 H new ATOM 0 HB3 GLN A 66 -3.863 -13.418 -0.791 1.00 0.00 H new ATOM 0 HG2 GLN A 66 -1.587 -13.147 -1.739 1.00 0.00 H new ATOM 0 HG3 GLN A 66 -1.327 -11.749 -0.715 1.00 0.00 H new ATOM 0 HE21 GLN A 66 0.221 -14.204 -0.781 1.00 0.00 H new ATOM 0 HE22 GLN A 66 0.103 -14.928 0.827 1.00 0.00 H new ATOM 1086 N GLU A 67 -2.459 -11.629 -3.812 1.00 0.00 N ATOM 1087 CA GLU A 67 -1.999 -12.137 -5.103 1.00 0.00 C ATOM 1088 C GLU A 67 -0.569 -12.655 -4.986 1.00 0.00 C ATOM 1089 O GLU A 67 0.300 -11.983 -4.434 1.00 0.00 O ATOM 1090 CB GLU A 67 -2.076 -11.046 -6.173 1.00 0.00 C ATOM 1091 CG GLU A 67 -1.596 -11.480 -7.550 1.00 0.00 C ATOM 1092 CD GLU A 67 -2.515 -12.474 -8.204 1.00 0.00 C ATOM 1093 OE1 GLU A 67 -3.706 -12.289 -8.134 1.00 0.00 O ATOM 1094 OE2 GLU A 67 -2.024 -13.421 -8.774 1.00 0.00 O ATOM 0 H GLU A 67 -1.894 -10.870 -3.431 1.00 0.00 H new ATOM 0 HA GLU A 67 -2.651 -12.958 -5.400 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -3.108 -10.705 -6.253 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -1.482 -10.192 -5.847 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -1.504 -10.603 -8.190 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -0.601 -11.916 -7.461 1.00 0.00 H new ATOM 1101 N LYS A 68 -0.332 -13.857 -5.511 1.00 0.00 N ATOM 1102 CA LYS A 68 0.987 -14.488 -5.422 1.00 0.00 C ATOM 1103 C LYS A 68 1.681 -14.472 -6.777 1.00 0.00 C ATOM 1104 O LYS A 68 1.072 -14.786 -7.800 1.00 0.00 O ATOM 1105 CB LYS A 68 0.869 -15.923 -4.907 1.00 0.00 C ATOM 1106 CG LYS A 68 2.200 -16.644 -4.742 1.00 0.00 C ATOM 1107 CD LYS A 68 2.005 -18.041 -4.174 1.00 0.00 C ATOM 1108 CE LYS A 68 3.333 -18.768 -4.021 1.00 0.00 C ATOM 1109 NZ LYS A 68 3.158 -20.138 -3.467 1.00 0.00 N ATOM 0 H LYS A 68 -1.033 -14.413 -6.001 1.00 0.00 H new ATOM 0 HA LYS A 68 1.588 -13.916 -4.715 1.00 0.00 H new ATOM 0 HB2 LYS A 68 0.355 -15.910 -3.946 1.00 0.00 H new ATOM 0 HB3 LYS A 68 0.244 -16.493 -5.595 1.00 0.00 H new ATOM 0 HG2 LYS A 68 2.703 -16.708 -5.707 1.00 0.00 H new ATOM 0 HG3 LYS A 68 2.849 -16.068 -4.082 1.00 0.00 H new ATOM 0 HD2 LYS A 68 1.510 -17.976 -3.205 1.00 0.00 H new ATOM 0 HD3 LYS A 68 1.348 -18.613 -4.829 1.00 0.00 H new ATOM 0 HE2 LYS A 68 3.826 -18.829 -4.991 1.00 0.00 H new ATOM 0 HE3 LYS A 68 3.988 -18.193 -3.366 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 4.087 -20.598 -3.379 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 2.711 -20.079 -2.530 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 2.554 -20.696 -4.104 1.00 0.00 H new ATOM 1123 N GLN A 69 2.958 -14.100 -6.780 1.00 0.00 N ATOM 1124 CA GLN A 69 3.752 -14.145 -7.998 1.00 0.00 C ATOM 1125 C GLN A 69 5.159 -14.651 -7.698 1.00 0.00 C ATOM 1126 O GLN A 69 5.961 -13.955 -7.077 1.00 0.00 O ATOM 1127 CB GLN A 69 3.816 -12.761 -8.651 1.00 0.00 C ATOM 1128 CG GLN A 69 4.712 -12.692 -9.876 1.00 0.00 C ATOM 1129 CD GLN A 69 4.211 -13.565 -11.010 1.00 0.00 C ATOM 1130 OE1 GLN A 69 3.044 -13.485 -11.404 1.00 0.00 O ATOM 1131 NE2 GLN A 69 5.091 -14.405 -11.543 1.00 0.00 N ATOM 0 H GLN A 69 3.460 -13.767 -5.957 1.00 0.00 H new ATOM 0 HA GLN A 69 3.273 -14.835 -8.693 1.00 0.00 H new ATOM 0 HB2 GLN A 69 2.808 -12.458 -8.934 1.00 0.00 H new ATOM 0 HB3 GLN A 69 4.170 -12.040 -7.914 1.00 0.00 H new ATOM 0 HG2 GLN A 69 4.776 -11.659 -10.218 1.00 0.00 H new ATOM 0 HG3 GLN A 69 5.721 -13.001 -9.602 1.00 0.00 H new ATOM 0 HE21 GLN A 69 6.046 -14.438 -11.186 1.00 0.00 H new ATOM 0 HE22 GLN A 69 4.812 -15.017 -12.310 1.00 0.00 H new ATOM 1140 N ASP A 70 5.449 -15.870 -8.140 1.00 0.00 N ATOM 1141 CA ASP A 70 6.699 -16.529 -7.780 1.00 0.00 C ATOM 1142 C ASP A 70 6.904 -16.506 -6.260 1.00 0.00 C ATOM 1143 O ASP A 70 6.124 -17.095 -5.514 1.00 0.00 O ATOM 1144 CB ASP A 70 7.882 -15.855 -8.478 1.00 0.00 C ATOM 1145 CG ASP A 70 7.805 -15.947 -9.996 1.00 0.00 C ATOM 1146 OD1 ASP A 70 7.549 -17.018 -10.494 1.00 0.00 O ATOM 1147 OD2 ASP A 70 8.003 -14.947 -10.643 1.00 0.00 O ATOM 0 H ASP A 70 4.839 -16.419 -8.745 1.00 0.00 H new ATOM 0 HA ASP A 70 6.642 -17.567 -8.109 1.00 0.00 H new ATOM 0 HB2 ASP A 70 7.921 -14.806 -8.184 1.00 0.00 H new ATOM 0 HB3 ASP A 70 8.809 -16.316 -8.138 1.00 0.00 H new ATOM 1152 N GLY A 71 7.959 -15.821 -5.811 1.00 0.00 N ATOM 1153 CA GLY A 71 8.254 -15.705 -4.378 1.00 0.00 C ATOM 1154 C GLY A 71 7.865 -14.326 -3.850 1.00 0.00 C ATOM 1155 O GLY A 71 8.429 -13.847 -2.865 1.00 0.00 O ATOM 0 H GLY A 71 8.623 -15.339 -6.417 1.00 0.00 H new ATOM 0 HA2 GLY A 71 7.713 -16.475 -3.828 1.00 0.00 H new ATOM 0 HA3 GLY A 71 9.316 -15.878 -4.206 1.00 0.00 H new ATOM 1159 N MET A 72 6.898 -13.695 -4.518 1.00 0.00 N ATOM 1160 CA MET A 72 6.389 -12.390 -4.085 1.00 0.00 C ATOM 1161 C MET A 72 4.905 -12.479 -3.754 1.00 0.00 C ATOM 1162 O MET A 72 4.124 -13.069 -4.499 1.00 0.00 O ATOM 1163 CB MET A 72 6.633 -11.335 -5.162 1.00 0.00 C ATOM 1164 CG MET A 72 6.027 -9.972 -4.857 1.00 0.00 C ATOM 1165 SD MET A 72 6.467 -8.726 -6.084 1.00 0.00 S ATOM 1166 CE MET A 72 5.640 -7.286 -5.416 1.00 0.00 C ATOM 0 H MET A 72 6.452 -14.064 -5.358 1.00 0.00 H new ATOM 0 HA MET A 72 6.927 -12.094 -3.184 1.00 0.00 H new ATOM 0 HB2 MET A 72 7.708 -11.218 -5.302 1.00 0.00 H new ATOM 0 HB3 MET A 72 6.226 -11.697 -6.106 1.00 0.00 H new ATOM 0 HG2 MET A 72 4.942 -10.063 -4.811 1.00 0.00 H new ATOM 0 HG3 MET A 72 6.361 -9.642 -3.874 1.00 0.00 H new ATOM 0 HE1 MET A 72 5.541 -6.529 -6.194 1.00 0.00 H new ATOM 0 HE2 MET A 72 4.650 -7.569 -5.057 1.00 0.00 H new ATOM 0 HE3 MET A 72 6.224 -6.882 -4.589 1.00 0.00 H new ATOM 1176 N ASP A 73 4.525 -11.883 -2.626 1.00 0.00 N ATOM 1177 CA ASP A 73 3.127 -11.864 -2.195 1.00 0.00 C ATOM 1178 C ASP A 73 2.689 -10.432 -1.922 1.00 0.00 C ATOM 1179 O ASP A 73 3.396 -9.676 -1.252 1.00 0.00 O ATOM 1180 CB ASP A 73 2.929 -12.718 -0.941 1.00 0.00 C ATOM 1181 CG ASP A 73 3.067 -14.210 -1.213 1.00 0.00 C ATOM 1182 OD1 ASP A 73 2.132 -14.794 -1.708 1.00 0.00 O ATOM 1183 OD2 ASP A 73 4.107 -14.752 -0.923 1.00 0.00 O ATOM 0 H ASP A 73 5.166 -11.406 -1.992 1.00 0.00 H new ATOM 0 HA ASP A 73 2.516 -12.283 -2.994 1.00 0.00 H new ATOM 0 HB2 ASP A 73 3.658 -12.422 -0.187 1.00 0.00 H new ATOM 0 HB3 ASP A 73 1.942 -12.519 -0.524 1.00 0.00 H new ATOM 1188 N VAL A 74 1.520 -10.061 -2.434 1.00 0.00 N ATOM 1189 CA VAL A 74 0.988 -8.715 -2.230 1.00 0.00 C ATOM 1190 C VAL A 74 -0.444 -8.779 -1.720 1.00 0.00 C ATOM 1191 O VAL A 74 -1.243 -9.589 -2.195 1.00 0.00 O ATOM 1192 CB VAL A 74 1.028 -7.912 -3.544 1.00 0.00 C ATOM 1193 CG1 VAL A 74 0.261 -8.640 -4.637 1.00 0.00 C ATOM 1194 CG2 VAL A 74 0.456 -6.521 -3.318 1.00 0.00 C ATOM 0 H VAL A 74 0.923 -10.671 -2.992 1.00 0.00 H new ATOM 0 HA VAL A 74 1.611 -8.216 -1.487 1.00 0.00 H new ATOM 0 HB VAL A 74 2.064 -7.814 -3.867 1.00 0.00 H new ATOM 0 HG11 VAL A 74 0.300 -8.058 -5.558 1.00 0.00 H new ATOM 0 HG12 VAL A 74 0.710 -9.619 -4.807 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -0.778 -8.766 -4.331 1.00 0.00 H new ATOM 0 HG21 VAL A 74 0.487 -5.959 -4.251 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -0.576 -6.603 -2.978 1.00 0.00 H new ATOM 0 HG23 VAL A 74 1.047 -6.003 -2.562 1.00 0.00 H new ATOM 1204 N LEU A 75 -0.768 -7.932 -0.741 1.00 0.00 N ATOM 1205 CA LEU A 75 -2.129 -7.884 -0.194 1.00 0.00 C ATOM 1206 C LEU A 75 -2.797 -6.564 -0.573 1.00 0.00 C ATOM 1207 O LEU A 75 -2.268 -5.484 -0.310 1.00 0.00 O ATOM 1208 CB LEU A 75 -2.105 -8.038 1.332 1.00 0.00 C ATOM 1209 CG LEU A 75 -3.464 -7.929 2.034 1.00 0.00 C ATOM 1210 CD1 LEU A 75 -4.349 -9.094 1.610 1.00 0.00 C ATOM 1211 CD2 LEU A 75 -3.259 -7.919 3.541 1.00 0.00 C ATOM 0 H LEU A 75 -0.115 -7.275 -0.313 1.00 0.00 H new ATOM 0 HA LEU A 75 -2.700 -8.710 -0.617 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -1.669 -9.007 1.574 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -1.442 -7.278 1.745 1.00 0.00 H new ATOM 0 HG LEU A 75 -3.957 -7.000 1.749 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -5.315 -9.017 2.109 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -4.495 -9.066 0.530 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -3.871 -10.034 1.887 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -4.225 -7.841 4.039 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -2.766 -8.842 3.847 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -2.639 -7.067 3.818 1.00 0.00 H new ATOM 1223 N GLU A 76 -3.974 -6.679 -1.181 1.00 0.00 N ATOM 1224 CA GLU A 76 -4.731 -5.507 -1.607 1.00 0.00 C ATOM 1225 C GLU A 76 -5.890 -5.283 -0.648 1.00 0.00 C ATOM 1226 O GLU A 76 -6.716 -6.179 -0.436 1.00 0.00 O ATOM 1227 CB GLU A 76 -5.250 -5.679 -3.036 1.00 0.00 C ATOM 1228 CG GLU A 76 -6.003 -4.474 -3.581 1.00 0.00 C ATOM 1229 CD GLU A 76 -6.535 -4.695 -4.969 1.00 0.00 C ATOM 1230 OE1 GLU A 76 -6.437 -5.797 -5.454 1.00 0.00 O ATOM 1231 OE2 GLU A 76 -7.039 -3.761 -5.547 1.00 0.00 O ATOM 0 H GLU A 76 -4.423 -7.571 -1.389 1.00 0.00 H new ATOM 0 HA GLU A 76 -4.073 -4.638 -1.594 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -4.407 -5.892 -3.693 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -5.907 -6.548 -3.069 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -6.831 -4.237 -2.913 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -5.340 -3.609 -3.585 1.00 0.00 H new ATOM 1238 N LEU A 77 -5.938 -4.090 -0.060 1.00 0.00 N ATOM 1239 CA LEU A 77 -7.026 -3.716 0.846 1.00 0.00 C ATOM 1240 C LEU A 77 -7.738 -2.480 0.318 1.00 0.00 C ATOM 1241 O LEU A 77 -7.221 -1.367 0.412 1.00 0.00 O ATOM 1242 CB LEU A 77 -6.488 -3.446 2.257 1.00 0.00 C ATOM 1243 CG LEU A 77 -5.678 -4.586 2.889 1.00 0.00 C ATOM 1244 CD1 LEU A 77 -5.073 -4.111 4.203 1.00 0.00 C ATOM 1245 CD2 LEU A 77 -6.581 -5.791 3.106 1.00 0.00 C ATOM 0 H LEU A 77 -5.235 -3.363 -0.194 1.00 0.00 H new ATOM 0 HA LEU A 77 -7.733 -4.544 0.898 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -5.861 -2.555 2.223 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -7.331 -3.218 2.910 1.00 0.00 H new ATOM 0 HG LEU A 77 -4.867 -4.880 2.223 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -4.498 -4.920 4.652 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -4.418 -3.261 4.015 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -5.870 -3.812 4.883 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -6.006 -6.601 3.555 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -7.401 -5.517 3.770 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -6.985 -6.120 2.149 1.00 0.00 H new ATOM 1257 N ASN A 78 -8.936 -2.684 -0.231 1.00 0.00 N ATOM 1258 CA ASN A 78 -9.731 -1.586 -0.775 1.00 0.00 C ATOM 1259 C ASN A 78 -10.855 -1.233 0.191 1.00 0.00 C ATOM 1260 O ASN A 78 -11.671 -2.086 0.537 1.00 0.00 O ATOM 1261 CB ASN A 78 -10.284 -1.939 -2.143 1.00 0.00 C ATOM 1262 CG ASN A 78 -9.202 -2.180 -3.159 1.00 0.00 C ATOM 1263 OD1 ASN A 78 -9.511 -2.952 -4.169 1.00 0.00 O flip ATOM 1264 ND2 ASN A 78 -8.086 -1.665 -3.029 1.00 0.00 N flip ATOM 0 H ASN A 78 -9.376 -3.601 -0.310 1.00 0.00 H new ATOM 0 HA ASN A 78 -9.086 -0.716 -0.896 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -10.905 -2.831 -2.061 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -10.929 -1.132 -2.489 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -7.890 -1.069 -2.225 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -7.361 -1.836 -3.726 1.00 0.00 H new ATOM 1271 N ILE A 79 -10.892 0.020 0.639 1.00 0.00 N ATOM 1272 CA ILE A 79 -11.812 0.435 1.700 1.00 0.00 C ATOM 1273 C ILE A 79 -12.736 1.533 1.190 1.00 0.00 C ATOM 1274 O ILE A 79 -12.276 2.544 0.672 1.00 0.00 O ATOM 1275 CB ILE A 79 -11.048 0.934 2.940 1.00 0.00 C ATOM 1276 CG1 ILE A 79 -10.131 -0.167 3.481 1.00 0.00 C ATOM 1277 CG2 ILE A 79 -12.021 1.396 4.014 1.00 0.00 C ATOM 1278 CD1 ILE A 79 -9.102 0.328 4.471 1.00 0.00 C ATOM 0 H ILE A 79 -10.296 0.768 0.284 1.00 0.00 H new ATOM 0 HA ILE A 79 -12.403 -0.434 1.990 1.00 0.00 H new ATOM 0 HB ILE A 79 -10.431 1.784 2.648 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -10.742 -0.933 3.958 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -9.618 -0.643 2.645 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -11.464 1.745 4.883 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -12.634 2.209 3.625 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -12.664 0.565 4.305 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -8.491 -0.509 4.809 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -8.466 1.073 3.993 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -9.607 0.777 5.326 1.00 0.00 H new ATOM 1290 N THR A 80 -14.044 1.341 1.347 1.00 0.00 N ATOM 1291 CA THR A 80 -15.015 2.334 0.890 1.00 0.00 C ATOM 1292 C THR A 80 -15.650 3.002 2.101 1.00 0.00 C ATOM 1293 O THR A 80 -16.211 2.325 2.965 1.00 0.00 O ATOM 1294 CB THR A 80 -16.103 1.702 0.002 1.00 0.00 C ATOM 1295 OG1 THR A 80 -15.497 1.120 -1.160 1.00 0.00 O ATOM 1296 CG2 THR A 80 -17.115 2.752 -0.430 1.00 0.00 C ATOM 0 H THR A 80 -14.454 0.515 1.783 1.00 0.00 H new ATOM 0 HA THR A 80 -14.492 3.074 0.285 1.00 0.00 H new ATOM 0 HB THR A 80 -16.617 0.931 0.576 1.00 0.00 H new ATOM 0 HG1 THR A 80 -16.190 0.717 -1.723 1.00 0.00 H new ATOM 0 HG21 THR A 80 -17.876 2.287 -1.057 1.00 0.00 H new ATOM 0 HG22 THR A 80 -17.586 3.187 0.451 1.00 0.00 H new ATOM 0 HG23 THR A 80 -16.609 3.535 -0.994 1.00 0.00 H new ATOM 1304 N LEU A 81 -15.554 4.321 2.179 1.00 0.00 N ATOM 1305 CA LEU A 81 -16.073 5.037 3.335 1.00 0.00 C ATOM 1306 C LEU A 81 -17.181 6.011 2.902 1.00 0.00 C ATOM 1307 O LEU A 81 -16.925 6.898 2.070 1.00 0.00 O ATOM 1308 CB LEU A 81 -14.943 5.798 4.039 1.00 0.00 C ATOM 1309 CG LEU A 81 -15.375 6.712 5.193 1.00 0.00 C ATOM 1310 CD1 LEU A 81 -15.922 5.866 6.334 1.00 0.00 C ATOM 1311 CD2 LEU A 81 -14.188 7.547 5.651 1.00 0.00 C ATOM 1312 OXT LEU A 81 -18.282 5.912 3.367 1.00 0.00 O ATOM 0 H LEU A 81 -15.127 4.911 1.465 1.00 0.00 H new ATOM 0 HA LEU A 81 -16.495 4.315 4.034 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -14.226 5.073 4.423 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -14.420 6.402 3.298 1.00 0.00 H new ATOM 0 HG LEU A 81 -16.162 7.388 4.859 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -16.229 6.515 7.154 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -16.781 5.294 5.983 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -15.148 5.182 6.683 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -14.495 8.196 6.471 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -13.389 6.888 5.990 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -13.829 8.156 4.821 1.00 0.00 H new ATOM 1325 N MET B 1 -3.634 -6.794 -15.570 1.00 0.00 N ATOM 1326 CA MET B 1 -4.946 -6.853 -14.868 1.00 0.00 C ATOM 1327 C MET B 1 -4.742 -6.531 -13.390 1.00 0.00 C ATOM 1328 O MET B 1 -5.371 -5.622 -12.851 1.00 0.00 O ATOM 1329 CB MET B 1 -5.597 -8.225 -15.031 1.00 0.00 C ATOM 1330 CG MET B 1 -6.056 -8.540 -16.448 1.00 0.00 C ATOM 1331 SD MET B 1 -6.706 -10.215 -16.612 1.00 0.00 S ATOM 1332 CE MET B 1 -8.241 -10.073 -15.702 1.00 0.00 C ATOM 0 H1 MET B 1 -3.790 -6.623 -16.584 1.00 0.00 H new ATOM 0 H2 MET B 1 -3.062 -6.022 -15.172 1.00 0.00 H new ATOM 0 H3 MET B 1 -3.132 -7.696 -15.445 1.00 0.00 H new ATOM 0 HA MET B 1 -5.615 -6.116 -15.312 1.00 0.00 H new ATOM 0 HB2 MET B 1 -4.888 -8.990 -14.713 1.00 0.00 H new ATOM 0 HB3 MET B 1 -6.455 -8.288 -14.362 1.00 0.00 H new ATOM 0 HG2 MET B 1 -6.824 -7.826 -16.744 1.00 0.00 H new ATOM 0 HG3 MET B 1 -5.219 -8.410 -17.134 1.00 0.00 H new ATOM 0 HE1 MET B 1 -8.857 -10.953 -15.888 1.00 0.00 H new ATOM 0 HE2 MET B 1 -8.026 -9.999 -14.636 1.00 0.00 H new ATOM 0 HE3 MET B 1 -8.776 -9.181 -16.027 1.00 0.00 H new ATOM 1344 N SER B 2 -3.858 -7.284 -12.743 1.00 0.00 N ATOM 1345 CA SER B 2 -3.606 -7.092 -11.320 1.00 0.00 C ATOM 1346 C SER B 2 -2.699 -5.886 -11.092 1.00 0.00 C ATOM 1347 O SER B 2 -1.832 -5.585 -11.913 1.00 0.00 O ATOM 1348 CB SER B 2 -2.976 -8.336 -10.726 1.00 0.00 C ATOM 1349 OG SER B 2 -2.584 -8.116 -9.399 1.00 0.00 O ATOM 0 H SER B 2 -3.309 -8.026 -13.177 1.00 0.00 H new ATOM 0 HA SER B 2 -4.559 -6.907 -10.825 1.00 0.00 H new ATOM 0 HB2 SER B 2 -3.686 -9.162 -10.767 1.00 0.00 H new ATOM 0 HB3 SER B 2 -2.111 -8.629 -11.321 1.00 0.00 H new ATOM 0 HG SER B 2 -2.789 -8.910 -8.862 1.00 0.00 H new ATOM 1355 N LEU B 3 -2.904 -5.203 -9.972 1.00 0.00 N ATOM 1356 CA LEU B 3 -2.020 -4.114 -9.574 1.00 0.00 C ATOM 1357 C LEU B 3 -0.565 -4.571 -9.571 1.00 0.00 C ATOM 1358 O LEU B 3 0.338 -3.802 -9.896 1.00 0.00 O ATOM 1359 CB LEU B 3 -2.406 -3.597 -8.182 1.00 0.00 C ATOM 1360 CG LEU B 3 -1.660 -2.343 -7.708 1.00 0.00 C ATOM 1361 CD1 LEU B 3 -0.300 -2.741 -7.151 1.00 0.00 C ATOM 1362 CD2 LEU B 3 -1.513 -1.371 -8.868 1.00 0.00 C ATOM 0 H LEU B 3 -3.672 -5.383 -9.325 1.00 0.00 H new ATOM 0 HA LEU B 3 -2.129 -3.307 -10.298 1.00 0.00 H new ATOM 0 HB2 LEU B 3 -3.475 -3.385 -8.177 1.00 0.00 H new ATOM 0 HB3 LEU B 3 -2.236 -4.394 -7.458 1.00 0.00 H new ATOM 0 HG LEU B 3 -2.225 -1.850 -6.916 1.00 0.00 H new ATOM 0 HD11 LEU B 3 0.230 -1.850 -6.814 1.00 0.00 H new ATOM 0 HD12 LEU B 3 -0.436 -3.422 -6.311 1.00 0.00 H new ATOM 0 HD13 LEU B 3 0.281 -3.237 -7.929 1.00 0.00 H new ATOM 0 HD21 LEU B 3 -0.983 -0.480 -8.531 1.00 0.00 H new ATOM 0 HD22 LEU B 3 -0.950 -1.846 -9.672 1.00 0.00 H new ATOM 0 HD23 LEU B 3 -2.500 -1.089 -9.234 1.00 0.00 H new ATOM 1374 N ILE B 4 -0.345 -5.827 -9.202 1.00 0.00 N ATOM 1375 CA ILE B 4 1.006 -6.367 -9.120 1.00 0.00 C ATOM 1376 C ILE B 4 1.600 -6.535 -10.512 1.00 0.00 C ATOM 1377 O ILE B 4 2.811 -6.408 -10.704 1.00 0.00 O ATOM 1378 CB ILE B 4 1.019 -7.719 -8.384 1.00 0.00 C ATOM 1379 CG1 ILE B 4 2.359 -7.929 -7.675 1.00 0.00 C ATOM 1380 CG2 ILE B 4 0.744 -8.856 -9.357 1.00 0.00 C ATOM 1381 CD1 ILE B 4 3.486 -8.323 -8.603 1.00 0.00 C ATOM 0 H ILE B 4 -1.082 -6.488 -8.956 1.00 0.00 H new ATOM 0 HA ILE B 4 1.612 -5.658 -8.556 1.00 0.00 H new ATOM 0 HB ILE B 4 0.230 -7.712 -7.632 1.00 0.00 H new ATOM 0 HG12 ILE B 4 2.633 -7.010 -7.156 1.00 0.00 H new ATOM 0 HG13 ILE B 4 2.240 -8.701 -6.915 1.00 0.00 H new ATOM 0 HG21 ILE B 4 0.757 -9.805 -8.821 1.00 0.00 H new ATOM 0 HG22 ILE B 4 -0.233 -8.712 -9.817 1.00 0.00 H new ATOM 0 HG23 ILE B 4 1.512 -8.866 -10.131 1.00 0.00 H new ATOM 0 HD11 ILE B 4 4.402 -8.454 -8.027 1.00 0.00 H new ATOM 0 HD12 ILE B 4 3.235 -9.258 -9.103 1.00 0.00 H new ATOM 0 HD13 ILE B 4 3.634 -7.541 -9.348 1.00 0.00 H new ATOM 1393 N GLU B 5 0.738 -6.800 -11.488 1.00 0.00 N ATOM 1394 CA GLU B 5 1.178 -6.850 -12.873 1.00 0.00 C ATOM 1395 C GLU B 5 1.521 -5.459 -13.383 1.00 0.00 C ATOM 1396 O GLU B 5 2.381 -5.308 -14.238 1.00 0.00 O ATOM 1397 CB GLU B 5 0.096 -7.478 -13.755 1.00 0.00 C ATOM 1398 CG GLU B 5 -0.122 -8.965 -13.520 1.00 0.00 C ATOM 1399 CD GLU B 5 -1.253 -9.527 -14.336 1.00 0.00 C ATOM 1400 OE1 GLU B 5 -2.234 -8.844 -14.506 1.00 0.00 O ATOM 1401 OE2 GLU B 5 -1.136 -10.641 -14.790 1.00 0.00 O ATOM 0 H GLU B 5 -0.256 -6.981 -11.347 1.00 0.00 H new ATOM 0 HA GLU B 5 2.075 -7.467 -12.920 1.00 0.00 H new ATOM 0 HB2 GLU B 5 -0.844 -6.954 -13.584 1.00 0.00 H new ATOM 0 HB3 GLU B 5 0.362 -7.323 -14.801 1.00 0.00 H new ATOM 0 HG2 GLU B 5 0.795 -9.504 -13.760 1.00 0.00 H new ATOM 0 HG3 GLU B 5 -0.324 -9.135 -12.462 1.00 0.00 H new ATOM 1408 N LEU B 6 0.833 -4.448 -12.866 1.00 0.00 N ATOM 1409 CA LEU B 6 1.194 -3.066 -13.168 1.00 0.00 C ATOM 1410 C LEU B 6 2.550 -2.706 -12.546 1.00 0.00 C ATOM 1411 O LEU B 6 3.336 -1.969 -13.138 1.00 0.00 O ATOM 1412 CB LEU B 6 0.111 -2.112 -12.649 1.00 0.00 C ATOM 1413 CG LEU B 6 -1.237 -2.178 -13.377 1.00 0.00 C ATOM 1414 CD1 LEU B 6 -2.264 -1.345 -12.622 1.00 0.00 C ATOM 1415 CD2 LEU B 6 -1.070 -1.677 -14.804 1.00 0.00 C ATOM 0 H LEU B 6 0.032 -4.555 -12.244 1.00 0.00 H new ATOM 0 HA LEU B 6 1.273 -2.964 -14.250 1.00 0.00 H new ATOM 0 HB2 LEU B 6 -0.057 -2.322 -11.593 1.00 0.00 H new ATOM 0 HB3 LEU B 6 0.489 -1.092 -12.715 1.00 0.00 H new ATOM 0 HG LEU B 6 -1.589 -3.209 -13.414 1.00 0.00 H new ATOM 0 HD11 LEU B 6 -3.222 -1.392 -13.140 1.00 0.00 H new ATOM 0 HD12 LEU B 6 -2.378 -1.737 -11.611 1.00 0.00 H new ATOM 0 HD13 LEU B 6 -1.928 -0.309 -12.574 1.00 0.00 H new ATOM 0 HD21 LEU B 6 -2.029 -1.724 -15.321 1.00 0.00 H new ATOM 0 HD22 LEU B 6 -0.716 -0.646 -14.789 1.00 0.00 H new ATOM 0 HD23 LEU B 6 -0.345 -2.301 -15.326 1.00 0.00 H new ATOM 1427 N LEU B 7 2.799 -3.209 -11.344 1.00 0.00 N ATOM 1428 CA LEU B 7 4.100 -3.045 -10.701 1.00 0.00 C ATOM 1429 C LEU B 7 5.184 -3.795 -11.469 1.00 0.00 C ATOM 1430 O LEU B 7 6.316 -3.329 -11.574 1.00 0.00 O ATOM 1431 CB LEU B 7 4.047 -3.549 -9.254 1.00 0.00 C ATOM 1432 CG LEU B 7 3.207 -2.705 -8.286 1.00 0.00 C ATOM 1433 CD1 LEU B 7 3.117 -3.413 -6.941 1.00 0.00 C ATOM 1434 CD2 LEU B 7 3.836 -1.328 -8.137 1.00 0.00 C ATOM 0 H LEU B 7 2.119 -3.734 -10.794 1.00 0.00 H new ATOM 0 HA LEU B 7 4.345 -1.983 -10.701 1.00 0.00 H new ATOM 0 HB2 LEU B 7 3.653 -4.565 -9.257 1.00 0.00 H new ATOM 0 HB3 LEU B 7 5.066 -3.603 -8.870 1.00 0.00 H new ATOM 0 HG LEU B 7 2.198 -2.582 -8.678 1.00 0.00 H new ATOM 0 HD11 LEU B 7 2.520 -2.813 -6.253 1.00 0.00 H new ATOM 0 HD12 LEU B 7 2.648 -4.388 -7.074 1.00 0.00 H new ATOM 0 HD13 LEU B 7 4.119 -3.545 -6.532 1.00 0.00 H new ATOM 0 HD21 LEU B 7 3.240 -0.728 -7.450 1.00 0.00 H new ATOM 0 HD22 LEU B 7 4.848 -1.431 -7.745 1.00 0.00 H new ATOM 0 HD23 LEU B 7 3.872 -0.837 -9.110 1.00 0.00 H new ATOM 1446 N PHE B 8 4.830 -4.966 -11.987 1.00 0.00 N ATOM 1447 CA PHE B 8 5.779 -5.800 -12.729 1.00 0.00 C ATOM 1448 C PHE B 8 5.407 -5.896 -14.204 1.00 0.00 C ATOM 1449 O PHE B 8 5.284 -6.991 -14.755 1.00 0.00 O ATOM 1450 CB PHE B 8 5.842 -7.205 -12.127 1.00 0.00 C ATOM 1451 CG PHE B 8 6.948 -8.055 -12.685 1.00 0.00 C ATOM 1452 CD1 PHE B 8 8.253 -7.900 -12.240 1.00 0.00 C ATOM 1453 CD2 PHE B 8 6.687 -9.010 -13.655 1.00 0.00 C ATOM 1454 CE1 PHE B 8 9.271 -8.681 -12.752 1.00 0.00 C ATOM 1455 CE2 PHE B 8 7.703 -9.793 -14.168 1.00 0.00 C ATOM 1456 CZ PHE B 8 8.997 -9.628 -13.716 1.00 0.00 C ATOM 0 H PHE B 8 3.893 -5.363 -11.909 1.00 0.00 H new ATOM 0 HA PHE B 8 6.757 -5.326 -12.651 1.00 0.00 H new ATOM 0 HB2 PHE B 8 5.969 -7.122 -11.048 1.00 0.00 H new ATOM 0 HB3 PHE B 8 4.889 -7.706 -12.298 1.00 0.00 H new ATOM 0 HD1 PHE B 8 8.475 -7.161 -11.485 1.00 0.00 H new ATOM 0 HD2 PHE B 8 5.677 -9.144 -14.014 1.00 0.00 H new ATOM 0 HE1 PHE B 8 10.282 -8.550 -12.397 1.00 0.00 H new ATOM 0 HE2 PHE B 8 7.485 -10.534 -14.923 1.00 0.00 H new ATOM 0 HZ PHE B 8 9.792 -10.239 -14.116 1.00 0.00 H new ATOM 1466 N GLY B 9 5.221 -4.746 -14.833 1.00 0.00 N ATOM 1467 CA GLY B 9 4.825 -4.695 -16.241 1.00 0.00 C ATOM 1468 C GLY B 9 6.002 -4.323 -17.134 1.00 0.00 C ATOM 1469 O GLY B 9 5.841 -4.129 -18.340 1.00 0.00 O ATOM 0 H GLY B 9 5.337 -3.832 -14.395 1.00 0.00 H new ATOM 0 HA2 GLY B 9 4.427 -5.663 -16.544 1.00 0.00 H new ATOM 0 HA3 GLY B 9 4.024 -3.967 -16.370 1.00 0.00 H new ATOM 1473 N GLN B 10 7.181 -4.219 -16.532 1.00 0.00 N ATOM 1474 CA GLN B 10 8.388 -3.853 -17.267 1.00 0.00 C ATOM 1475 C GLN B 10 9.214 -5.079 -17.577 1.00 0.00 C ATOM 1476 O GLN B 10 10.351 -5.212 -17.124 1.00 0.00 O ATOM 1477 CB GLN B 10 9.226 -2.847 -16.475 1.00 0.00 C ATOM 1478 CG GLN B 10 8.543 -1.509 -16.248 1.00 0.00 C ATOM 1479 CD GLN B 10 9.408 -0.544 -15.459 1.00 0.00 C ATOM 1480 OE1 GLN B 10 10.506 -0.892 -15.017 1.00 0.00 O ATOM 1481 NE2 GLN B 10 8.917 0.677 -15.278 1.00 0.00 N ATOM 0 H GLN B 10 7.328 -4.383 -15.536 1.00 0.00 H new ATOM 0 HA GLN B 10 8.081 -3.388 -18.204 1.00 0.00 H new ATOM 0 HB2 GLN B 10 9.478 -3.282 -15.508 1.00 0.00 H new ATOM 0 HB3 GLN B 10 10.165 -2.678 -17.003 1.00 0.00 H new ATOM 0 HG2 GLN B 10 8.293 -1.064 -17.211 1.00 0.00 H new ATOM 0 HG3 GLN B 10 7.605 -1.669 -15.717 1.00 0.00 H new ATOM 0 HE21 GLN B 10 8.004 0.922 -15.661 1.00 0.00 H new ATOM 0 HE22 GLN B 10 9.453 1.370 -14.756 1.00 0.00 H new ATOM 1490 N MET B 11 8.633 -5.967 -18.356 1.00 0.00 N ATOM 1491 CA MET B 11 9.293 -7.206 -18.702 1.00 0.00 C ATOM 1492 C MET B 11 9.696 -7.959 -17.441 1.00 0.00 C ATOM 1493 O MET B 11 9.239 -7.644 -16.341 1.00 0.00 O ATOM 1494 CB MET B 11 10.509 -6.930 -19.583 1.00 0.00 C ATOM 1495 CG MET B 11 10.179 -6.337 -20.945 1.00 0.00 C ATOM 1496 SD MET B 11 11.643 -6.086 -21.968 1.00 0.00 S ATOM 1497 CE MET B 11 12.381 -4.669 -21.161 1.00 0.00 C ATOM 0 H MET B 11 7.704 -5.853 -18.761 1.00 0.00 H new ATOM 0 HA MET B 11 8.599 -7.830 -19.265 1.00 0.00 H new ATOM 0 HB2 MET B 11 11.177 -6.248 -19.056 1.00 0.00 H new ATOM 0 HB3 MET B 11 11.055 -7.862 -19.729 1.00 0.00 H new ATOM 0 HG2 MET B 11 9.486 -6.997 -21.466 1.00 0.00 H new ATOM 0 HG3 MET B 11 9.669 -5.384 -20.808 1.00 0.00 H new ATOM 0 HE1 MET B 11 13.194 -4.283 -21.776 1.00 0.00 H new ATOM 0 HE2 MET B 11 11.627 -3.893 -21.027 1.00 0.00 H new ATOM 0 HE3 MET B 11 12.772 -4.967 -20.188 1.00 0.00 H new ATOM 1507 N GLN B 12 10.568 -8.944 -17.605 1.00 0.00 N ATOM 1508 CA GLN B 12 11.086 -9.686 -16.462 1.00 0.00 C ATOM 1509 C GLN B 12 12.362 -9.036 -15.948 1.00 0.00 C ATOM 1510 O GLN B 12 13.267 -8.709 -16.716 1.00 0.00 O ATOM 1511 CB GLN B 12 11.351 -11.147 -16.838 1.00 0.00 C ATOM 1512 CG GLN B 12 11.822 -12.011 -15.681 1.00 0.00 C ATOM 1513 CD GLN B 12 12.004 -13.463 -16.080 1.00 0.00 C ATOM 1514 OE1 GLN B 12 12.321 -13.770 -17.233 1.00 0.00 O ATOM 1515 NE2 GLN B 12 11.805 -14.367 -15.127 1.00 0.00 N ATOM 0 H GLN B 12 10.930 -9.247 -18.509 1.00 0.00 H new ATOM 0 HA GLN B 12 10.336 -9.666 -15.671 1.00 0.00 H new ATOM 0 HB2 GLN B 12 10.437 -11.576 -17.249 1.00 0.00 H new ATOM 0 HB3 GLN B 12 12.101 -11.177 -17.628 1.00 0.00 H new ATOM 0 HG2 GLN B 12 12.766 -11.621 -15.300 1.00 0.00 H new ATOM 0 HG3 GLN B 12 11.100 -11.949 -14.867 1.00 0.00 H new ATOM 0 HE21 GLN B 12 11.544 -14.068 -14.187 1.00 0.00 H new ATOM 0 HE22 GLN B 12 11.913 -15.360 -15.335 1.00 0.00 H new ATOM 1524 N LYS B 13 12.422 -8.856 -14.641 1.00 0.00 N ATOM 1525 CA LYS B 13 13.577 -8.242 -14.018 1.00 0.00 C ATOM 1526 C LYS B 13 14.663 -9.279 -13.726 1.00 0.00 C ATOM 1527 O LYS B 13 15.843 -8.961 -13.778 1.00 0.00 O ATOM 1528 CB LYS B 13 13.166 -7.525 -12.731 1.00 0.00 C ATOM 1529 CG LYS B 13 12.192 -6.372 -12.937 1.00 0.00 C ATOM 1530 CD LYS B 13 12.812 -5.267 -13.779 1.00 0.00 C ATOM 1531 CE LYS B 13 11.860 -4.091 -13.939 1.00 0.00 C ATOM 1532 NZ LYS B 13 12.446 -3.010 -14.776 1.00 0.00 N ATOM 0 H LYS B 13 11.684 -9.127 -13.992 1.00 0.00 H new ATOM 0 HA LYS B 13 13.988 -7.511 -14.714 1.00 0.00 H new ATOM 0 HB2 LYS B 13 12.714 -8.250 -12.054 1.00 0.00 H new ATOM 0 HB3 LYS B 13 14.061 -7.145 -12.239 1.00 0.00 H new ATOM 0 HG2 LYS B 13 11.288 -6.739 -13.424 1.00 0.00 H new ATOM 0 HG3 LYS B 13 11.892 -5.970 -11.969 1.00 0.00 H new ATOM 0 HD2 LYS B 13 13.737 -4.928 -13.313 1.00 0.00 H new ATOM 0 HD3 LYS B 13 13.076 -5.660 -14.761 1.00 0.00 H new ATOM 0 HE2 LYS B 13 10.930 -4.436 -14.391 1.00 0.00 H new ATOM 0 HE3 LYS B 13 11.608 -3.692 -12.956 1.00 0.00 H new ATOM 0 HZ1 LYS B 13 11.759 -2.236 -14.874 1.00 0.00 H new ATOM 0 HZ2 LYS B 13 13.311 -2.651 -14.323 1.00 0.00 H new ATOM 0 HZ3 LYS B 13 12.679 -3.387 -15.717 1.00 0.00 H new ATOM 1546 N THR B 14 14.254 -10.511 -13.419 1.00 0.00 N ATOM 1547 CA THR B 14 15.197 -11.589 -13.078 1.00 0.00 C ATOM 1548 C THR B 14 16.398 -11.047 -12.296 1.00 0.00 C ATOM 1549 O THR B 14 16.304 -10.031 -11.609 1.00 0.00 O ATOM 1550 CB THR B 14 15.692 -12.315 -14.343 1.00 0.00 C ATOM 1551 OG1 THR B 14 16.554 -13.398 -13.968 1.00 0.00 O ATOM 1552 CG2 THR B 14 16.452 -11.357 -15.246 1.00 0.00 C ATOM 0 H THR B 14 13.274 -10.792 -13.398 1.00 0.00 H new ATOM 0 HA THR B 14 14.659 -12.300 -12.450 1.00 0.00 H new ATOM 0 HB THR B 14 14.828 -12.699 -14.885 1.00 0.00 H new ATOM 0 HG1 THR B 14 16.285 -13.741 -13.090 1.00 0.00 H new ATOM 0 HG21 THR B 14 16.794 -11.888 -16.134 1.00 0.00 H new ATOM 0 HG22 THR B 14 15.796 -10.539 -15.542 1.00 0.00 H new ATOM 0 HG23 THR B 14 17.312 -10.956 -14.710 1.00 0.00 H new ATOM 1560 N ALA B 15 17.526 -11.739 -12.392 1.00 0.00 N ATOM 1561 CA ALA B 15 18.706 -11.359 -11.624 1.00 0.00 C ATOM 1562 C ALA B 15 18.438 -11.479 -10.126 1.00 0.00 C ATOM 1563 O ALA B 15 17.457 -10.940 -9.616 1.00 0.00 O ATOM 1564 CB ALA B 15 19.097 -9.916 -11.968 1.00 0.00 C ATOM 0 H ALA B 15 17.649 -12.558 -12.987 1.00 0.00 H new ATOM 0 HA ALA B 15 19.523 -12.032 -11.882 1.00 0.00 H new ATOM 0 HB1 ALA B 15 19.979 -9.631 -11.394 1.00 0.00 H new ATOM 0 HB2 ALA B 15 19.318 -9.843 -13.033 1.00 0.00 H new ATOM 0 HB3 ALA B 15 18.272 -9.247 -11.722 1.00 0.00 H new ATOM 1570 N THR B 16 19.321 -12.186 -9.426 1.00 0.00 N ATOM 1571 CA THR B 16 19.185 -12.348 -7.983 1.00 0.00 C ATOM 1572 C THR B 16 20.043 -11.323 -7.253 1.00 0.00 C ATOM 1573 O THR B 16 21.242 -11.209 -7.505 1.00 0.00 O ATOM 1574 CB THR B 16 19.577 -13.769 -7.538 1.00 0.00 C ATOM 1575 OG1 THR B 16 18.708 -14.725 -8.160 1.00 0.00 O ATOM 1576 CG2 THR B 16 19.473 -13.903 -6.026 1.00 0.00 C ATOM 0 H THR B 16 20.132 -12.652 -9.832 1.00 0.00 H new ATOM 0 HA THR B 16 18.137 -12.188 -7.729 1.00 0.00 H new ATOM 0 HB THR B 16 20.608 -13.956 -7.839 1.00 0.00 H new ATOM 0 HG1 THR B 16 18.960 -15.629 -7.877 1.00 0.00 H new ATOM 0 HG21 THR B 16 19.754 -14.914 -5.730 1.00 0.00 H new ATOM 0 HG22 THR B 16 20.143 -13.186 -5.550 1.00 0.00 H new ATOM 0 HG23 THR B 16 18.448 -13.705 -5.713 1.00 0.00 H new ATOM 1584 N VAL B 17 19.419 -10.577 -6.349 1.00 0.00 N ATOM 1585 CA VAL B 17 20.132 -9.560 -5.587 1.00 0.00 C ATOM 1586 C VAL B 17 20.233 -9.968 -4.119 1.00 0.00 C ATOM 1587 O VAL B 17 20.922 -9.323 -3.329 1.00 0.00 O ATOM 1588 CB VAL B 17 19.414 -8.202 -5.697 1.00 0.00 C ATOM 1589 CG1 VAL B 17 19.370 -7.739 -7.146 1.00 0.00 C ATOM 1590 CG2 VAL B 17 18.009 -8.311 -5.124 1.00 0.00 C ATOM 0 H VAL B 17 18.427 -10.657 -6.127 1.00 0.00 H new ATOM 0 HA VAL B 17 21.136 -9.466 -6.001 1.00 0.00 H new ATOM 0 HB VAL B 17 19.969 -7.461 -5.122 1.00 0.00 H new ATOM 0 HG11 VAL B 17 18.859 -6.778 -7.206 1.00 0.00 H new ATOM 0 HG12 VAL B 17 20.386 -7.634 -7.525 1.00 0.00 H new ATOM 0 HG13 VAL B 17 18.833 -8.473 -7.746 1.00 0.00 H new ATOM 0 HG21 VAL B 17 17.507 -7.347 -5.205 1.00 0.00 H new ATOM 0 HG22 VAL B 17 17.446 -9.061 -5.680 1.00 0.00 H new ATOM 0 HG23 VAL B 17 18.065 -8.604 -4.076 1.00 0.00 H new ATOM 1600 N ALA B 18 19.533 -11.044 -3.762 1.00 0.00 N ATOM 1601 CA ALA B 18 19.618 -11.591 -2.412 1.00 0.00 C ATOM 1602 C ALA B 18 19.133 -10.568 -1.390 1.00 0.00 C ATOM 1603 O ALA B 18 19.661 -10.487 -0.281 1.00 0.00 O ATOM 1604 CB ALA B 18 21.061 -11.985 -2.095 1.00 0.00 C ATOM 0 H ALA B 18 18.905 -11.550 -4.386 1.00 0.00 H new ATOM 0 HA ALA B 18 18.982 -12.474 -2.358 1.00 0.00 H new ATOM 0 HB1 ALA B 18 21.114 -12.392 -1.085 1.00 0.00 H new ATOM 0 HB2 ALA B 18 21.398 -12.738 -2.808 1.00 0.00 H new ATOM 0 HB3 ALA B 18 21.702 -11.106 -2.166 1.00 0.00 H new ATOM 1610 N ARG B 19 18.130 -9.786 -1.777 1.00 0.00 N ATOM 1611 CA ARG B 19 17.563 -8.767 -0.893 1.00 0.00 C ATOM 1612 C ARG B 19 16.043 -8.745 -1.019 1.00 0.00 C ATOM 1613 O ARG B 19 15.485 -9.117 -2.055 1.00 0.00 O ATOM 1614 CB ARG B 19 18.121 -7.391 -1.222 1.00 0.00 C ATOM 1615 CG ARG B 19 19.615 -7.232 -0.983 1.00 0.00 C ATOM 1616 CD ARG B 19 19.943 -7.242 0.466 1.00 0.00 C ATOM 1617 NE ARG B 19 21.353 -6.982 0.704 1.00 0.00 N ATOM 1618 CZ ARG B 19 22.315 -7.926 0.707 1.00 0.00 C ATOM 1619 NH1 ARG B 19 22.002 -9.183 0.484 1.00 0.00 N ATOM 1620 NH2 ARG B 19 23.572 -7.588 0.935 1.00 0.00 N ATOM 0 H ARG B 19 17.691 -9.837 -2.697 1.00 0.00 H new ATOM 0 HA ARG B 19 17.838 -9.020 0.131 1.00 0.00 H new ATOM 0 HB2 ARG B 19 17.910 -7.170 -2.268 1.00 0.00 H new ATOM 0 HB3 ARG B 19 17.591 -6.648 -0.626 1.00 0.00 H new ATOM 0 HG2 ARG B 19 20.152 -8.038 -1.483 1.00 0.00 H new ATOM 0 HG3 ARG B 19 19.957 -6.297 -1.427 1.00 0.00 H new ATOM 0 HD2 ARG B 19 19.343 -6.490 0.979 1.00 0.00 H new ATOM 0 HD3 ARG B 19 19.675 -8.209 0.892 1.00 0.00 H new ATOM 0 HE ARG B 19 21.634 -6.018 0.881 1.00 0.00 H new ATOM 0 HH11 ARG B 19 21.032 -9.444 0.309 1.00 0.00 H new ATOM 0 HH12 ARG B 19 22.730 -9.898 0.486 1.00 0.00 H new ATOM 0 HH21 ARG B 19 23.814 -6.613 1.109 1.00 0.00 H new ATOM 0 HH22 ARG B 19 24.300 -8.303 0.937 1.00 0.00 H new ATOM 1634 N ASP B 20 15.376 -8.312 0.053 1.00 0.00 N ATOM 1635 CA ASP B 20 13.920 -8.202 0.054 1.00 0.00 C ATOM 1636 C ASP B 20 13.511 -6.766 -0.247 1.00 0.00 C ATOM 1637 O ASP B 20 14.221 -5.828 0.103 1.00 0.00 O ATOM 1638 CB ASP B 20 13.339 -8.641 1.401 1.00 0.00 C ATOM 1639 CG ASP B 20 13.506 -10.132 1.661 1.00 0.00 C ATOM 1640 OD1 ASP B 20 13.677 -10.864 0.715 1.00 0.00 O ATOM 1641 OD2 ASP B 20 13.462 -10.524 2.802 1.00 0.00 O ATOM 0 H ASP B 20 15.821 -8.033 0.927 1.00 0.00 H new ATOM 0 HA ASP B 20 13.524 -8.861 -0.719 1.00 0.00 H new ATOM 0 HB2 ASP B 20 13.825 -8.081 2.200 1.00 0.00 H new ATOM 0 HB3 ASP B 20 12.279 -8.388 1.434 1.00 0.00 H new ATOM 1646 N ARG B 21 12.370 -6.602 -0.911 1.00 0.00 N ATOM 1647 CA ARG B 21 11.879 -5.276 -1.284 1.00 0.00 C ATOM 1648 C ARG B 21 10.392 -5.168 -0.981 1.00 0.00 C ATOM 1649 O ARG B 21 9.594 -5.992 -1.434 1.00 0.00 O ATOM 1650 CB ARG B 21 12.120 -5.001 -2.761 1.00 0.00 C ATOM 1651 CG ARG B 21 11.691 -3.620 -3.232 1.00 0.00 C ATOM 1652 CD ARG B 21 12.208 -3.318 -4.591 1.00 0.00 C ATOM 1653 NE ARG B 21 11.681 -4.237 -5.588 1.00 0.00 N ATOM 1654 CZ ARG B 21 11.861 -4.109 -6.917 1.00 0.00 C ATOM 1655 NH1 ARG B 21 12.554 -3.098 -7.392 1.00 0.00 N ATOM 1656 NH2 ARG B 21 11.340 -5.000 -7.743 1.00 0.00 N ATOM 0 H ARG B 21 11.767 -7.371 -1.203 1.00 0.00 H new ATOM 0 HA ARG B 21 12.425 -4.535 -0.700 1.00 0.00 H new ATOM 0 HB2 ARG B 21 13.182 -5.127 -2.971 1.00 0.00 H new ATOM 0 HB3 ARG B 21 11.588 -5.751 -3.347 1.00 0.00 H new ATOM 0 HG2 ARG B 21 10.603 -3.558 -3.235 1.00 0.00 H new ATOM 0 HG3 ARG B 21 12.051 -2.868 -2.530 1.00 0.00 H new ATOM 0 HD2 ARG B 21 11.942 -2.296 -4.862 1.00 0.00 H new ATOM 0 HD3 ARG B 21 13.297 -3.373 -4.586 1.00 0.00 H new ATOM 0 HE ARG B 21 11.137 -5.034 -5.258 1.00 0.00 H new ATOM 0 HH11 ARG B 21 12.955 -2.410 -6.754 1.00 0.00 H new ATOM 0 HH12 ARG B 21 12.690 -3.001 -8.398 1.00 0.00 H new ATOM 0 HH21 ARG B 21 10.802 -5.784 -7.374 1.00 0.00 H new ATOM 0 HH22 ARG B 21 11.476 -4.903 -8.749 1.00 0.00 H new ATOM 1670 N LEU B 22 10.024 -4.146 -0.216 1.00 0.00 N ATOM 1671 CA LEU B 22 8.619 -3.877 0.088 1.00 0.00 C ATOM 1672 C LEU B 22 8.121 -2.711 -0.761 1.00 0.00 C ATOM 1673 O LEU B 22 8.771 -1.673 -0.850 1.00 0.00 O ATOM 1674 CB LEU B 22 8.441 -3.557 1.578 1.00 0.00 C ATOM 1675 CG LEU B 22 9.004 -4.597 2.554 1.00 0.00 C ATOM 1676 CD1 LEU B 22 8.815 -4.108 3.984 1.00 0.00 C ATOM 1677 CD2 LEU B 22 8.303 -5.930 2.336 1.00 0.00 C ATOM 0 H LEU B 22 10.679 -3.488 0.207 1.00 0.00 H new ATOM 0 HA LEU B 22 8.034 -4.767 -0.145 1.00 0.00 H new ATOM 0 HB2 LEU B 22 8.916 -2.598 1.784 1.00 0.00 H new ATOM 0 HB3 LEU B 22 7.377 -3.435 1.780 1.00 0.00 H new ATOM 0 HG LEU B 22 10.070 -4.735 2.376 1.00 0.00 H new ATOM 0 HD11 LEU B 22 9.215 -4.848 4.677 1.00 0.00 H new ATOM 0 HD12 LEU B 22 9.341 -3.163 4.118 1.00 0.00 H new ATOM 0 HD13 LEU B 22 7.753 -3.963 4.182 1.00 0.00 H new ATOM 0 HD21 LEU B 22 8.703 -6.669 3.030 1.00 0.00 H new ATOM 0 HD22 LEU B 22 7.233 -5.811 2.509 1.00 0.00 H new ATOM 0 HD23 LEU B 22 8.470 -6.266 1.312 1.00 0.00 H new ATOM 1689 N GLN B 23 6.956 -2.901 -1.382 1.00 0.00 N ATOM 1690 CA GLN B 23 6.298 -1.838 -2.143 1.00 0.00 C ATOM 1691 C GLN B 23 4.967 -1.493 -1.497 1.00 0.00 C ATOM 1692 O GLN B 23 3.987 -2.223 -1.643 1.00 0.00 O ATOM 1693 CB GLN B 23 6.085 -2.256 -3.601 1.00 0.00 C ATOM 1694 CG GLN B 23 5.365 -1.220 -4.447 1.00 0.00 C ATOM 1695 CD GLN B 23 6.273 -0.078 -4.860 1.00 0.00 C ATOM 1696 OE1 GLN B 23 5.890 1.142 -4.498 1.00 0.00 O flip ATOM 1697 NE2 GLN B 23 7.308 -0.289 -5.498 1.00 0.00 N flip ATOM 0 H GLN B 23 6.447 -3.785 -1.373 1.00 0.00 H new ATOM 0 HA GLN B 23 6.942 -0.959 -2.135 1.00 0.00 H new ATOM 0 HB2 GLN B 23 7.055 -2.467 -4.052 1.00 0.00 H new ATOM 0 HB3 GLN B 23 5.515 -3.185 -3.621 1.00 0.00 H new ATOM 0 HG2 GLN B 23 4.961 -1.700 -5.338 1.00 0.00 H new ATOM 0 HG3 GLN B 23 4.518 -0.823 -3.887 1.00 0.00 H new ATOM 0 HE21 GLN B 23 7.563 -1.243 -5.755 1.00 0.00 H new ATOM 0 HE22 GLN B 23 7.908 0.490 -5.769 1.00 0.00 H new ATOM 1706 N ILE B 24 4.941 -0.377 -0.775 1.00 0.00 N ATOM 1707 CA ILE B 24 3.761 0.000 0.000 1.00 0.00 C ATOM 1708 C ILE B 24 3.088 1.213 -0.622 1.00 0.00 C ATOM 1709 O ILE B 24 3.683 2.287 -0.717 1.00 0.00 O ATOM 1710 CB ILE B 24 4.168 0.339 1.437 1.00 0.00 C ATOM 1711 CG1 ILE B 24 4.832 -0.880 2.085 1.00 0.00 C ATOM 1712 CG2 ILE B 24 2.924 0.726 2.239 1.00 0.00 C ATOM 1713 CD1 ILE B 24 5.460 -0.470 3.419 1.00 0.00 C ATOM 0 H ILE B 24 5.719 0.280 -0.710 1.00 0.00 H new ATOM 0 HA ILE B 24 3.066 -0.839 0.001 1.00 0.00 H new ATOM 0 HB ILE B 24 4.871 1.172 1.427 1.00 0.00 H new ATOM 0 HG12 ILE B 24 4.095 -1.667 2.244 1.00 0.00 H new ATOM 0 HG13 ILE B 24 5.595 -1.287 1.422 1.00 0.00 H new ATOM 0 HG21 ILE B 24 3.211 0.968 3.262 1.00 0.00 H new ATOM 0 HG22 ILE B 24 2.451 1.594 1.780 1.00 0.00 H new ATOM 0 HG23 ILE B 24 2.222 -0.108 2.247 1.00 0.00 H new ATOM 0 HD11 ILE B 24 5.933 -1.337 3.880 1.00 0.00 H new ATOM 0 HD12 ILE B 24 6.209 0.303 3.246 1.00 0.00 H new ATOM 0 HD13 ILE B 24 4.686 -0.083 4.082 1.00 0.00 H new ATOM 1725 N ILE B 25 1.837 1.034 -1.039 1.00 0.00 N ATOM 1726 CA ILE B 25 1.040 2.137 -1.572 1.00 0.00 C ATOM 1727 C ILE B 25 -0.066 2.496 -0.591 1.00 0.00 C ATOM 1728 O ILE B 25 -0.931 1.676 -0.286 1.00 0.00 O ATOM 1729 CB ILE B 25 0.429 1.778 -2.939 1.00 0.00 C ATOM 1730 CG1 ILE B 25 1.525 1.356 -3.920 1.00 0.00 C ATOM 1731 CG2 ILE B 25 -0.362 2.954 -3.493 1.00 0.00 C ATOM 1732 CD1 ILE B 25 2.563 2.425 -4.174 1.00 0.00 C ATOM 0 H ILE B 25 1.353 0.136 -1.018 1.00 0.00 H new ATOM 0 HA ILE B 25 1.699 2.994 -1.711 1.00 0.00 H new ATOM 0 HB ILE B 25 -0.253 0.939 -2.804 1.00 0.00 H new ATOM 0 HG12 ILE B 25 2.021 0.466 -3.534 1.00 0.00 H new ATOM 0 HG13 ILE B 25 1.064 1.078 -4.868 1.00 0.00 H new ATOM 0 HG21 ILE B 25 -0.787 2.684 -4.460 1.00 0.00 H new ATOM 0 HG22 ILE B 25 -1.165 3.210 -2.802 1.00 0.00 H new ATOM 0 HG23 ILE B 25 0.299 3.812 -3.615 1.00 0.00 H new ATOM 0 HD11 ILE B 25 3.305 2.051 -4.879 1.00 0.00 H new ATOM 0 HD12 ILE B 25 2.080 3.309 -4.590 1.00 0.00 H new ATOM 0 HD13 ILE B 25 3.053 2.687 -3.236 1.00 0.00 H new ATOM 1744 N ILE B 26 -0.028 3.729 -0.098 1.00 0.00 N ATOM 1745 CA ILE B 26 -1.074 4.235 0.790 1.00 0.00 C ATOM 1746 C ILE B 26 -1.846 5.355 0.111 1.00 0.00 C ATOM 1747 O ILE B 26 -1.488 6.523 0.234 1.00 0.00 O ATOM 1748 CB ILE B 26 -0.482 4.746 2.116 1.00 0.00 C ATOM 1749 CG1 ILE B 26 0.345 3.648 2.789 1.00 0.00 C ATOM 1750 CG2 ILE B 26 -1.589 5.226 3.042 1.00 0.00 C ATOM 1751 CD1 ILE B 26 1.190 4.140 3.942 1.00 0.00 C ATOM 0 H ILE B 26 0.715 4.399 -0.297 1.00 0.00 H new ATOM 0 HA ILE B 26 -1.751 3.409 1.010 1.00 0.00 H new ATOM 0 HB ILE B 26 0.175 5.589 1.901 1.00 0.00 H new ATOM 0 HG12 ILE B 26 -0.327 2.869 3.150 1.00 0.00 H new ATOM 0 HG13 ILE B 26 0.995 3.188 2.045 1.00 0.00 H new ATOM 0 HG21 ILE B 26 -1.153 5.584 3.975 1.00 0.00 H new ATOM 0 HG22 ILE B 26 -2.138 6.037 2.563 1.00 0.00 H new ATOM 0 HG23 ILE B 26 -2.270 4.402 3.253 1.00 0.00 H new ATOM 0 HD11 ILE B 26 1.747 3.305 4.367 1.00 0.00 H new ATOM 0 HD12 ILE B 26 1.888 4.897 3.584 1.00 0.00 H new ATOM 0 HD13 ILE B 26 0.545 4.573 4.707 1.00 0.00 H new ATOM 1763 N ALA B 27 -2.911 4.991 -0.601 1.00 0.00 N ATOM 1764 CA ALA B 27 -3.624 5.942 -1.460 1.00 0.00 C ATOM 1765 C ALA B 27 -4.941 6.340 -0.813 1.00 0.00 C ATOM 1766 O ALA B 27 -5.791 5.493 -0.532 1.00 0.00 O ATOM 1767 CB ALA B 27 -3.897 5.314 -2.828 1.00 0.00 C ATOM 0 H ALA B 27 -3.300 4.048 -0.602 1.00 0.00 H new ATOM 0 HA ALA B 27 -3.003 6.828 -1.590 1.00 0.00 H new ATOM 0 HB1 ALA B 27 -4.427 6.029 -3.457 1.00 0.00 H new ATOM 0 HB2 ALA B 27 -2.952 5.045 -3.300 1.00 0.00 H new ATOM 0 HB3 ALA B 27 -4.507 4.419 -2.702 1.00 0.00 H new ATOM 1773 N GLN B 28 -5.104 7.639 -0.576 1.00 0.00 N ATOM 1774 CA GLN B 28 -6.348 8.164 -0.020 1.00 0.00 C ATOM 1775 C GLN B 28 -7.053 9.051 -1.033 1.00 0.00 C ATOM 1776 O GLN B 28 -6.636 10.183 -1.277 1.00 0.00 O ATOM 1777 CB GLN B 28 -6.080 8.948 1.267 1.00 0.00 C ATOM 1778 CG GLN B 28 -7.328 9.508 1.927 1.00 0.00 C ATOM 1779 CD GLN B 28 -7.022 10.233 3.223 1.00 0.00 C ATOM 1780 OE1 GLN B 28 -6.004 10.920 3.341 1.00 0.00 O ATOM 1781 NE2 GLN B 28 -7.904 10.085 4.205 1.00 0.00 N ATOM 0 H GLN B 28 -4.392 8.346 -0.760 1.00 0.00 H new ATOM 0 HA GLN B 28 -6.994 7.319 0.217 1.00 0.00 H new ATOM 0 HB2 GLN B 28 -5.569 8.297 1.976 1.00 0.00 H new ATOM 0 HB3 GLN B 28 -5.401 9.771 1.043 1.00 0.00 H new ATOM 0 HG2 GLN B 28 -7.823 10.193 1.239 1.00 0.00 H new ATOM 0 HG3 GLN B 28 -8.027 8.695 2.125 1.00 0.00 H new ATOM 0 HE21 GLN B 28 -8.733 9.507 4.064 1.00 0.00 H new ATOM 0 HE22 GLN B 28 -7.753 10.549 5.101 1.00 0.00 H new ATOM 1790 N GLU B 29 -8.135 8.535 -1.611 1.00 0.00 N ATOM 1791 CA GLU B 29 -8.874 9.259 -2.647 1.00 0.00 C ATOM 1792 C GLU B 29 -10.003 10.053 -2.003 1.00 0.00 C ATOM 1793 O GLU B 29 -10.953 9.478 -1.474 1.00 0.00 O ATOM 1794 CB GLU B 29 -9.437 8.295 -3.693 1.00 0.00 C ATOM 1795 CG GLU B 29 -10.176 8.972 -4.839 1.00 0.00 C ATOM 1796 CD GLU B 29 -10.662 8.000 -5.878 1.00 0.00 C ATOM 1797 OE1 GLU B 29 -10.351 6.838 -5.768 1.00 0.00 O ATOM 1798 OE2 GLU B 29 -11.345 8.419 -6.782 1.00 0.00 O ATOM 0 H GLU B 29 -8.521 7.619 -1.381 1.00 0.00 H new ATOM 0 HA GLU B 29 -8.190 9.941 -3.152 1.00 0.00 H new ATOM 0 HB2 GLU B 29 -8.618 7.705 -4.103 1.00 0.00 H new ATOM 0 HB3 GLU B 29 -10.116 7.599 -3.200 1.00 0.00 H new ATOM 0 HG2 GLU B 29 -11.027 9.525 -4.440 1.00 0.00 H new ATOM 0 HG3 GLU B 29 -9.516 9.700 -5.311 1.00 0.00 H new ATOM 1805 N ARG B 30 -9.894 11.379 -2.050 1.00 0.00 N ATOM 1806 CA ARG B 30 -10.888 12.255 -1.429 1.00 0.00 C ATOM 1807 C ARG B 30 -11.509 13.178 -2.467 1.00 0.00 C ATOM 1808 O ARG B 30 -12.203 12.729 -3.379 1.00 0.00 O ATOM 1809 CB ARG B 30 -10.261 13.090 -0.323 1.00 0.00 C ATOM 1810 CG ARG B 30 -9.807 12.300 0.895 1.00 0.00 C ATOM 1811 CD ARG B 30 -9.081 13.158 1.866 1.00 0.00 C ATOM 1812 NE ARG B 30 -7.789 13.584 1.353 1.00 0.00 N ATOM 1813 CZ ARG B 30 -6.930 14.385 2.013 1.00 0.00 C ATOM 1814 NH1 ARG B 30 -7.239 14.836 3.209 1.00 0.00 N ATOM 1815 NH2 ARG B 30 -5.777 14.716 1.459 1.00 0.00 N ATOM 0 H ARG B 30 -9.129 11.871 -2.511 1.00 0.00 H new ATOM 0 HA ARG B 30 -11.664 11.623 -0.998 1.00 0.00 H new ATOM 0 HB2 ARG B 30 -9.403 13.624 -0.732 1.00 0.00 H new ATOM 0 HB3 ARG B 30 -10.982 13.842 -0.002 1.00 0.00 H new ATOM 0 HG2 ARG B 30 -10.673 11.852 1.382 1.00 0.00 H new ATOM 0 HG3 ARG B 30 -9.161 11.482 0.578 1.00 0.00 H new ATOM 0 HD2 ARG B 30 -9.686 14.034 2.099 1.00 0.00 H new ATOM 0 HD3 ARG B 30 -8.939 12.611 2.798 1.00 0.00 H new ATOM 0 HE ARG B 30 -7.514 13.253 0.428 1.00 0.00 H new ATOM 0 HH11 ARG B 30 -8.129 14.579 3.637 1.00 0.00 H new ATOM 0 HH12 ARG B 30 -6.589 15.442 3.709 1.00 0.00 H new ATOM 0 HH21 ARG B 30 -5.537 14.365 0.532 1.00 0.00 H new ATOM 0 HH22 ARG B 30 -5.127 15.322 1.959 1.00 0.00 H new ATOM 1829 N ALA B 31 -11.255 14.475 -2.319 1.00 0.00 N ATOM 1830 CA ALA B 31 -11.992 15.481 -3.077 1.00 0.00 C ATOM 1831 C ALA B 31 -11.423 16.867 -2.793 1.00 0.00 C ATOM 1832 O ALA B 31 -10.543 17.017 -1.945 1.00 0.00 O ATOM 1833 CB ALA B 31 -13.471 15.439 -2.682 1.00 0.00 C ATOM 0 H ALA B 31 -10.550 14.852 -1.686 1.00 0.00 H new ATOM 0 HA ALA B 31 -11.895 15.269 -4.142 1.00 0.00 H new ATOM 0 HB1 ALA B 31 -14.020 16.191 -3.249 1.00 0.00 H new ATOM 0 HB2 ALA B 31 -13.878 14.451 -2.900 1.00 0.00 H new ATOM 0 HB3 ALA B 31 -13.569 15.645 -1.616 1.00 0.00 H new ATOM 1839 N GLN B 32 -11.919 17.873 -3.511 1.00 0.00 N ATOM 1840 CA GLN B 32 -11.527 19.261 -3.254 1.00 0.00 C ATOM 1841 C GLN B 32 -11.924 19.690 -1.844 1.00 0.00 C ATOM 1842 O GLN B 32 -11.204 20.444 -1.188 1.00 0.00 O ATOM 1843 CB GLN B 32 -12.162 20.199 -4.284 1.00 0.00 C ATOM 1844 CG GLN B 32 -11.728 21.649 -4.156 1.00 0.00 C ATOM 1845 CD GLN B 32 -10.247 21.835 -4.427 1.00 0.00 C ATOM 1846 OE1 GLN B 32 -9.730 21.395 -5.458 1.00 0.00 O ATOM 1847 NE2 GLN B 32 -9.555 22.491 -3.502 1.00 0.00 N ATOM 0 H GLN B 32 -12.589 17.756 -4.271 1.00 0.00 H new ATOM 0 HA GLN B 32 -10.442 19.323 -3.341 1.00 0.00 H new ATOM 0 HB2 GLN B 32 -11.913 19.844 -5.284 1.00 0.00 H new ATOM 0 HB3 GLN B 32 -13.246 20.146 -4.187 1.00 0.00 H new ATOM 0 HG2 GLN B 32 -12.302 22.260 -4.853 1.00 0.00 H new ATOM 0 HG3 GLN B 32 -11.959 22.007 -3.153 1.00 0.00 H new ATOM 0 HE21 GLN B 32 -10.023 22.837 -2.665 1.00 0.00 H new ATOM 0 HE22 GLN B 32 -8.555 22.648 -3.629 1.00 0.00 H new ATOM 1856 N GLU B 33 -13.071 19.199 -1.384 1.00 0.00 N ATOM 1857 CA GLU B 33 -13.505 19.454 -0.017 1.00 0.00 C ATOM 1858 C GLU B 33 -12.809 18.489 0.937 1.00 0.00 C ATOM 1859 O GLU B 33 -12.731 17.288 0.677 1.00 0.00 O ATOM 1860 CB GLU B 33 -15.024 19.313 0.104 1.00 0.00 C ATOM 1861 CG GLU B 33 -15.579 19.646 1.482 1.00 0.00 C ATOM 1862 CD GLU B 33 -17.077 19.539 1.551 1.00 0.00 C ATOM 1863 OE1 GLU B 33 -17.678 19.229 0.551 1.00 0.00 O ATOM 1864 OE2 GLU B 33 -17.621 19.768 2.606 1.00 0.00 O ATOM 0 H GLU B 33 -13.712 18.627 -1.934 1.00 0.00 H new ATOM 0 HA GLU B 33 -13.234 20.476 0.248 1.00 0.00 H new ATOM 0 HB2 GLU B 33 -15.497 19.964 -0.632 1.00 0.00 H new ATOM 0 HB3 GLU B 33 -15.303 18.290 -0.149 1.00 0.00 H new ATOM 0 HG2 GLU B 33 -15.138 18.974 2.218 1.00 0.00 H new ATOM 0 HG3 GLU B 33 -15.279 20.658 1.754 1.00 0.00 H new ATOM 1871 N GLY B 34 -12.301 19.028 2.041 1.00 0.00 N ATOM 1872 CA GLY B 34 -11.577 18.224 3.025 1.00 0.00 C ATOM 1873 C GLY B 34 -10.974 19.109 4.107 1.00 0.00 C ATOM 1874 O GLY B 34 -10.943 20.332 3.978 1.00 0.00 O ATOM 0 H GLY B 34 -12.376 20.017 2.278 1.00 0.00 H new ATOM 0 HA2 GLY B 34 -12.253 17.499 3.477 1.00 0.00 H new ATOM 0 HA3 GLY B 34 -10.788 17.658 2.530 1.00 0.00 H new ATOM 1878 N GLN B 35 -10.493 18.482 5.178 1.00 0.00 N ATOM 1879 CA GLN B 35 -9.912 19.221 6.302 1.00 0.00 C ATOM 1880 C GLN B 35 -9.227 18.266 7.273 1.00 0.00 C ATOM 1881 O GLN B 35 -9.171 17.058 7.039 1.00 0.00 O ATOM 1882 CB GLN B 35 -10.985 20.032 7.032 1.00 0.00 C ATOM 1883 CG GLN B 35 -12.064 19.187 7.689 1.00 0.00 C ATOM 1884 CD GLN B 35 -13.140 20.031 8.345 1.00 0.00 C ATOM 1885 OE1 GLN B 35 -13.697 20.942 7.726 1.00 0.00 O ATOM 1886 NE2 GLN B 35 -13.440 19.733 9.604 1.00 0.00 N ATOM 0 H GLN B 35 -10.493 17.469 5.294 1.00 0.00 H new ATOM 0 HA GLN B 35 -9.168 19.911 5.904 1.00 0.00 H new ATOM 0 HB2 GLN B 35 -10.505 20.646 7.794 1.00 0.00 H new ATOM 0 HB3 GLN B 35 -11.454 20.714 6.323 1.00 0.00 H new ATOM 0 HG2 GLN B 35 -12.520 18.539 6.941 1.00 0.00 H new ATOM 0 HG3 GLN B 35 -11.608 18.538 8.437 1.00 0.00 H new ATOM 0 HE21 GLN B 35 -12.954 18.971 10.077 1.00 0.00 H new ATOM 0 HE22 GLN B 35 -14.156 20.266 10.097 1.00 0.00 H new ATOM 1895 N THR B 36 -8.703 18.820 8.359 1.00 0.00 N ATOM 1896 CA THR B 36 -8.015 18.010 9.354 1.00 0.00 C ATOM 1897 C THR B 36 -7.050 17.042 8.660 1.00 0.00 C ATOM 1898 O THR B 36 -7.312 15.844 8.605 1.00 0.00 O ATOM 1899 CB THR B 36 -9.013 17.228 10.228 1.00 0.00 C ATOM 1900 OG1 THR B 36 -10.043 18.113 10.690 1.00 0.00 O ATOM 1901 CG2 THR B 36 -8.306 16.611 11.425 1.00 0.00 C ATOM 0 H THR B 36 -8.741 19.817 8.571 1.00 0.00 H new ATOM 0 HA THR B 36 -7.452 18.678 10.006 1.00 0.00 H new ATOM 0 HB THR B 36 -9.451 16.431 9.628 1.00 0.00 H new ATOM 0 HG1 THR B 36 -10.678 17.614 11.245 1.00 0.00 H new ATOM 0 HG21 THR B 36 -9.027 16.063 12.031 1.00 0.00 H new ATOM 0 HG22 THR B 36 -7.531 15.928 11.077 1.00 0.00 H new ATOM 0 HG23 THR B 36 -7.853 17.399 12.026 1.00 0.00 H new ATOM 1909 N PRO B 37 -5.956 17.538 8.126 1.00 0.00 N ATOM 1910 CA PRO B 37 -4.925 16.679 7.457 1.00 0.00 C ATOM 1911 C PRO B 37 -4.230 15.713 8.443 1.00 0.00 C ATOM 1912 O PRO B 37 -4.566 15.693 9.613 1.00 0.00 O ATOM 1913 CB PRO B 37 -3.934 17.705 6.898 1.00 0.00 C ATOM 1914 CG PRO B 37 -4.716 18.972 6.834 1.00 0.00 C ATOM 1915 CD PRO B 37 -5.588 18.935 8.061 1.00 0.00 C ATOM 0 HA PRO B 37 -5.357 16.027 6.698 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -3.061 17.808 7.543 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -3.570 17.412 5.913 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -4.062 19.844 6.838 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -5.313 19.025 5.924 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -5.051 19.257 8.953 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -6.459 19.582 7.962 1.00 0.00 H new ATOM 1923 N ASP B 38 -3.231 14.965 7.979 1.00 0.00 N ATOM 1924 CA ASP B 38 -2.407 14.107 8.856 1.00 0.00 C ATOM 1925 C ASP B 38 -2.927 12.669 8.914 1.00 0.00 C ATOM 1926 O ASP B 38 -3.279 12.171 9.983 1.00 0.00 O ATOM 1927 CB ASP B 38 -2.358 14.683 10.273 1.00 0.00 C ATOM 1928 CG ASP B 38 -1.199 14.136 11.095 1.00 0.00 C ATOM 1929 OD1 ASP B 38 -0.243 13.685 10.511 1.00 0.00 O ATOM 1930 OD2 ASP B 38 -1.282 14.174 12.300 1.00 0.00 O ATOM 0 H ASP B 38 -2.964 14.930 6.995 1.00 0.00 H new ATOM 0 HA ASP B 38 -1.405 14.087 8.427 1.00 0.00 H new ATOM 0 HB2 ASP B 38 -2.276 15.768 10.216 1.00 0.00 H new ATOM 0 HB3 ASP B 38 -3.295 14.461 10.783 1.00 0.00 H new ATOM 1935 N TYR B 39 -2.948 11.999 7.762 1.00 0.00 N ATOM 1936 CA TYR B 39 -3.386 10.601 7.688 1.00 0.00 C ATOM 1937 C TYR B 39 -2.275 9.728 7.105 1.00 0.00 C ATOM 1938 O TYR B 39 -1.956 8.668 7.639 1.00 0.00 O ATOM 1939 CB TYR B 39 -4.661 10.475 6.851 1.00 0.00 C ATOM 1940 CG TYR B 39 -5.798 11.349 7.333 1.00 0.00 C ATOM 1941 CD1 TYR B 39 -6.165 12.472 6.608 1.00 0.00 C ATOM 1942 CD2 TYR B 39 -6.472 11.026 8.502 1.00 0.00 C ATOM 1943 CE1 TYR B 39 -7.203 13.270 7.049 1.00 0.00 C ATOM 1944 CE2 TYR B 39 -7.510 11.824 8.943 1.00 0.00 C ATOM 1945 CZ TYR B 39 -7.876 12.942 8.221 1.00 0.00 C ATOM 1946 OH TYR B 39 -8.910 13.737 8.660 1.00 0.00 O ATOM 0 H TYR B 39 -2.668 12.399 6.867 1.00 0.00 H new ATOM 0 HA TYR B 39 -3.607 10.256 8.698 1.00 0.00 H new ATOM 0 HB2 TYR B 39 -4.432 10.731 5.817 1.00 0.00 H new ATOM 0 HB3 TYR B 39 -4.987 9.435 6.857 1.00 0.00 H new ATOM 0 HD1 TYR B 39 -5.640 12.723 5.698 1.00 0.00 H new ATOM 0 HD2 TYR B 39 -6.185 10.151 9.067 1.00 0.00 H new ATOM 0 HE1 TYR B 39 -7.491 14.145 6.486 1.00 0.00 H new ATOM 0 HE2 TYR B 39 -8.035 11.573 9.853 1.00 0.00 H new ATOM 0 HH TYR B 39 -8.621 14.673 8.670 1.00 0.00 H new ATOM 1956 N LEU B 40 -1.684 10.194 6.010 1.00 0.00 N ATOM 1957 CA LEU B 40 -0.629 9.441 5.337 1.00 0.00 C ATOM 1958 C LEU B 40 0.594 9.317 6.264 1.00 0.00 C ATOM 1959 O LEU B 40 1.115 8.216 6.454 1.00 0.00 O ATOM 1960 CB LEU B 40 -0.233 10.131 4.025 1.00 0.00 C ATOM 1961 CG LEU B 40 -1.292 10.108 2.916 1.00 0.00 C ATOM 1962 CD1 LEU B 40 -0.813 10.947 1.739 1.00 0.00 C ATOM 1963 CD2 LEU B 40 -1.553 8.670 2.493 1.00 0.00 C ATOM 0 H LEU B 40 -1.915 11.085 5.570 1.00 0.00 H new ATOM 0 HA LEU B 40 -1.001 8.444 5.103 1.00 0.00 H new ATOM 0 HB2 LEU B 40 0.016 11.170 4.243 1.00 0.00 H new ATOM 0 HB3 LEU B 40 0.673 9.658 3.646 1.00 0.00 H new ATOM 0 HG LEU B 40 -2.226 10.533 3.283 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -1.565 10.931 0.951 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -0.652 11.974 2.066 1.00 0.00 H new ATOM 0 HD13 LEU B 40 0.122 10.537 1.357 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -2.306 8.654 1.705 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -0.629 8.227 2.122 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -1.911 8.098 3.349 1.00 0.00 H new ATOM 1975 N PRO B 41 1.059 10.402 6.858 1.00 0.00 N ATOM 1976 CA PRO B 41 2.257 10.367 7.761 1.00 0.00 C ATOM 1977 C PRO B 41 1.939 9.723 9.111 1.00 0.00 C ATOM 1978 O PRO B 41 2.837 9.252 9.810 1.00 0.00 O ATOM 1979 CB PRO B 41 2.638 11.850 7.925 1.00 0.00 C ATOM 1980 CG PRO B 41 1.350 12.583 7.755 1.00 0.00 C ATOM 1981 CD PRO B 41 0.596 11.824 6.669 1.00 0.00 C ATOM 0 HA PRO B 41 3.066 9.764 7.348 1.00 0.00 H new ATOM 0 HB2 PRO B 41 3.078 12.042 8.903 1.00 0.00 H new ATOM 0 HB3 PRO B 41 3.372 12.157 7.180 1.00 0.00 H new ATOM 0 HG2 PRO B 41 0.783 12.604 8.686 1.00 0.00 H new ATOM 0 HG3 PRO B 41 1.522 13.619 7.463 1.00 0.00 H new ATOM 0 HD2 PRO B 41 -0.483 11.915 6.789 1.00 0.00 H new ATOM 0 HD3 PRO B 41 0.839 12.198 5.674 1.00 0.00 H new ATOM 1989 N THR B 42 0.657 9.688 9.466 1.00 0.00 N ATOM 1990 CA THR B 42 0.234 8.980 10.670 1.00 0.00 C ATOM 1991 C THR B 42 0.440 7.473 10.520 1.00 0.00 C ATOM 1992 O THR B 42 1.039 6.828 11.382 1.00 0.00 O ATOM 1993 CB THR B 42 -1.243 9.273 10.995 1.00 0.00 C ATOM 1994 OG1 THR B 42 -1.407 10.671 11.266 1.00 0.00 O ATOM 1995 CG2 THR B 42 -1.692 8.469 12.206 1.00 0.00 C ATOM 0 H THR B 42 -0.097 10.135 8.945 1.00 0.00 H new ATOM 0 HA THR B 42 0.852 9.339 11.493 1.00 0.00 H new ATOM 0 HB THR B 42 -1.852 8.989 10.137 1.00 0.00 H new ATOM 0 HG1 THR B 42 -2.046 11.055 10.630 1.00 0.00 H new ATOM 0 HG21 THR B 42 -2.738 8.689 12.421 1.00 0.00 H new ATOM 0 HG22 THR B 42 -1.580 7.405 11.998 1.00 0.00 H new ATOM 0 HG23 THR B 42 -1.080 8.737 13.068 1.00 0.00 H new ATOM 2003 N LEU B 43 -0.061 6.915 9.420 1.00 0.00 N ATOM 2004 CA LEU B 43 0.152 5.505 9.118 1.00 0.00 C ATOM 2005 C LEU B 43 1.623 5.230 8.826 1.00 0.00 C ATOM 2006 O LEU B 43 2.171 4.219 9.258 1.00 0.00 O ATOM 2007 CB LEU B 43 -0.704 5.083 7.917 1.00 0.00 C ATOM 2008 CG LEU B 43 -0.590 3.610 7.504 1.00 0.00 C ATOM 2009 CD1 LEU B 43 -0.941 2.721 8.689 1.00 0.00 C ATOM 2010 CD2 LEU B 43 -1.514 3.340 6.326 1.00 0.00 C ATOM 0 H LEU B 43 -0.615 7.417 8.726 1.00 0.00 H new ATOM 0 HA LEU B 43 -0.144 4.923 9.991 1.00 0.00 H new ATOM 0 HB2 LEU B 43 -1.748 5.298 8.145 1.00 0.00 H new ATOM 0 HB3 LEU B 43 -0.430 5.703 7.063 1.00 0.00 H new ATOM 0 HG LEU B 43 0.432 3.387 7.198 1.00 0.00 H new ATOM 0 HD11 LEU B 43 -0.860 1.674 8.395 1.00 0.00 H new ATOM 0 HD12 LEU B 43 -0.253 2.922 9.511 1.00 0.00 H new ATOM 0 HD13 LEU B 43 -1.961 2.930 9.011 1.00 0.00 H new ATOM 0 HD21 LEU B 43 -1.433 2.293 6.032 1.00 0.00 H new ATOM 0 HD22 LEU B 43 -2.543 3.558 6.613 1.00 0.00 H new ATOM 0 HD23 LEU B 43 -1.229 3.975 5.487 1.00 0.00 H new ATOM 2022 N ARG B 44 2.255 6.138 8.097 1.00 0.00 N ATOM 2023 CA ARG B 44 3.680 6.009 7.818 1.00 0.00 C ATOM 2024 C ARG B 44 4.467 5.831 9.110 1.00 0.00 C ATOM 2025 O ARG B 44 5.320 4.952 9.205 1.00 0.00 O ATOM 2026 CB ARG B 44 4.196 7.232 7.074 1.00 0.00 C ATOM 2027 CG ARG B 44 5.667 7.175 6.694 1.00 0.00 C ATOM 2028 CD ARG B 44 6.164 8.494 6.224 1.00 0.00 C ATOM 2029 NE ARG B 44 6.158 9.486 7.288 1.00 0.00 N ATOM 2030 CZ ARG B 44 6.245 10.816 7.094 1.00 0.00 C ATOM 2031 NH1 ARG B 44 6.342 11.298 5.874 1.00 0.00 N ATOM 2032 NH2 ARG B 44 6.231 11.637 8.129 1.00 0.00 N ATOM 0 H ARG B 44 1.812 6.963 7.692 1.00 0.00 H new ATOM 0 HA ARG B 44 3.818 5.128 7.192 1.00 0.00 H new ATOM 0 HB2 ARG B 44 3.606 7.363 6.167 1.00 0.00 H new ATOM 0 HB3 ARG B 44 4.029 8.113 7.693 1.00 0.00 H new ATOM 0 HG2 ARG B 44 6.253 6.851 7.554 1.00 0.00 H new ATOM 0 HG3 ARG B 44 5.812 6.431 5.911 1.00 0.00 H new ATOM 0 HD2 ARG B 44 7.177 8.383 5.836 1.00 0.00 H new ATOM 0 HD3 ARG B 44 5.543 8.843 5.399 1.00 0.00 H new ATOM 0 HE ARG B 44 6.083 9.151 8.248 1.00 0.00 H new ATOM 0 HH11 ARG B 44 6.351 10.665 5.075 1.00 0.00 H new ATOM 0 HH12 ARG B 44 6.408 12.305 5.727 1.00 0.00 H new ATOM 0 HH21 ARG B 44 6.154 11.264 9.075 1.00 0.00 H new ATOM 0 HH22 ARG B 44 6.297 12.644 7.982 1.00 0.00 H new ATOM 2046 N LYS B 45 4.195 6.676 10.092 1.00 0.00 N ATOM 2047 CA LYS B 45 4.861 6.551 11.379 1.00 0.00 C ATOM 2048 C LYS B 45 4.630 5.175 11.997 1.00 0.00 C ATOM 2049 O LYS B 45 5.562 4.549 12.502 1.00 0.00 O ATOM 2050 CB LYS B 45 4.380 7.645 12.334 1.00 0.00 C ATOM 2051 CG LYS B 45 5.019 7.599 13.716 1.00 0.00 C ATOM 2052 CD LYS B 45 4.555 8.764 14.578 1.00 0.00 C ATOM 2053 CE LYS B 45 5.249 8.761 15.932 1.00 0.00 C ATOM 2054 NZ LYS B 45 4.752 7.667 16.810 1.00 0.00 N ATOM 0 H LYS B 45 3.528 7.445 10.025 1.00 0.00 H new ATOM 0 HA LYS B 45 5.932 6.668 11.212 1.00 0.00 H new ATOM 0 HB2 LYS B 45 4.583 8.617 11.885 1.00 0.00 H new ATOM 0 HB3 LYS B 45 3.299 7.565 12.444 1.00 0.00 H new ATOM 0 HG2 LYS B 45 4.766 6.658 14.205 1.00 0.00 H new ATOM 0 HG3 LYS B 45 6.104 7.626 13.618 1.00 0.00 H new ATOM 0 HD2 LYS B 45 4.760 9.703 14.064 1.00 0.00 H new ATOM 0 HD3 LYS B 45 3.476 8.707 14.720 1.00 0.00 H new ATOM 0 HE2 LYS B 45 6.324 8.651 15.788 1.00 0.00 H new ATOM 0 HE3 LYS B 45 5.090 9.721 16.423 1.00 0.00 H new ATOM 0 HZ1 LYS B 45 5.213 7.731 17.740 1.00 0.00 H new ATOM 0 HZ2 LYS B 45 3.723 7.757 16.927 1.00 0.00 H new ATOM 0 HZ3 LYS B 45 4.972 6.747 16.377 1.00 0.00 H new ATOM 2068 N ALA B 46 3.383 4.720 11.977 1.00 0.00 N ATOM 2069 CA ALA B 46 3.052 3.425 12.552 1.00 0.00 C ATOM 2070 C ALA B 46 3.789 2.319 11.833 1.00 0.00 C ATOM 2071 O ALA B 46 4.258 1.365 12.450 1.00 0.00 O ATOM 2072 CB ALA B 46 1.549 3.165 12.472 1.00 0.00 C ATOM 0 H ALA B 46 2.593 5.223 11.573 1.00 0.00 H new ATOM 0 HA ALA B 46 3.357 3.439 13.598 1.00 0.00 H new ATOM 0 HB1 ALA B 46 1.324 2.191 12.908 1.00 0.00 H new ATOM 0 HB2 ALA B 46 1.016 3.940 13.022 1.00 0.00 H new ATOM 0 HB3 ALA B 46 1.233 3.177 11.429 1.00 0.00 H new ATOM 2078 N LEU B 47 3.898 2.453 10.528 1.00 0.00 N ATOM 2079 CA LEU B 47 4.617 1.466 9.735 1.00 0.00 C ATOM 2080 C LEU B 47 6.107 1.476 10.061 1.00 0.00 C ATOM 2081 O LEU B 47 6.759 0.434 10.060 1.00 0.00 O ATOM 2082 CB LEU B 47 4.410 1.738 8.239 1.00 0.00 C ATOM 2083 CG LEU B 47 2.994 1.485 7.707 1.00 0.00 C ATOM 2084 CD1 LEU B 47 2.900 1.966 6.265 1.00 0.00 C ATOM 2085 CD2 LEU B 47 2.669 0.003 7.812 1.00 0.00 C ATOM 0 H LEU B 47 3.503 3.227 9.993 1.00 0.00 H new ATOM 0 HA LEU B 47 4.219 0.482 9.982 1.00 0.00 H new ATOM 0 HB2 LEU B 47 4.674 2.776 8.037 1.00 0.00 H new ATOM 0 HB3 LEU B 47 5.106 1.117 7.676 1.00 0.00 H new ATOM 0 HG LEU B 47 2.268 2.038 8.302 1.00 0.00 H new ATOM 0 HD11 LEU B 47 1.894 1.786 5.886 1.00 0.00 H new ATOM 0 HD12 LEU B 47 3.119 3.033 6.222 1.00 0.00 H new ATOM 0 HD13 LEU B 47 3.620 1.423 5.653 1.00 0.00 H new ATOM 0 HD21 LEU B 47 1.663 -0.176 7.434 1.00 0.00 H new ATOM 0 HD22 LEU B 47 3.385 -0.569 7.223 1.00 0.00 H new ATOM 0 HD23 LEU B 47 2.726 -0.309 8.855 1.00 0.00 H new ATOM 2097 N MET B 48 6.632 2.658 10.341 1.00 0.00 N ATOM 2098 CA MET B 48 8.034 2.801 10.711 1.00 0.00 C ATOM 2099 C MET B 48 8.294 2.205 12.092 1.00 0.00 C ATOM 2100 O MET B 48 9.367 1.656 12.350 1.00 0.00 O ATOM 2101 CB MET B 48 8.443 4.272 10.677 1.00 0.00 C ATOM 2102 CG MET B 48 8.596 4.851 9.277 1.00 0.00 C ATOM 2103 SD MET B 48 9.751 3.912 8.259 1.00 0.00 S ATOM 2104 CE MET B 48 11.243 4.031 9.242 1.00 0.00 C ATOM 0 H MET B 48 6.109 3.534 10.320 1.00 0.00 H new ATOM 0 HA MET B 48 8.638 2.254 9.987 1.00 0.00 H new ATOM 0 HB2 MET B 48 7.699 4.856 11.219 1.00 0.00 H new ATOM 0 HB3 MET B 48 9.387 4.386 11.209 1.00 0.00 H new ATOM 0 HG2 MET B 48 7.622 4.872 8.789 1.00 0.00 H new ATOM 0 HG3 MET B 48 8.939 5.883 9.350 1.00 0.00 H new ATOM 0 HE1 MET B 48 12.103 3.756 8.632 1.00 0.00 H new ATOM 0 HE2 MET B 48 11.363 5.054 9.599 1.00 0.00 H new ATOM 0 HE3 MET B 48 11.172 3.356 10.095 1.00 0.00 H new ATOM 2114 N GLU B 49 7.304 2.309 12.970 1.00 0.00 N ATOM 2115 CA GLU B 49 7.369 1.651 14.269 1.00 0.00 C ATOM 2116 C GLU B 49 7.438 0.131 14.117 1.00 0.00 C ATOM 2117 O GLU B 49 8.285 -0.524 14.724 1.00 0.00 O ATOM 2118 CB GLU B 49 6.156 2.036 15.119 1.00 0.00 C ATOM 2119 CG GLU B 49 6.151 3.485 15.586 1.00 0.00 C ATOM 2120 CD GLU B 49 4.868 3.876 16.266 1.00 0.00 C ATOM 2121 OE1 GLU B 49 3.994 3.048 16.364 1.00 0.00 O ATOM 2122 OE2 GLU B 49 4.761 5.004 16.686 1.00 0.00 O ATOM 0 H GLU B 49 6.449 2.841 12.807 1.00 0.00 H new ATOM 0 HA GLU B 49 8.278 1.985 14.769 1.00 0.00 H new ATOM 0 HB2 GLU B 49 5.250 1.849 14.543 1.00 0.00 H new ATOM 0 HB3 GLU B 49 6.118 1.385 15.993 1.00 0.00 H new ATOM 0 HG2 GLU B 49 6.983 3.643 16.272 1.00 0.00 H new ATOM 0 HG3 GLU B 49 6.316 4.138 14.729 1.00 0.00 H new ATOM 2129 N VAL B 50 6.565 -0.424 13.284 1.00 0.00 N ATOM 2130 CA VAL B 50 6.613 -1.853 12.993 1.00 0.00 C ATOM 2131 C VAL B 50 7.932 -2.210 12.319 1.00 0.00 C ATOM 2132 O VAL B 50 8.530 -3.244 12.609 1.00 0.00 O ATOM 2133 CB VAL B 50 5.440 -2.260 12.081 1.00 0.00 C ATOM 2134 CG1 VAL B 50 5.601 -3.700 11.617 1.00 0.00 C ATOM 2135 CG2 VAL B 50 4.123 -2.074 12.818 1.00 0.00 C ATOM 0 H VAL B 50 5.824 0.086 12.803 1.00 0.00 H new ATOM 0 HA VAL B 50 6.532 -2.396 13.935 1.00 0.00 H new ATOM 0 HB VAL B 50 5.439 -1.620 11.199 1.00 0.00 H new ATOM 0 HG11 VAL B 50 4.764 -3.971 10.974 1.00 0.00 H new ATOM 0 HG12 VAL B 50 6.533 -3.801 11.061 1.00 0.00 H new ATOM 0 HG13 VAL B 50 5.622 -4.361 12.483 1.00 0.00 H new ATOM 0 HG21 VAL B 50 3.298 -2.364 12.167 1.00 0.00 H new ATOM 0 HG22 VAL B 50 4.116 -2.697 13.713 1.00 0.00 H new ATOM 0 HG23 VAL B 50 4.010 -1.028 13.103 1.00 0.00 H new ATOM 2145 N LEU B 51 8.373 -1.350 11.407 1.00 0.00 N ATOM 2146 CA LEU B 51 9.662 -1.555 10.765 1.00 0.00 C ATOM 2147 C LEU B 51 10.763 -1.688 11.811 1.00 0.00 C ATOM 2148 O LEU B 51 11.527 -2.649 11.798 1.00 0.00 O ATOM 2149 CB LEU B 51 9.978 -0.391 9.818 1.00 0.00 C ATOM 2150 CG LEU B 51 11.290 -0.509 9.032 1.00 0.00 C ATOM 2151 CD1 LEU B 51 11.127 0.148 7.668 1.00 0.00 C ATOM 2152 CD2 LEU B 51 12.415 0.143 9.822 1.00 0.00 C ATOM 0 H LEU B 51 7.866 -0.519 11.101 1.00 0.00 H new ATOM 0 HA LEU B 51 9.614 -2.477 10.186 1.00 0.00 H new ATOM 0 HB2 LEU B 51 9.158 -0.293 9.107 1.00 0.00 H new ATOM 0 HB3 LEU B 51 10.007 0.530 10.401 1.00 0.00 H new ATOM 0 HG LEU B 51 11.540 -1.559 8.880 1.00 0.00 H new ATOM 0 HD11 LEU B 51 12.059 0.064 7.110 1.00 0.00 H new ATOM 0 HD12 LEU B 51 10.329 -0.350 7.118 1.00 0.00 H new ATOM 0 HD13 LEU B 51 10.876 1.201 7.799 1.00 0.00 H new ATOM 0 HD21 LEU B 51 13.347 0.059 9.264 1.00 0.00 H new ATOM 0 HD22 LEU B 51 12.183 1.195 9.985 1.00 0.00 H new ATOM 0 HD23 LEU B 51 12.522 -0.358 10.784 1.00 0.00 H new ATOM 2164 N SER B 52 10.841 -0.737 12.728 1.00 0.00 N ATOM 2165 CA SER B 52 11.923 -0.739 13.701 1.00 0.00 C ATOM 2166 C SER B 52 11.923 -2.040 14.504 1.00 0.00 C ATOM 2167 O SER B 52 12.975 -2.517 14.927 1.00 0.00 O ATOM 2168 CB SER B 52 11.788 0.449 14.634 1.00 0.00 C ATOM 2169 OG SER B 52 10.678 0.303 15.476 1.00 0.00 O ATOM 0 H SER B 52 10.180 0.035 12.820 1.00 0.00 H new ATOM 0 HA SER B 52 12.869 -0.664 13.165 1.00 0.00 H new ATOM 0 HB2 SER B 52 12.693 0.550 15.233 1.00 0.00 H new ATOM 0 HB3 SER B 52 11.689 1.364 14.051 1.00 0.00 H new ATOM 0 HG SER B 52 9.859 0.283 14.938 1.00 0.00 H new ATOM 2175 N LYS B 53 10.736 -2.611 14.706 1.00 0.00 N ATOM 2176 CA LYS B 53 10.605 -3.872 15.445 1.00 0.00 C ATOM 2177 C LYS B 53 11.202 -5.045 14.662 1.00 0.00 C ATOM 2178 O LYS B 53 12.014 -5.807 15.189 1.00 0.00 O ATOM 2179 CB LYS B 53 9.136 -4.151 15.767 1.00 0.00 C ATOM 2180 CG LYS B 53 8.534 -3.223 16.814 1.00 0.00 C ATOM 2181 CD LYS B 53 7.065 -3.537 17.052 1.00 0.00 C ATOM 2182 CE LYS B 53 6.458 -2.602 18.088 1.00 0.00 C ATOM 2183 NZ LYS B 53 5.018 -2.892 18.323 1.00 0.00 N ATOM 0 H LYS B 53 9.853 -2.225 14.371 1.00 0.00 H new ATOM 0 HA LYS B 53 11.162 -3.769 16.376 1.00 0.00 H new ATOM 0 HB2 LYS B 53 8.554 -4.070 14.849 1.00 0.00 H new ATOM 0 HB3 LYS B 53 9.042 -5.180 16.114 1.00 0.00 H new ATOM 0 HG2 LYS B 53 9.085 -3.321 17.749 1.00 0.00 H new ATOM 0 HG3 LYS B 53 8.639 -2.188 16.489 1.00 0.00 H new ATOM 0 HD2 LYS B 53 6.516 -3.449 16.114 1.00 0.00 H new ATOM 0 HD3 LYS B 53 6.962 -4.569 17.386 1.00 0.00 H new ATOM 0 HE2 LYS B 53 7.005 -2.696 19.026 1.00 0.00 H new ATOM 0 HE3 LYS B 53 6.571 -1.570 17.756 1.00 0.00 H new ATOM 0 HZ1 LYS B 53 4.643 -2.233 19.035 1.00 0.00 H new ATOM 0 HZ2 LYS B 53 4.491 -2.777 17.434 1.00 0.00 H new ATOM 0 HZ3 LYS B 53 4.912 -3.868 18.665 1.00 0.00 H new ATOM 2197 N TYR B 54 10.778 -5.189 13.411 1.00 0.00 N ATOM 2198 CA TYR B 54 10.929 -6.449 12.685 1.00 0.00 C ATOM 2199 C TYR B 54 11.877 -6.297 11.503 1.00 0.00 C ATOM 2200 O TYR B 54 12.519 -7.263 11.091 1.00 0.00 O ATOM 2201 CB TYR B 54 9.567 -6.958 12.208 1.00 0.00 C ATOM 2202 CG TYR B 54 8.582 -7.209 13.329 1.00 0.00 C ATOM 2203 CD1 TYR B 54 7.496 -6.364 13.500 1.00 0.00 C ATOM 2204 CD2 TYR B 54 8.766 -8.285 14.185 1.00 0.00 C ATOM 2205 CE1 TYR B 54 6.597 -6.593 14.524 1.00 0.00 C ATOM 2206 CE2 TYR B 54 7.867 -8.514 15.209 1.00 0.00 C ATOM 2207 CZ TYR B 54 6.786 -7.673 15.379 1.00 0.00 C ATOM 2208 OH TYR B 54 5.891 -7.902 16.398 1.00 0.00 O ATOM 0 H TYR B 54 10.326 -4.448 12.876 1.00 0.00 H new ATOM 0 HA TYR B 54 11.359 -7.179 13.371 1.00 0.00 H new ATOM 0 HB2 TYR B 54 9.140 -6.231 11.517 1.00 0.00 H new ATOM 0 HB3 TYR B 54 9.711 -7.883 11.649 1.00 0.00 H new ATOM 0 HD1 TYR B 54 7.353 -5.527 12.833 1.00 0.00 H new ATOM 0 HD2 TYR B 54 9.612 -8.943 14.051 1.00 0.00 H new ATOM 0 HE1 TYR B 54 5.751 -5.936 14.660 1.00 0.00 H new ATOM 0 HE2 TYR B 54 8.010 -9.351 15.876 1.00 0.00 H new ATOM 0 HH TYR B 54 6.166 -8.696 16.903 1.00 0.00 H new ATOM 2218 N VAL B 55 11.958 -5.087 10.955 1.00 0.00 N ATOM 2219 CA VAL B 55 12.646 -4.862 9.677 1.00 0.00 C ATOM 2220 C VAL B 55 13.732 -3.797 9.830 1.00 0.00 C ATOM 2221 O VAL B 55 13.441 -2.604 9.909 1.00 0.00 O ATOM 2222 CB VAL B 55 11.643 -4.420 8.594 1.00 0.00 C ATOM 2223 CG1 VAL B 55 12.362 -4.152 7.280 1.00 0.00 C ATOM 2224 CG2 VAL B 55 10.571 -5.483 8.416 1.00 0.00 C ATOM 0 H VAL B 55 11.558 -4.246 11.371 1.00 0.00 H new ATOM 0 HA VAL B 55 13.109 -5.801 9.375 1.00 0.00 H new ATOM 0 HB VAL B 55 11.165 -3.494 8.912 1.00 0.00 H new ATOM 0 HG11 VAL B 55 11.639 -3.841 6.526 1.00 0.00 H new ATOM 0 HG12 VAL B 55 13.099 -3.362 7.423 1.00 0.00 H new ATOM 0 HG13 VAL B 55 12.864 -5.061 6.948 1.00 0.00 H new ATOM 0 HG21 VAL B 55 9.866 -5.164 7.649 1.00 0.00 H new ATOM 0 HG22 VAL B 55 11.036 -6.421 8.113 1.00 0.00 H new ATOM 0 HG23 VAL B 55 10.042 -5.627 9.358 1.00 0.00 H new ATOM 2234 N ASN B 56 14.987 -4.243 9.893 1.00 0.00 N ATOM 2235 CA ASN B 56 16.114 -3.347 10.168 1.00 0.00 C ATOM 2236 C ASN B 56 16.549 -2.599 8.916 1.00 0.00 C ATOM 2237 O ASN B 56 17.551 -2.945 8.299 1.00 0.00 O ATOM 2238 CB ASN B 56 17.282 -4.119 10.756 1.00 0.00 C ATOM 2239 CG ASN B 56 18.383 -3.218 11.242 1.00 0.00 C ATOM 2240 OD1 ASN B 56 18.248 -1.989 11.231 1.00 0.00 O ATOM 2241 ND2 ASN B 56 19.471 -3.806 11.670 1.00 0.00 N ATOM 0 H ASN B 56 15.250 -5.219 9.758 1.00 0.00 H new ATOM 0 HA ASN B 56 15.779 -2.611 10.898 1.00 0.00 H new ATOM 0 HB2 ASN B 56 16.927 -4.733 11.584 1.00 0.00 H new ATOM 0 HB3 ASN B 56 17.680 -4.799 10.003 1.00 0.00 H new ATOM 0 HD21 ASN B 56 20.252 -3.247 12.013 1.00 0.00 H new ATOM 0 HD22 ASN B 56 19.538 -4.824 11.661 1.00 0.00 H new ATOM 2248 N VAL B 57 15.799 -1.564 8.553 1.00 0.00 N ATOM 2249 CA VAL B 57 16.147 -0.743 7.391 1.00 0.00 C ATOM 2250 C VAL B 57 16.170 0.732 7.772 1.00 0.00 C ATOM 2251 O VAL B 57 15.323 1.203 8.529 1.00 0.00 O ATOM 2252 CB VAL B 57 15.136 -0.962 6.250 1.00 0.00 C ATOM 2253 CG1 VAL B 57 15.458 -0.056 5.071 1.00 0.00 C ATOM 2254 CG2 VAL B 57 15.143 -2.423 5.825 1.00 0.00 C ATOM 0 H VAL B 57 14.952 -1.272 9.040 1.00 0.00 H new ATOM 0 HA VAL B 57 17.138 -1.042 7.050 1.00 0.00 H new ATOM 0 HB VAL B 57 14.138 -0.708 6.608 1.00 0.00 H new ATOM 0 HG11 VAL B 57 14.733 -0.224 4.274 1.00 0.00 H new ATOM 0 HG12 VAL B 57 15.412 0.985 5.389 1.00 0.00 H new ATOM 0 HG13 VAL B 57 16.460 -0.279 4.704 1.00 0.00 H new ATOM 0 HG21 VAL B 57 14.426 -2.571 5.018 1.00 0.00 H new ATOM 0 HG22 VAL B 57 16.140 -2.697 5.479 1.00 0.00 H new ATOM 0 HG23 VAL B 57 14.869 -3.050 6.673 1.00 0.00 H new ATOM 2264 N SER B 58 17.146 1.457 7.234 1.00 0.00 N ATOM 2265 CA SER B 58 17.323 2.861 7.576 1.00 0.00 C ATOM 2266 C SER B 58 16.601 3.728 6.558 1.00 0.00 C ATOM 2267 O SER B 58 16.358 3.292 5.439 1.00 0.00 O ATOM 2268 CB SER B 58 18.796 3.220 7.619 1.00 0.00 C ATOM 2269 OG SER B 58 18.972 4.602 7.765 1.00 0.00 O ATOM 0 H SER B 58 17.823 1.096 6.562 1.00 0.00 H new ATOM 0 HA SER B 58 16.900 3.038 8.565 1.00 0.00 H new ATOM 0 HB2 SER B 58 19.277 2.699 8.447 1.00 0.00 H new ATOM 0 HB3 SER B 58 19.283 2.882 6.704 1.00 0.00 H new ATOM 0 HG SER B 58 19.930 4.809 7.792 1.00 0.00 H new ATOM 2275 N LEU B 59 16.265 4.953 6.944 1.00 0.00 N ATOM 2276 CA LEU B 59 15.578 5.879 6.046 1.00 0.00 C ATOM 2277 C LEU B 59 16.489 6.270 4.875 1.00 0.00 C ATOM 2278 O LEU B 59 16.026 6.817 3.877 1.00 0.00 O ATOM 2279 CB LEU B 59 15.139 7.135 6.809 1.00 0.00 C ATOM 2280 CG LEU B 59 13.988 6.940 7.804 1.00 0.00 C ATOM 2281 CD1 LEU B 59 13.794 8.216 8.613 1.00 0.00 C ATOM 2282 CD2 LEU B 59 12.720 6.573 7.048 1.00 0.00 C ATOM 0 H LEU B 59 16.456 5.330 7.872 1.00 0.00 H new ATOM 0 HA LEU B 59 14.694 5.379 5.650 1.00 0.00 H new ATOM 0 HB2 LEU B 59 16.000 7.529 7.350 1.00 0.00 H new ATOM 0 HB3 LEU B 59 14.844 7.894 6.084 1.00 0.00 H new ATOM 0 HG LEU B 59 14.224 6.129 8.493 1.00 0.00 H new ATOM 0 HD11 LEU B 59 12.976 8.078 9.320 1.00 0.00 H new ATOM 0 HD12 LEU B 59 14.710 8.444 9.158 1.00 0.00 H new ATOM 0 HD13 LEU B 59 13.557 9.041 7.941 1.00 0.00 H new ATOM 0 HD21 LEU B 59 11.902 6.434 7.755 1.00 0.00 H new ATOM 0 HD22 LEU B 59 12.467 7.373 6.352 1.00 0.00 H new ATOM 0 HD23 LEU B 59 12.881 5.648 6.494 1.00 0.00 H new ATOM 2294 N ASP B 60 17.778 5.977 5.011 1.00 0.00 N ATOM 2295 CA ASP B 60 18.720 6.179 3.917 1.00 0.00 C ATOM 2296 C ASP B 60 18.418 5.236 2.751 1.00 0.00 C ATOM 2297 O ASP B 60 18.800 5.514 1.613 1.00 0.00 O ATOM 2298 CB ASP B 60 20.157 5.963 4.401 1.00 0.00 C ATOM 2299 CG ASP B 60 20.646 7.076 5.318 1.00 0.00 C ATOM 2300 OD1 ASP B 60 20.029 8.114 5.343 1.00 0.00 O ATOM 2301 OD2 ASP B 60 21.633 6.876 5.985 1.00 0.00 O ATOM 0 H ASP B 60 18.192 5.601 5.864 1.00 0.00 H new ATOM 0 HA ASP B 60 18.612 7.206 3.568 1.00 0.00 H new ATOM 0 HB2 ASP B 60 20.218 5.011 4.928 1.00 0.00 H new ATOM 0 HB3 ASP B 60 20.819 5.893 3.538 1.00 0.00 H new ATOM 2306 N ASN B 61 17.734 4.120 3.031 1.00 0.00 N ATOM 2307 CA ASN B 61 17.397 3.135 1.994 1.00 0.00 C ATOM 2308 C ASN B 61 15.897 3.152 1.696 1.00 0.00 C ATOM 2309 O ASN B 61 15.454 2.605 0.690 1.00 0.00 O ATOM 2310 CB ASN B 61 17.844 1.745 2.406 1.00 0.00 C ATOM 2311 CG ASN B 61 19.340 1.622 2.496 1.00 0.00 C ATOM 2312 OD1 ASN B 61 20.072 2.197 1.683 1.00 0.00 O ATOM 2313 ND2 ASN B 61 19.808 0.883 3.469 1.00 0.00 N ATOM 0 H ASN B 61 17.403 3.876 3.965 1.00 0.00 H new ATOM 0 HA ASN B 61 17.929 3.408 1.083 1.00 0.00 H new ATOM 0 HB2 ASN B 61 17.404 1.497 3.372 1.00 0.00 H new ATOM 0 HB3 ASN B 61 17.466 1.018 1.687 1.00 0.00 H new ATOM 0 HD21 ASN B 61 20.815 0.763 3.579 1.00 0.00 H new ATOM 0 HD22 ASN B 61 19.166 0.427 4.117 1.00 0.00 H new ATOM 2320 N ILE B 62 15.121 3.785 2.579 1.00 0.00 N ATOM 2321 CA ILE B 62 13.666 3.872 2.404 1.00 0.00 C ATOM 2322 C ILE B 62 13.287 5.104 1.584 1.00 0.00 C ATOM 2323 O ILE B 62 13.599 6.233 1.961 1.00 0.00 O ATOM 2324 CB ILE B 62 12.946 3.918 3.764 1.00 0.00 C ATOM 2325 CG1 ILE B 62 13.248 2.653 4.571 1.00 0.00 C ATOM 2326 CG2 ILE B 62 11.447 4.083 3.567 1.00 0.00 C ATOM 2327 CD1 ILE B 62 12.841 2.745 6.024 1.00 0.00 C ATOM 0 H ILE B 62 15.472 4.244 3.420 1.00 0.00 H new ATOM 0 HA ILE B 62 13.349 2.978 1.868 1.00 0.00 H new ATOM 0 HB ILE B 62 13.315 4.778 4.323 1.00 0.00 H new ATOM 0 HG12 ILE B 62 12.733 1.809 4.112 1.00 0.00 H new ATOM 0 HG13 ILE B 62 14.316 2.444 4.515 1.00 0.00 H new ATOM 0 HG21 ILE B 62 10.954 4.114 4.538 1.00 0.00 H new ATOM 0 HG22 ILE B 62 11.251 5.011 3.031 1.00 0.00 H new ATOM 0 HG23 ILE B 62 11.061 3.242 2.990 1.00 0.00 H new ATOM 0 HD11 ILE B 62 13.087 1.812 6.530 1.00 0.00 H new ATOM 0 HD12 ILE B 62 13.375 3.567 6.500 1.00 0.00 H new ATOM 0 HD13 ILE B 62 11.768 2.922 6.091 1.00 0.00 H new ATOM 2339 N ARG B 63 12.583 4.871 0.482 1.00 0.00 N ATOM 2340 CA ARG B 63 12.144 5.961 -0.384 1.00 0.00 C ATOM 2341 C ARG B 63 10.746 6.404 0.029 1.00 0.00 C ATOM 2342 O ARG B 63 9.804 5.613 0.019 1.00 0.00 O ATOM 2343 CB ARG B 63 12.137 5.532 -1.844 1.00 0.00 C ATOM 2344 CG ARG B 63 11.719 6.614 -2.826 1.00 0.00 C ATOM 2345 CD ARG B 63 11.866 6.165 -4.234 1.00 0.00 C ATOM 2346 NE ARG B 63 11.444 7.188 -5.177 1.00 0.00 N ATOM 2347 CZ ARG B 63 10.197 7.305 -5.673 1.00 0.00 C ATOM 2348 NH1 ARG B 63 9.262 6.457 -5.307 1.00 0.00 N ATOM 2349 NH2 ARG B 63 9.914 8.273 -6.527 1.00 0.00 N ATOM 0 H ARG B 63 12.305 3.942 0.167 1.00 0.00 H new ATOM 0 HA ARG B 63 12.843 6.791 -0.277 1.00 0.00 H new ATOM 0 HB2 ARG B 63 13.135 5.185 -2.111 1.00 0.00 H new ATOM 0 HB3 ARG B 63 11.464 4.682 -1.955 1.00 0.00 H new ATOM 0 HG2 ARG B 63 10.682 6.894 -2.640 1.00 0.00 H new ATOM 0 HG3 ARG B 63 12.324 7.506 -2.664 1.00 0.00 H new ATOM 0 HD2 ARG B 63 12.907 5.903 -4.425 1.00 0.00 H new ATOM 0 HD3 ARG B 63 11.276 5.262 -4.390 1.00 0.00 H new ATOM 0 HE ARG B 63 12.142 7.865 -5.485 1.00 0.00 H new ATOM 0 HH11 ARG B 63 9.481 5.710 -4.647 1.00 0.00 H new ATOM 0 HH12 ARG B 63 8.318 6.546 -5.683 1.00 0.00 H new ATOM 0 HH21 ARG B 63 10.640 8.931 -6.810 1.00 0.00 H new ATOM 0 HH22 ARG B 63 8.970 8.362 -6.903 1.00 0.00 H new ATOM 2363 N ILE B 64 10.625 7.675 0.404 1.00 0.00 N ATOM 2364 CA ILE B 64 9.344 8.246 0.824 1.00 0.00 C ATOM 2365 C ILE B 64 8.933 9.367 -0.109 1.00 0.00 C ATOM 2366 O ILE B 64 9.570 10.419 -0.158 1.00 0.00 O ATOM 2367 CB ILE B 64 9.416 8.779 2.267 1.00 0.00 C ATOM 2368 CG1 ILE B 64 9.823 7.660 3.229 1.00 0.00 C ATOM 2369 CG2 ILE B 64 8.081 9.380 2.678 1.00 0.00 C ATOM 2370 CD1 ILE B 64 10.101 8.137 4.637 1.00 0.00 C ATOM 0 H ILE B 64 11.403 8.334 0.426 1.00 0.00 H new ATOM 0 HA ILE B 64 8.600 7.450 0.785 1.00 0.00 H new ATOM 0 HB ILE B 64 10.173 9.562 2.311 1.00 0.00 H new ATOM 0 HG12 ILE B 64 9.030 6.913 3.258 1.00 0.00 H new ATOM 0 HG13 ILE B 64 10.713 7.165 2.840 1.00 0.00 H new ATOM 0 HG21 ILE B 64 8.149 9.752 3.700 1.00 0.00 H new ATOM 0 HG22 ILE B 64 7.831 10.203 2.008 1.00 0.00 H new ATOM 0 HG23 ILE B 64 7.305 8.617 2.620 1.00 0.00 H new ATOM 0 HD11 ILE B 64 10.383 7.288 5.260 1.00 0.00 H new ATOM 0 HD12 ILE B 64 10.915 8.862 4.622 1.00 0.00 H new ATOM 0 HD13 ILE B 64 9.206 8.605 5.046 1.00 0.00 H new ATOM 2382 N SER B 65 7.850 9.137 -0.840 1.00 0.00 N ATOM 2383 CA SER B 65 7.384 10.102 -1.823 1.00 0.00 C ATOM 2384 C SER B 65 5.862 10.146 -1.836 1.00 0.00 C ATOM 2385 O SER B 65 5.200 9.112 -1.940 1.00 0.00 O ATOM 2386 CB SER B 65 7.908 9.746 -3.200 1.00 0.00 C ATOM 2387 OG SER B 65 7.432 10.644 -4.166 1.00 0.00 O ATOM 0 H SER B 65 7.281 8.294 -0.770 1.00 0.00 H new ATOM 0 HA SER B 65 7.762 11.087 -1.550 1.00 0.00 H new ATOM 0 HB2 SER B 65 8.998 9.758 -3.193 1.00 0.00 H new ATOM 0 HB3 SER B 65 7.602 8.732 -3.459 1.00 0.00 H new ATOM 0 HG SER B 65 7.785 10.395 -5.046 1.00 0.00 H new ATOM 2393 N GLN B 66 5.310 11.354 -1.725 1.00 0.00 N ATOM 2394 CA GLN B 66 3.870 11.547 -1.846 1.00 0.00 C ATOM 2395 C GLN B 66 3.531 12.136 -3.207 1.00 0.00 C ATOM 2396 O GLN B 66 4.213 13.037 -3.695 1.00 0.00 O ATOM 2397 CB GLN B 66 3.348 12.459 -0.732 1.00 0.00 C ATOM 2398 CG GLN B 66 1.850 12.703 -0.779 1.00 0.00 C ATOM 2399 CD GLN B 66 1.376 13.611 0.340 1.00 0.00 C ATOM 2400 OE1 GLN B 66 2.003 13.691 1.401 1.00 0.00 O ATOM 2401 NE2 GLN B 66 0.265 14.301 0.111 1.00 0.00 N ATOM 0 H GLN B 66 5.838 12.209 -1.552 1.00 0.00 H new ATOM 0 HA GLN B 66 3.385 10.575 -1.750 1.00 0.00 H new ATOM 0 HB2 GLN B 66 3.603 12.019 0.232 1.00 0.00 H new ATOM 0 HB3 GLN B 66 3.863 13.418 -0.791 1.00 0.00 H new ATOM 0 HG2 GLN B 66 1.587 13.147 -1.739 1.00 0.00 H new ATOM 0 HG3 GLN B 66 1.327 11.749 -0.715 1.00 0.00 H new ATOM 0 HE21 GLN B 66 -0.221 14.204 -0.781 1.00 0.00 H new ATOM 0 HE22 GLN B 66 -0.103 14.928 0.827 1.00 0.00 H new ATOM 2410 N GLU B 67 2.459 11.629 -3.812 1.00 0.00 N ATOM 2411 CA GLU B 67 1.999 12.137 -5.103 1.00 0.00 C ATOM 2412 C GLU B 67 0.569 12.655 -4.986 1.00 0.00 C ATOM 2413 O GLU B 67 -0.300 11.983 -4.434 1.00 0.00 O ATOM 2414 CB GLU B 67 2.076 11.046 -6.173 1.00 0.00 C ATOM 2415 CG GLU B 67 1.596 11.480 -7.550 1.00 0.00 C ATOM 2416 CD GLU B 67 2.515 12.474 -8.204 1.00 0.00 C ATOM 2417 OE1 GLU B 67 3.706 12.289 -8.134 1.00 0.00 O ATOM 2418 OE2 GLU B 67 2.024 13.421 -8.774 1.00 0.00 O ATOM 0 H GLU B 67 1.894 10.870 -3.431 1.00 0.00 H new ATOM 0 HA GLU B 67 2.651 12.958 -5.400 1.00 0.00 H new ATOM 0 HB2 GLU B 67 3.108 10.705 -6.253 1.00 0.00 H new ATOM 0 HB3 GLU B 67 1.482 10.192 -5.847 1.00 0.00 H new ATOM 0 HG2 GLU B 67 1.504 10.603 -8.190 1.00 0.00 H new ATOM 0 HG3 GLU B 67 0.601 11.916 -7.461 1.00 0.00 H new ATOM 2425 N LYS B 68 0.332 13.857 -5.511 1.00 0.00 N ATOM 2426 CA LYS B 68 -0.987 14.488 -5.422 1.00 0.00 C ATOM 2427 C LYS B 68 -1.681 14.472 -6.777 1.00 0.00 C ATOM 2428 O LYS B 68 -1.072 14.786 -7.800 1.00 0.00 O ATOM 2429 CB LYS B 68 -0.869 15.923 -4.907 1.00 0.00 C ATOM 2430 CG LYS B 68 -2.200 16.644 -4.742 1.00 0.00 C ATOM 2431 CD LYS B 68 -2.005 18.041 -4.174 1.00 0.00 C ATOM 2432 CE LYS B 68 -3.333 18.768 -4.021 1.00 0.00 C ATOM 2433 NZ LYS B 68 -3.158 20.138 -3.467 1.00 0.00 N ATOM 0 H LYS B 68 1.033 14.413 -6.001 1.00 0.00 H new ATOM 0 HA LYS B 68 -1.588 13.916 -4.715 1.00 0.00 H new ATOM 0 HB2 LYS B 68 -0.355 15.910 -3.946 1.00 0.00 H new ATOM 0 HB3 LYS B 68 -0.244 16.493 -5.595 1.00 0.00 H new ATOM 0 HG2 LYS B 68 -2.703 16.708 -5.707 1.00 0.00 H new ATOM 0 HG3 LYS B 68 -2.849 16.068 -4.082 1.00 0.00 H new ATOM 0 HD2 LYS B 68 -1.510 17.976 -3.205 1.00 0.00 H new ATOM 0 HD3 LYS B 68 -1.348 18.613 -4.829 1.00 0.00 H new ATOM 0 HE2 LYS B 68 -3.826 18.829 -4.991 1.00 0.00 H new ATOM 0 HE3 LYS B 68 -3.988 18.193 -3.366 1.00 0.00 H new ATOM 0 HZ1 LYS B 68 -4.087 20.598 -3.379 1.00 0.00 H new ATOM 0 HZ2 LYS B 68 -2.711 20.079 -2.530 1.00 0.00 H new ATOM 0 HZ3 LYS B 68 -2.554 20.696 -4.104 1.00 0.00 H new ATOM 2447 N GLN B 69 -2.958 14.100 -6.780 1.00 0.00 N ATOM 2448 CA GLN B 69 -3.752 14.145 -7.998 1.00 0.00 C ATOM 2449 C GLN B 69 -5.159 14.651 -7.698 1.00 0.00 C ATOM 2450 O GLN B 69 -5.961 13.955 -7.077 1.00 0.00 O ATOM 2451 CB GLN B 69 -3.816 12.761 -8.651 1.00 0.00 C ATOM 2452 CG GLN B 69 -4.712 12.692 -9.876 1.00 0.00 C ATOM 2453 CD GLN B 69 -4.211 13.565 -11.010 1.00 0.00 C ATOM 2454 OE1 GLN B 69 -3.044 13.485 -11.404 1.00 0.00 O ATOM 2455 NE2 GLN B 69 -5.091 14.405 -11.543 1.00 0.00 N ATOM 0 H GLN B 69 -3.460 13.767 -5.957 1.00 0.00 H new ATOM 0 HA GLN B 69 -3.273 14.835 -8.693 1.00 0.00 H new ATOM 0 HB2 GLN B 69 -2.808 12.458 -8.934 1.00 0.00 H new ATOM 0 HB3 GLN B 69 -4.170 12.040 -7.914 1.00 0.00 H new ATOM 0 HG2 GLN B 69 -4.776 11.659 -10.218 1.00 0.00 H new ATOM 0 HG3 GLN B 69 -5.721 13.001 -9.602 1.00 0.00 H new ATOM 0 HE21 GLN B 69 -6.046 14.438 -11.186 1.00 0.00 H new ATOM 0 HE22 GLN B 69 -4.812 15.017 -12.310 1.00 0.00 H new ATOM 2464 N ASP B 70 -5.449 15.870 -8.140 1.00 0.00 N ATOM 2465 CA ASP B 70 -6.699 16.529 -7.780 1.00 0.00 C ATOM 2466 C ASP B 70 -6.904 16.506 -6.260 1.00 0.00 C ATOM 2467 O ASP B 70 -6.124 17.095 -5.514 1.00 0.00 O ATOM 2468 CB ASP B 70 -7.882 15.855 -8.478 1.00 0.00 C ATOM 2469 CG ASP B 70 -7.805 15.947 -9.996 1.00 0.00 C ATOM 2470 OD1 ASP B 70 -7.549 17.018 -10.494 1.00 0.00 O ATOM 2471 OD2 ASP B 70 -8.003 14.947 -10.643 1.00 0.00 O ATOM 0 H ASP B 70 -4.839 16.419 -8.745 1.00 0.00 H new ATOM 0 HA ASP B 70 -6.642 17.567 -8.109 1.00 0.00 H new ATOM 0 HB2 ASP B 70 -7.921 14.806 -8.184 1.00 0.00 H new ATOM 0 HB3 ASP B 70 -8.809 16.316 -8.138 1.00 0.00 H new ATOM 2476 N GLY B 71 -7.959 15.821 -5.811 1.00 0.00 N ATOM 2477 CA GLY B 71 -8.254 15.705 -4.378 1.00 0.00 C ATOM 2478 C GLY B 71 -7.865 14.326 -3.850 1.00 0.00 C ATOM 2479 O GLY B 71 -8.429 13.847 -2.865 1.00 0.00 O ATOM 0 H GLY B 71 -8.623 15.339 -6.417 1.00 0.00 H new ATOM 0 HA2 GLY B 71 -7.713 16.475 -3.828 1.00 0.00 H new ATOM 0 HA3 GLY B 71 -9.316 15.878 -4.206 1.00 0.00 H new ATOM 2483 N MET B 72 -6.898 13.695 -4.518 1.00 0.00 N ATOM 2484 CA MET B 72 -6.389 12.390 -4.085 1.00 0.00 C ATOM 2485 C MET B 72 -4.905 12.479 -3.754 1.00 0.00 C ATOM 2486 O MET B 72 -4.124 13.069 -4.499 1.00 0.00 O ATOM 2487 CB MET B 72 -6.633 11.335 -5.162 1.00 0.00 C ATOM 2488 CG MET B 72 -6.027 9.972 -4.857 1.00 0.00 C ATOM 2489 SD MET B 72 -6.467 8.726 -6.084 1.00 0.00 S ATOM 2490 CE MET B 72 -5.640 7.286 -5.416 1.00 0.00 C ATOM 0 H MET B 72 -6.452 14.064 -5.358 1.00 0.00 H new ATOM 0 HA MET B 72 -6.927 12.094 -3.184 1.00 0.00 H new ATOM 0 HB2 MET B 72 -7.708 11.218 -5.302 1.00 0.00 H new ATOM 0 HB3 MET B 72 -6.226 11.697 -6.106 1.00 0.00 H new ATOM 0 HG2 MET B 72 -4.942 10.063 -4.811 1.00 0.00 H new ATOM 0 HG3 MET B 72 -6.361 9.642 -3.874 1.00 0.00 H new ATOM 0 HE1 MET B 72 -5.636 6.490 -6.161 1.00 0.00 H new ATOM 0 HE2 MET B 72 -4.614 7.544 -5.155 1.00 0.00 H new ATOM 0 HE3 MET B 72 -6.166 6.945 -4.524 1.00 0.00 H new ATOM 2500 N ASP B 73 -4.525 11.883 -2.626 1.00 0.00 N ATOM 2501 CA ASP B 73 -3.127 11.864 -2.195 1.00 0.00 C ATOM 2502 C ASP B 73 -2.689 10.432 -1.922 1.00 0.00 C ATOM 2503 O ASP B 73 -3.396 9.676 -1.252 1.00 0.00 O ATOM 2504 CB ASP B 73 -2.929 12.718 -0.941 1.00 0.00 C ATOM 2505 CG ASP B 73 -3.067 14.210 -1.213 1.00 0.00 C ATOM 2506 OD1 ASP B 73 -2.132 14.794 -1.708 1.00 0.00 O ATOM 2507 OD2 ASP B 73 -4.107 14.752 -0.923 1.00 0.00 O ATOM 0 H ASP B 73 -5.166 11.406 -1.992 1.00 0.00 H new ATOM 0 HA ASP B 73 -2.516 12.283 -2.994 1.00 0.00 H new ATOM 0 HB2 ASP B 73 -3.658 12.422 -0.187 1.00 0.00 H new ATOM 0 HB3 ASP B 73 -1.942 12.519 -0.524 1.00 0.00 H new ATOM 2512 N VAL B 74 -1.520 10.061 -2.434 1.00 0.00 N ATOM 2513 CA VAL B 74 -0.988 8.715 -2.230 1.00 0.00 C ATOM 2514 C VAL B 74 0.444 8.779 -1.720 1.00 0.00 C ATOM 2515 O VAL B 74 1.243 9.589 -2.195 1.00 0.00 O ATOM 2516 CB VAL B 74 -1.028 7.912 -3.544 1.00 0.00 C ATOM 2517 CG1 VAL B 74 -0.261 8.640 -4.637 1.00 0.00 C ATOM 2518 CG2 VAL B 74 -0.456 6.521 -3.318 1.00 0.00 C ATOM 0 H VAL B 74 -0.923 10.671 -2.992 1.00 0.00 H new ATOM 0 HA VAL B 74 -1.611 8.216 -1.487 1.00 0.00 H new ATOM 0 HB VAL B 74 -2.064 7.814 -3.867 1.00 0.00 H new ATOM 0 HG11 VAL B 74 -0.300 8.058 -5.558 1.00 0.00 H new ATOM 0 HG12 VAL B 74 -0.710 9.619 -4.807 1.00 0.00 H new ATOM 0 HG13 VAL B 74 0.778 8.766 -4.331 1.00 0.00 H new ATOM 0 HG21 VAL B 74 -0.487 5.959 -4.251 1.00 0.00 H new ATOM 0 HG22 VAL B 74 0.576 6.603 -2.978 1.00 0.00 H new ATOM 0 HG23 VAL B 74 -1.047 6.003 -2.562 1.00 0.00 H new ATOM 2528 N LEU B 75 0.768 7.932 -0.741 1.00 0.00 N ATOM 2529 CA LEU B 75 2.129 7.884 -0.194 1.00 0.00 C ATOM 2530 C LEU B 75 2.797 6.564 -0.573 1.00 0.00 C ATOM 2531 O LEU B 75 2.268 5.484 -0.310 1.00 0.00 O ATOM 2532 CB LEU B 75 2.105 8.038 1.332 1.00 0.00 C ATOM 2533 CG LEU B 75 3.464 7.929 2.034 1.00 0.00 C ATOM 2534 CD1 LEU B 75 4.349 9.094 1.610 1.00 0.00 C ATOM 2535 CD2 LEU B 75 3.259 7.919 3.541 1.00 0.00 C ATOM 0 H LEU B 75 0.115 7.275 -0.313 1.00 0.00 H new ATOM 0 HA LEU B 75 2.700 8.710 -0.617 1.00 0.00 H new ATOM 0 HB2 LEU B 75 1.669 9.007 1.574 1.00 0.00 H new ATOM 0 HB3 LEU B 75 1.442 7.278 1.745 1.00 0.00 H new ATOM 0 HG LEU B 75 3.957 7.000 1.749 1.00 0.00 H new ATOM 0 HD11 LEU B 75 5.315 9.017 2.109 1.00 0.00 H new ATOM 0 HD12 LEU B 75 4.495 9.066 0.530 1.00 0.00 H new ATOM 0 HD13 LEU B 75 3.871 10.034 1.887 1.00 0.00 H new ATOM 0 HD21 LEU B 75 4.225 7.841 4.039 1.00 0.00 H new ATOM 0 HD22 LEU B 75 2.766 8.842 3.847 1.00 0.00 H new ATOM 0 HD23 LEU B 75 2.639 7.067 3.818 1.00 0.00 H new ATOM 2547 N GLU B 76 3.974 6.679 -1.181 1.00 0.00 N ATOM 2548 CA GLU B 76 4.731 5.507 -1.607 1.00 0.00 C ATOM 2549 C GLU B 76 5.890 5.283 -0.648 1.00 0.00 C ATOM 2550 O GLU B 76 6.716 6.179 -0.436 1.00 0.00 O ATOM 2551 CB GLU B 76 5.250 5.679 -3.036 1.00 0.00 C ATOM 2552 CG GLU B 76 6.003 4.474 -3.581 1.00 0.00 C ATOM 2553 CD GLU B 76 6.535 4.695 -4.969 1.00 0.00 C ATOM 2554 OE1 GLU B 76 6.437 5.797 -5.454 1.00 0.00 O ATOM 2555 OE2 GLU B 76 7.039 3.761 -5.547 1.00 0.00 O ATOM 0 H GLU B 76 4.423 7.571 -1.389 1.00 0.00 H new ATOM 0 HA GLU B 76 4.073 4.638 -1.594 1.00 0.00 H new ATOM 0 HB2 GLU B 76 4.407 5.892 -3.693 1.00 0.00 H new ATOM 0 HB3 GLU B 76 5.907 6.548 -3.069 1.00 0.00 H new ATOM 0 HG2 GLU B 76 6.831 4.237 -2.913 1.00 0.00 H new ATOM 0 HG3 GLU B 76 5.340 3.609 -3.585 1.00 0.00 H new ATOM 2562 N LEU B 77 5.938 4.090 -0.060 1.00 0.00 N ATOM 2563 CA LEU B 77 7.026 3.716 0.846 1.00 0.00 C ATOM 2564 C LEU B 77 7.738 2.480 0.318 1.00 0.00 C ATOM 2565 O LEU B 77 7.221 1.367 0.412 1.00 0.00 O ATOM 2566 CB LEU B 77 6.488 3.446 2.257 1.00 0.00 C ATOM 2567 CG LEU B 77 5.678 4.586 2.889 1.00 0.00 C ATOM 2568 CD1 LEU B 77 5.073 4.111 4.203 1.00 0.00 C ATOM 2569 CD2 LEU B 77 6.581 5.791 3.106 1.00 0.00 C ATOM 0 H LEU B 77 5.235 3.363 -0.194 1.00 0.00 H new ATOM 0 HA LEU B 77 7.733 4.544 0.898 1.00 0.00 H new ATOM 0 HB2 LEU B 77 5.861 2.555 2.223 1.00 0.00 H new ATOM 0 HB3 LEU B 77 7.331 3.218 2.910 1.00 0.00 H new ATOM 0 HG LEU B 77 4.867 4.880 2.223 1.00 0.00 H new ATOM 0 HD11 LEU B 77 4.498 4.920 4.652 1.00 0.00 H new ATOM 0 HD12 LEU B 77 4.418 3.261 4.015 1.00 0.00 H new ATOM 0 HD13 LEU B 77 5.870 3.812 4.883 1.00 0.00 H new ATOM 0 HD21 LEU B 77 6.006 6.601 3.555 1.00 0.00 H new ATOM 0 HD22 LEU B 77 7.401 5.517 3.770 1.00 0.00 H new ATOM 0 HD23 LEU B 77 6.985 6.120 2.149 1.00 0.00 H new ATOM 2581 N ASN B 78 8.936 2.684 -0.231 1.00 0.00 N ATOM 2582 CA ASN B 78 9.731 1.586 -0.775 1.00 0.00 C ATOM 2583 C ASN B 78 10.855 1.233 0.191 1.00 0.00 C ATOM 2584 O ASN B 78 11.671 2.086 0.537 1.00 0.00 O ATOM 2585 CB ASN B 78 10.284 1.939 -2.143 1.00 0.00 C ATOM 2586 CG ASN B 78 9.202 2.180 -3.159 1.00 0.00 C ATOM 2587 OD1 ASN B 78 9.511 2.952 -4.169 1.00 0.00 O flip ATOM 2588 ND2 ASN B 78 8.086 1.665 -3.029 1.00 0.00 N flip ATOM 0 H ASN B 78 9.376 3.601 -0.310 1.00 0.00 H new ATOM 0 HA ASN B 78 9.086 0.716 -0.896 1.00 0.00 H new ATOM 0 HB2 ASN B 78 10.905 2.831 -2.061 1.00 0.00 H new ATOM 0 HB3 ASN B 78 10.929 1.132 -2.489 1.00 0.00 H new ATOM 0 HD21 ASN B 78 7.890 1.069 -2.225 1.00 0.00 H new ATOM 0 HD22 ASN B 78 7.361 1.836 -3.726 1.00 0.00 H new ATOM 2595 N ILE B 79 10.892 -0.020 0.639 1.00 0.00 N ATOM 2596 CA ILE B 79 11.812 -0.435 1.700 1.00 0.00 C ATOM 2597 C ILE B 79 12.736 -1.533 1.190 1.00 0.00 C ATOM 2598 O ILE B 79 12.276 -2.544 0.672 1.00 0.00 O ATOM 2599 CB ILE B 79 11.048 -0.934 2.940 1.00 0.00 C ATOM 2600 CG1 ILE B 79 10.131 0.167 3.481 1.00 0.00 C ATOM 2601 CG2 ILE B 79 12.021 -1.396 4.014 1.00 0.00 C ATOM 2602 CD1 ILE B 79 9.102 -0.328 4.471 1.00 0.00 C ATOM 0 H ILE B 79 10.296 -0.768 0.284 1.00 0.00 H new ATOM 0 HA ILE B 79 12.403 0.434 1.990 1.00 0.00 H new ATOM 0 HB ILE B 79 10.431 -1.784 2.648 1.00 0.00 H new ATOM 0 HG12 ILE B 79 10.742 0.933 3.958 1.00 0.00 H new ATOM 0 HG13 ILE B 79 9.618 0.643 2.645 1.00 0.00 H new ATOM 0 HG21 ILE B 79 11.464 -1.745 4.883 1.00 0.00 H new ATOM 0 HG22 ILE B 79 12.634 -2.209 3.625 1.00 0.00 H new ATOM 0 HG23 ILE B 79 12.664 -0.565 4.305 1.00 0.00 H new ATOM 0 HD11 ILE B 79 8.491 0.509 4.809 1.00 0.00 H new ATOM 0 HD12 ILE B 79 8.466 -1.073 3.993 1.00 0.00 H new ATOM 0 HD13 ILE B 79 9.607 -0.777 5.326 1.00 0.00 H new ATOM 2614 N THR B 80 14.044 -1.341 1.347 1.00 0.00 N ATOM 2615 CA THR B 80 15.015 -2.334 0.890 1.00 0.00 C ATOM 2616 C THR B 80 15.650 -3.002 2.101 1.00 0.00 C ATOM 2617 O THR B 80 16.211 -2.325 2.965 1.00 0.00 O ATOM 2618 CB THR B 80 16.103 -1.702 0.002 1.00 0.00 C ATOM 2619 OG1 THR B 80 15.497 -1.120 -1.160 1.00 0.00 O ATOM 2620 CG2 THR B 80 17.115 -2.752 -0.430 1.00 0.00 C ATOM 0 H THR B 80 14.454 -0.515 1.783 1.00 0.00 H new ATOM 0 HA THR B 80 14.492 -3.074 0.285 1.00 0.00 H new ATOM 0 HB THR B 80 16.617 -0.931 0.576 1.00 0.00 H new ATOM 0 HG1 THR B 80 16.190 -0.717 -1.723 1.00 0.00 H new ATOM 0 HG21 THR B 80 17.876 -2.287 -1.057 1.00 0.00 H new ATOM 0 HG22 THR B 80 17.586 -3.187 0.451 1.00 0.00 H new ATOM 0 HG23 THR B 80 16.609 -3.535 -0.994 1.00 0.00 H new ATOM 2628 N LEU B 81 15.554 -4.321 2.179 1.00 0.00 N ATOM 2629 CA LEU B 81 16.073 -5.037 3.335 1.00 0.00 C ATOM 2630 C LEU B 81 17.181 -6.011 2.902 1.00 0.00 C ATOM 2631 O LEU B 81 16.925 -6.898 2.070 1.00 0.00 O ATOM 2632 CB LEU B 81 14.943 -5.798 4.039 1.00 0.00 C ATOM 2633 CG LEU B 81 15.375 -6.712 5.193 1.00 0.00 C ATOM 2634 CD1 LEU B 81 15.922 -5.866 6.334 1.00 0.00 C ATOM 2635 CD2 LEU B 81 14.188 -7.547 5.651 1.00 0.00 C ATOM 2636 OXT LEU B 81 18.282 -5.912 3.367 1.00 0.00 O ATOM 0 H LEU B 81 15.127 -4.911 1.465 1.00 0.00 H new ATOM 0 HA LEU B 81 16.495 -4.315 4.034 1.00 0.00 H new ATOM 0 HB2 LEU B 81 14.226 -5.073 4.423 1.00 0.00 H new ATOM 0 HB3 LEU B 81 14.420 -6.402 3.298 1.00 0.00 H new ATOM 0 HG LEU B 81 16.162 -7.388 4.859 1.00 0.00 H new ATOM 0 HD11 LEU B 81 16.229 -6.515 7.154 1.00 0.00 H new ATOM 0 HD12 LEU B 81 16.781 -5.294 5.983 1.00 0.00 H new ATOM 0 HD13 LEU B 81 15.148 -5.182 6.683 1.00 0.00 H new ATOM 0 HD21 LEU B 81 14.495 -8.196 6.471 1.00 0.00 H new ATOM 0 HD22 LEU B 81 13.389 -6.888 5.990 1.00 0.00 H new ATOM 0 HD23 LEU B 81 13.829 -8.156 4.821 1.00 0.00 H new